#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u9o n ASP 23 N 0.00 0.00 0.00 1.61 8.00 -1.26 -4.10 116.55 120.80 1u9o n ASP 23 Ca 0.00 0.85 0.00 0.00 0.71 0.00 0.00 54.79 56.35 1u9o n ASP 23 Cb 0.00 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1u9o n ASP 23 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1u9o n ASP 24 N -1.74 0.00 -0.13 -2.24 9.92 -1.26 -0.49 116.55 120.62 1u9o n ASP 24 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 54.32 1u9o n ASP 24 Cb 0.00 0.00 0.12 0.00 -0.64 0.00 0.00 41.12 40.60 1u9o n ASP 24 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1u9o n ARG 25 N 0.00 -0.03 0.22 -1.24 1.74 -1.26 -0.06 116.66 116.03 1u9o n ARG 25 Ca 0.00 0.54 -0.15 0.00 -0.77 0.00 0.00 57.85 57.47 1u9o n ARG 25 Cb 0.00 -0.87 -0.08 0.00 -1.02 0.00 0.00 32.46 30.49 1u9o n ARG 25 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1u9o h GLU 26 N 0.00 -0.49 -0.92 5.56 4.81 -1.05 -2.72 114.58 119.76 1u9o h GLU 26 Ca 0.23 0.03 0.22 0.00 -0.13 0.00 0.00 59.36 59.71 1u9o h GLU 26 Cb 0.49 0.11 -0.12 0.00 0.63 0.00 0.00 28.75 29.86 1u9o h GLU 26 CO -0.34 -0.27 0.46 -0.07 -0.73 0.00 0.00 179.01 178.06 1u9o h LEU 27 N -0.62 0.46 -0.16 1.64 3.38 -0.65 0.14 115.31 119.49 1u9o h LEU 27 Ca -0.05 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1u9o h LEU 27 Cb 0.46 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 1u9o h LEU 27 CO 0.09 0.05 -0.17 0.00 0.09 0.00 0.00 178.44 178.50 1u9o h ALA 28 N 1.70 -0.08 0.29 1.53 0.00 -1.30 0.48 119.26 121.89 1u9o h ALA 28 Ca 0.58 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.53 1u9o h ALA 28 Cb 1.07 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1u9o h ALA 28 CO -0.49 -0.61 -0.14 0.82 0.00 0.00 0.00 179.25 178.82 1u9o h ILE 29 N -0.20 0.74 0.21 0.00 2.04 -0.52 0.11 117.51 119.88 1u9o h ILE 29 Ca 0.11 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1u9o h ILE 29 Cb 0.36 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 1u9o h ILE 29 CO -0.28 0.04 -0.36 -0.07 0.00 0.00 0.00 178.15 177.49 1u9o h LEU 30 N -0.50 -1.03 -0.81 1.44 3.38 -0.79 -1.89 115.31 115.10 1u9o h LEU 30 Ca -0.04 0.10 0.19 0.00 0.09 0.00 0.00 57.88 58.22 1u9o h LEU 30 Cb 0.38 0.36 -0.12 0.00 0.09 0.00 0.00 40.66 41.36 1u9o h LEU 30 CO 0.07 -0.42 0.22 0.00 0.09 0.00 0.00 178.44 178.40 1u9o h ALA 31 N -1.01 1.13 -0.67 1.53 0.00 -0.02 -1.35 119.26 118.86 1u9o h ALA 31 Ca -0.02 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1u9o h ALA 31 Cb 0.56 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1u9o h ALA 31 CO -0.12 -0.38 0.39 1.15 0.00 0.00 0.00 179.25 180.29 1u9o h THR 32 N 0.27 1.00 0.41 0.00 2.02 -0.22 -2.81 112.91 113.58 1u9o h THR 32 Ca 0.48 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1u9o h THR 32 Cb 0.89 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1u9o h THR 32 CO -0.57 0.13 -0.22 0.00 0.37 0.00 0.00 175.52 175.23 1u9o h ALA 33 N 1.33 -1.12 -0.06 6.16 0.00 -0.47 -2.70 119.26 122.41 1u9o h ALA 33 Ca 0.29 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1u9o h ALA 33 Cb 0.14 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1u9o h ALA 33 CO -0.16 -1.08 0.72 1.49 0.00 0.00 0.00 179.25 180.21 1u9o h GLU 34 N -0.58 0.00 -0.46 0.00 4.81 -1.43 0.86 114.58 117.77 1u9o h GLU 34 Ca -0.06 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 1u9o h GLU 34 Cb 0.46 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.79 1u9o h GLU 34 CO 0.07 0.00 0.06 0.09 -0.73 0.00 0.00 179.01 178.51 1u9o n ASN 35 N -2.73 4.39 0.00 1.04 5.03 -1.03 -3.85 115.26 118.11 1u9o n ASN 35 Ca 0.00 -3.14 0.00 0.00 0.87 0.00 0.00 54.58 52.31 1u9o n ASN 35 Cb 0.76 -0.64 0.00 0.00 -1.02 0.00 0.00 39.78 38.88 1u9o n ASN 35 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1u9o n LEU 36 N -0.25 0.00 0.06 3.41 4.77 0.28 -4.70 117.00 120.57 1u9o n LEU 36 Ca 0.29 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 1u9o n LEU 36 Cb 1.11 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.66 1u9o n LEU 36 CO 0.27 0.00 0.86 0.18 -1.33 0.00 0.00 177.39 177.37 1u9o n LEU 37 N -0.58 0.36 -0.00 2.23 4.77 -0.30 -2.24 117.00 121.23 1u9o n LEU 37 Ca 0.00 0.56 0.14 0.00 -0.03 0.00 0.00 56.01 56.68 1u9o n LEU 37 Cb 0.01 -0.47 0.65 0.00 -2.33 0.00 0.00 43.42 41.28 1u9o n LEU 37 CO 0.00 -0.23 0.96 1.21 -1.33 0.00 0.00 177.39 178.00 1u9o n GLU 38 N -1.86 0.15 -0.01 3.23 4.07 -1.26 -3.89 120.64 121.07 1u9o n GLU 38 Ca 0.05 -0.01 0.01 0.00 -0.06 0.00 0.00 57.16 57.15 1u9o n GLU 38 Cb 0.30 -1.50 -0.04 0.00 -0.06 0.00 0.00 31.44 30.13 1u9o n GLU 38 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1u9o n ASP 39 N -1.42 3.70 -3.61 4.31 8.00 -0.95 -5.09 116.55 121.50 1u9o n ASP 39 Ca 0.09 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.51 1u9o n ASP 39 Cb 0.31 1.01 -0.02 0.00 -0.02 0.00 0.00 41.12 42.40 1u9o n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u9o s ARG 40 N -2.29 1.24 0.36 -1.24 3.03 -1.15 -5.16 118.95 113.74 1u9o s ARG 40 Ca -0.02 -0.57 -0.06 0.00 2.03 0.00 0.00 55.73 57.10 1u9o s ARG 40 Cb 0.03 0.50 0.09 0.00 -1.03 0.00 0.00 34.95 34.53 1u9o s ARG 40 CO 0.23 -0.55 0.37 -0.35 -1.13 0.00 0.00 175.30 173.86 1u9o n PRO 41 N -0.38 -1.26 0.22 3.89 -0.04 -1.26 -4.29 135.00 131.88 1u9o n PRO 41 Ca -0.10 -0.58 0.08 0.00 -0.04 0.00 0.00 63.50 62.86 1u9o n PRO 41 Cb 0.62 -0.48 0.50 0.00 -0.04 0.00 0.00 33.50 34.10 1u9o n PRO 41 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1u9o h LEU 42 N 0.00 0.00 0.06 1.53 5.85 -1.95 -3.18 115.31 117.62 1u9o h LEU 42 Ca -0.13 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1u9o h LEU 42 Cb 0.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1u9o h LEU 42 CO 0.09 0.26 -0.03 0.00 -0.34 0.00 0.00 178.44 178.42 1u9o h ALA 43 N 1.74 -0.08 0.00 1.25 0.00 -2.03 -2.83 119.26 117.30 1u9o h ALA 43 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1u9o h ALA 43 Cb 0.58 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1u9o h ALA 43 CO 0.03 -0.39 0.00 -0.25 0.00 0.00 0.00 179.25 178.65 1u9o n ASP 44 N -4.98 0.00 -4.36 0.00 10.43 -1.20 -4.54 116.55 111.90 1u9o n ASP 44 Ca -0.08 -0.31 -0.32 0.00 2.57 0.00 0.00 54.79 56.65 1u9o n ASP 44 Cb 0.19 0.00 -0.15 0.00 1.84 0.00 0.00 41.12 43.00 1u9o n ASP 44 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1u9o s ILE 45 N -2.00 2.62 0.12 0.53 1.01 -1.07 -5.01 121.20 117.40 1u9o s ILE 45 Ca 0.08 -0.86 0.10 0.00 0.00 0.00 0.00 60.65 59.97 1u9o s ILE 45 Cb 0.03 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1u9o s ILE 45 CO 0.06 0.57 -0.26 -0.94 0.00 0.00 0.00 174.94 174.36 1u9o s SER 46 N -0.26 3.21 0.59 3.58 1.04 -1.26 -4.95 113.70 115.65 1u9o s SER 46 Ca 0.01 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1u9o s SER 46 Cb -0.13 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.77 1u9o s SER 46 CO 0.03 0.18 0.95 0.52 0.98 0.00 0.00 173.24 175.89 1u9o n VAL 47 N 1.04 0.00 -0.01 5.02 0.31 -1.26 -0.11 118.33 123.32 1u9o n VAL 47 Ca -0.18 0.95 -0.21 0.00 -0.01 0.00 0.00 64.34 64.88 1u9o n VAL 47 Cb 0.53 -1.94 -0.14 0.00 -0.91 0.00 0.00 33.84 31.38 1u9o n VAL 47 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1u9o h ASP 48 N 0.00 0.34 0.00 4.52 3.58 -1.94 -3.24 116.42 119.68 1u9o h ASP 48 Ca 0.00 -0.83 0.00 0.00 0.42 0.00 0.00 57.03 56.62 1u9o h ASP 48 Cb 1.89 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.83 1u9o h ASP 48 CO 0.00 1.65 0.42 0.44 -2.88 0.00 0.00 179.24 178.87 1u9o h ASP 49 N -0.32 0.00 0.50 2.28 3.45 -0.92 0.96 116.42 122.38 1u9o h ASP 49 Ca -0.33 0.00 -0.27 0.00 0.43 0.00 0.00 57.03 56.85 1u9o h ASP 49 Cb 1.76 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 40.48 1u9o h ASP 49 CO 0.03 0.00 -1.69 0.18 -1.57 0.00 0.00 179.24 176.19 1u9o n LEU 50 N -2.77 0.83 -0.27 1.55 4.77 -1.23 -4.03 117.00 115.86 1u9o n LEU 50 Ca -0.02 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1u9o n LEU 50 Cb 0.46 0.17 0.13 0.00 -2.33 0.00 0.00 43.42 41.85 1u9o n LEU 50 CO 0.11 0.35 1.13 0.00 -1.33 0.00 0.00 177.39 177.65 1u9o h ALA 51 N 1.07 1.05 0.02 -1.18 0.00 0.95 -2.77 119.26 118.40 1u9o h ALA 51 Ca -0.28 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1u9o h ALA 51 Cb 1.95 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1u9o h ALA 51 CO 0.07 0.11 -0.01 0.87 0.00 0.00 0.00 179.25 180.29 1u9o h LYS 52 N 0.78 -0.02 -0.52 0.00 1.57 -1.70 -1.17 116.57 115.50 1u9o h LYS 52 Ca 0.35 0.00 0.21 0.00 -1.87 0.00 0.00 60.65 59.34 1u9o h LYS 52 Cb 0.24 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.47 1u9o h LYS 52 CO -0.20 -0.02 0.29 0.41 -0.57 0.00 0.00 179.45 179.36 1u9o n GLY 53 N -0.49 -0.38 0.13 3.86 0.00 -1.16 0.78 105.19 107.93 1u9o n GLY 53 Ca -0.00 0.39 -0.22 0.00 0.00 0.00 0.00 46.02 46.19 1u9o n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9o h ALA 54 N 0.94 0.27 0.00 4.61 0.00 -1.51 -3.47 119.26 120.11 1u9o h ALA 54 Ca 0.42 -1.21 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1u9o h ALA 54 Cb 1.15 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1u9o h ALA 54 CO -0.35 0.95 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1u9o n GLY 55 N 1.76 0.95 3.14 0.00 0.00 0.23 -4.96 105.19 106.31 1u9o n GLY 55 Ca -0.29 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 1u9o n GLY 55 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u9o s ILE 56 N -1.77 0.48 0.42 -0.61 -5.25 -0.75 -5.05 121.20 108.66 1u9o s ILE 56 Ca 0.00 -1.88 -0.24 0.00 -0.99 0.00 0.00 60.65 57.54 1u9o s ILE 56 Cb 0.00 -1.64 -0.08 0.00 2.95 0.00 0.00 42.46 43.69 1u9o s ILE 56 CO 0.00 -0.91 1.12 -0.94 -1.79 0.00 0.00 174.94 172.43 1u9o s SER 57 N -3.00 6.47 0.19 4.36 1.04 -1.26 -4.38 113.70 117.12 1u9o s SER 57 Ca 0.10 2.21 -0.06 0.00 0.48 0.00 0.00 55.95 58.69 1u9o s SER 57 Cb 0.06 -2.60 0.31 0.00 0.10 0.00 0.00 66.02 63.89 1u9o s SER 57 CO -0.07 -0.71 1.05 -1.14 0.98 0.00 0.00 173.24 173.36 1u9o n ARG 58 N -0.21 -0.06 -0.18 4.02 0.63 -1.26 0.05 116.66 119.65 1u9o n ARG 58 Ca 0.06 1.05 -0.10 0.00 -0.92 0.00 0.00 57.85 57.94 1u9o n ARG 58 Cb 0.48 -1.57 0.01 0.00 0.45 0.00 0.00 32.46 31.83 1u9o n ARG 58 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1u9o h PRO 59 N 0.00 0.95 -0.93 -0.14 0.13 -1.97 -3.18 132.00 126.86 1u9o h PRO 59 Ca 0.32 -0.32 0.22 0.00 -0.87 0.00 0.00 66.00 65.35 1u9o h PRO 59 Cb 0.49 -0.08 -0.17 0.00 0.13 0.00 0.00 31.00 31.37 1u9o h PRO 59 CO -0.70 0.98 -0.09 1.15 -0.23 0.00 0.00 178.00 179.12 1u9o h THR 60 N 0.82 0.09 -0.26 1.56 2.02 -0.73 -1.83 112.91 114.58 1u9o h THR 60 Ca 0.14 -0.01 0.02 0.00 0.77 0.00 0.00 66.41 67.34 1u9o h THR 60 Cb 0.58 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1u9o h THR 60 CO 0.03 0.00 -0.15 0.33 0.37 0.00 0.00 175.52 176.10 1u9o n PHE 61 N -5.51 -0.12 0.00 3.16 -0.00 -1.20 -1.12 117.46 112.67 1u9o n PHE 61 Ca 0.18 0.33 0.00 0.00 -0.00 0.00 0.00 57.45 57.96 1u9o n PHE 61 Cb 0.59 -0.41 0.00 0.00 -0.00 0.00 0.00 39.48 39.66 1u9o n PHE 61 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1u9o n TYR 62 N -3.53 0.00 1.04 -5.13 4.01 -0.69 -0.38 117.16 112.49 1u9o n TYR 62 Ca 0.01 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.86 1u9o n TYR 62 Cb 0.07 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.15 1u9o n TYR 62 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1u9o n PHE 63 N -0.57 0.00 0.00 -0.72 3.01 -0.28 -4.30 117.46 114.60 1u9o n PHE 63 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1u9o n PHE 63 Cb 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.45 1u9o n PHE 63 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1u9o n TYR 64 N -0.24 0.00 -3.74 1.38 4.02 0.48 -5.04 117.16 114.02 1u9o n TYR 64 Ca 0.09 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.86 1u9o n TYR 64 Cb 0.44 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.63 1u9o n TYR 64 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1u9o s PHE 65 N -1.83 -0.31 0.36 -0.72 0.40 -1.16 -5.02 117.98 109.70 1u9o s PHE 65 Ca 0.00 0.74 0.11 0.00 -0.60 0.00 0.00 56.93 57.18 1u9o s PHE 65 Cb 0.00 0.05 0.68 0.00 0.51 0.00 0.00 43.02 44.26 1u9o s PHE 65 CO 0.00 -0.21 1.82 -1.00 0.70 0.00 0.00 175.22 176.53 1u9o h PRO 66 N 6.96 0.11 -2.07 0.24 0.13 -1.90 -3.34 132.00 132.13 1u9o h PRO 66 Ca -0.38 -0.04 0.20 0.00 -0.87 0.00 0.00 66.00 64.91 1u9o h PRO 66 Cb 1.16 -0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.17 1u9o h PRO 66 CO 0.38 0.42 0.59 -1.54 -0.23 0.00 0.00 178.00 177.62 1u9o s SER 67 N -6.91 -0.19 0.45 1.44 1.04 -1.26 -4.98 113.70 103.29 1u9o s SER 67 Ca -0.04 -0.22 0.16 0.00 0.48 0.00 0.00 55.95 56.33 1u9o s SER 67 Cb 0.14 0.37 1.10 0.00 0.10 0.00 0.00 66.02 67.73 1u9o s SER 67 CO 0.74 -0.66 1.98 0.07 0.98 0.00 0.00 173.24 176.35 1u9o h LYS 68 N 2.00 0.32 -0.14 4.02 2.10 -1.98 -0.33 116.57 122.55 1u9o h LYS 68 Ca -0.24 -0.02 0.05 0.00 -2.00 0.00 0.00 60.65 58.44 1u9o h LYS 68 Cb 1.22 -0.07 -0.05 0.00 -0.90 0.00 0.00 32.23 32.43 1u9o h LYS 68 CO 0.27 0.21 -0.18 0.93 -2.00 0.00 0.00 179.45 178.68 1u9o h GLU 69 N 0.33 -0.22 0.00 0.07 3.07 -1.98 -0.58 114.58 115.28 1u9o h GLU 69 Ca 0.27 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 1u9o h GLU 69 Cb 0.62 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 1u9o h GLU 69 CO -0.07 -0.14 0.00 0.00 -1.40 0.00 0.00 179.01 177.40 1u9o n ALA 70 N -2.64 1.35 -0.04 3.43 0.00 -0.15 -2.25 120.51 120.22 1u9o n ALA 70 Ca -0.03 -0.02 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 1u9o n ALA 70 Cb 0.24 -1.10 -0.13 0.00 0.00 0.00 0.00 19.45 18.46 1u9o n ALA 70 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u9o h VAL 71 N 0.00 1.20 -0.92 0.00 2.07 -0.99 -3.18 116.25 114.43 1u9o h VAL 71 Ca 0.00 -2.32 0.07 0.00 0.82 0.00 0.00 66.70 65.26 1u9o h VAL 71 Cb 0.09 2.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.54 1u9o h VAL 71 CO 0.00 0.56 0.58 0.25 0.02 0.00 0.00 177.57 178.98 1u9o h LEU 72 N -0.69 0.92 -0.87 2.57 5.85 -1.16 0.16 115.31 122.09 1u9o h LEU 72 Ca -0.24 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1u9o h LEU 72 Cb 1.43 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 1u9o h LEU 72 CO -0.04 0.58 0.54 0.25 -0.34 0.00 0.00 178.44 179.44 1u9o h LEU 73 N 1.05 0.87 -0.33 2.25 5.85 -1.62 0.57 115.31 123.95 1u9o h LEU 73 Ca 0.40 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 59.01 1u9o h LEU 73 Cb 0.19 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1u9o h LEU 73 CO -0.18 0.57 -0.26 0.74 -0.34 0.00 0.00 178.44 178.96 1u9o h THR 74 N 1.01 1.29 0.13 1.05 2.02 -1.12 -0.11 112.91 117.18 1u9o h THR 74 Ca 0.37 -1.42 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 1u9o h THR 74 Cb 0.13 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1u9o h THR 74 CO -0.16 0.46 -0.15 -0.07 0.37 0.00 0.00 175.52 175.97 1u9o h LEU 75 N 0.54 -0.43 -0.98 2.58 3.38 0.41 -0.09 115.31 120.72 1u9o h LEU 75 Ca 0.06 0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1u9o h LEU 75 Cb 0.83 0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.60 1u9o h LEU 75 CO 0.07 -0.19 -0.53 -0.11 0.09 0.00 0.00 178.44 177.77 1u9o n LEU 76 N -3.26 -0.94 -0.29 1.67 0.00 0.19 0.04 117.00 114.41 1u9o n LEU 76 Ca -0.03 1.73 0.07 0.00 0.00 0.00 0.00 56.01 57.77 1u9o n LEU 76 Cb 0.14 -0.27 0.22 0.00 0.00 0.00 0.00 43.42 43.51 1u9o n LEU 76 CO 0.07 -1.45 1.10 -0.78 0.00 0.00 0.00 177.39 176.33 1u9o h ASP 77 N 0.00 0.52 0.34 1.96 1.82 -0.80 0.11 116.42 120.38 1u9o h ASP 77 Ca 0.20 0.09 -0.00 0.00 -0.39 0.00 0.00 57.03 56.93 1u9o h ASP 77 Cb 0.45 0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 1u9o h ASP 77 CO -0.93 0.23 -0.43 0.03 -1.61 0.00 0.00 179.24 176.53 1u9o h ARG 78 N 0.63 -0.78 -0.99 0.28 2.47 0.16 0.64 114.38 116.78 1u9o h ARG 78 Ca 0.45 0.05 0.10 0.00 -1.26 0.00 0.00 59.98 59.33 1u9o h ARG 78 Cb 0.63 0.18 -0.08 0.00 -1.65 0.00 0.00 29.97 29.04 1u9o h ARG 78 CO -0.35 -0.52 0.62 0.28 0.56 0.00 0.00 179.97 180.56 1u9o h VAL 79 N -0.81 0.96 -0.37 2.04 2.07 -0.26 0.24 116.25 120.11 1u9o h VAL 79 Ca -0.02 -0.35 -0.16 0.00 0.82 0.00 0.00 66.70 66.98 1u9o h VAL 79 Cb 0.75 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1u9o h VAL 79 CO -0.12 0.19 -0.40 0.58 0.02 0.00 0.00 177.57 177.84 1u9o h VAL 80 N 1.03 1.27 -0.35 2.57 2.07 -0.51 -3.10 116.25 119.23 1u9o h VAL 80 Ca 0.47 -1.58 -0.13 0.00 0.82 0.00 0.00 66.70 66.29 1u9o h VAL 80 Cb 0.40 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1u9o h VAL 80 CO -0.24 0.53 -0.29 0.78 0.02 0.00 0.00 177.57 178.37 1u9o h ASN 81 N 0.75 0.77 -0.89 0.57 2.35 0.02 -2.53 115.58 116.62 1u9o h ASN 81 Ca 0.06 -0.30 0.17 0.00 -0.55 0.00 0.00 56.30 55.67 1u9o h ASN 81 Cb 1.00 -0.21 -0.10 0.00 0.05 0.00 0.00 38.32 39.05 1u9o h ASN 81 CO 0.10 1.01 0.47 -0.61 -1.65 0.00 0.00 177.43 176.75 1u9o h GLN 82 N 0.64 0.60 -0.03 0.81 4.15 -0.92 0.34 115.11 120.70 1u9o h GLN 82 Ca 0.08 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 1u9o h GLN 82 Cb 0.81 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 1u9o h GLN 82 CO 0.07 0.40 0.01 0.00 -1.93 0.00 0.00 178.83 177.37 1u9o h ALA 83 N 1.60 0.04 0.32 3.38 0.00 -1.40 0.37 119.26 123.58 1u9o h ALA 83 Ca 0.50 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 1u9o h ALA 83 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1u9o h ALA 83 CO -0.39 -0.34 -0.15 0.22 0.00 0.00 0.00 179.25 178.58 1u9o h ASP 84 N -0.18 -0.37 -0.81 0.00 1.82 -0.88 0.23 116.42 116.23 1u9o h ASP 84 Ca 0.01 -0.01 0.11 0.00 -0.39 0.00 0.00 57.03 56.75 1u9o h ASP 84 Cb 0.24 0.09 -0.06 0.00 0.68 0.00 0.00 39.33 40.29 1u9o h ASP 84 CO 0.00 -0.24 0.53 0.24 -1.61 0.00 0.00 179.24 178.16 1u9o h MET 85 N -0.46 0.67 0.25 0.28 2.86 -0.34 0.63 114.93 118.82 1u9o h MET 85 Ca -0.04 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1u9o h MET 85 Cb 0.35 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1u9o h MET 85 CO 0.07 0.45 -0.12 0.00 1.06 0.00 0.00 176.91 178.37 1u9o h ALA 86 N 1.60 -0.86 -0.77 6.32 0.00 0.36 -2.52 119.26 123.39 1u9o h ALA 86 Ca 0.38 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.37 1u9o h ALA 86 Cb 0.54 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1u9o h ALA 86 CO -0.15 -0.84 0.52 1.25 0.00 0.00 0.00 179.25 180.02 1u9o h LEU 87 N -0.42 0.39 -0.03 0.00 6.46 -0.27 -0.27 115.31 121.18 1u9o h LEU 87 Ca -0.03 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.78 1u9o h LEU 87 Cb 0.26 -0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.09 1u9o h LEU 87 CO 0.06 0.20 -0.25 -0.61 -0.62 0.00 0.00 178.44 177.22 1u9o h GLN 88 N 0.42 -0.36 -1.14 1.25 4.15 0.27 -0.10 115.11 119.60 1u9o h GLN 88 Ca 0.38 0.02 0.33 0.00 0.77 0.00 0.00 58.65 60.16 1u9o h GLN 88 Cb 0.88 0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.61 1u9o h GLN 88 CO -0.12 -0.24 0.84 1.15 -1.93 0.00 0.00 178.83 178.53 1u9o h THR 89 N -0.37 0.39 0.00 2.39 2.02 -0.58 1.30 112.91 118.07 1u9o h THR 89 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1u9o h THR 89 Cb 0.47 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1u9o h THR 89 CO -0.24 0.00 -0.06 -0.07 0.37 0.00 0.00 175.52 175.52 1u9o h LEU 90 N 0.00 0.00 -0.03 2.58 3.38 -0.99 -2.87 115.31 117.38 1u9o h LEU 90 Ca 0.54 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.50 1u9o h LEU 90 Cb 2.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.97 1u9o h LEU 90 CO -0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1u9o n ALA 91 N -1.95 2.08 -1.60 1.53 0.00 0.45 -4.49 120.51 116.53 1u9o n ALA 91 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1u9o n ALA 91 Cb 0.48 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1u9o n ALA 91 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u9o n GLU 92 N -1.57 0.00 -1.67 0.00 1.02 -1.08 -4.96 120.64 112.37 1u9o n GLU 92 Ca 0.06 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.77 1u9o n GLU 92 Cb 0.28 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.67 1u9o n GLU 92 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1u9o n ASN 93 N 0.00 4.06 -4.82 1.62 4.13 -1.24 -4.98 115.26 114.03 1u9o n ASN 93 Ca 0.00 0.94 -0.31 0.00 1.68 0.00 0.00 54.58 56.89 1u9o n ASN 93 Cb 0.00 -1.52 0.06 0.00 -1.54 0.00 0.00 39.78 36.78 1u9o n ASN 93 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 1u9o s PRO 94 N 3.81 2.67 -0.24 3.52 0.02 -1.26 -4.76 135.00 138.76 1u9o s PRO 94 Ca 0.87 0.85 -0.01 0.00 0.02 0.00 0.00 61.00 62.72 1u9o s PRO 94 Cb -0.48 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.10 1u9o s PRO 94 CO 0.41 -1.26 -0.09 0.00 -0.33 0.00 0.00 177.00 175.74 1u9o s ALA 95 N -3.08 2.64 -0.88 -1.55 0.00 -1.26 -5.04 121.76 112.58 1u9o s ALA 95 Ca 0.59 -1.42 -0.27 0.00 0.00 0.00 0.00 51.96 50.86 1u9o s ALA 95 Cb -0.14 -1.60 -0.25 0.00 0.00 0.00 0.00 23.12 21.13 1u9o s ALA 95 CO 0.55 -0.73 2.00 -3.47 0.00 0.00 0.00 175.76 174.11 1u9o n ASP 96 N 4.66 1.43 -3.57 0.00 2.03 -1.26 -4.77 116.55 115.07 1u9o n ASP 96 Ca -0.17 -2.51 -0.15 0.00 0.52 0.00 0.00 54.79 52.48 1u9o n ASP 96 Cb 0.47 -1.49 -0.06 0.00 -0.72 0.00 0.00 41.12 39.32 1u9o n ASP 96 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1u9o s THR 97 N 14.74 0.00 0.19 5.18 -1.32 -1.26 -5.18 115.64 127.99 1u9o s THR 97 Ca 0.78 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 61.24 1u9o s THR 97 Cb -0.00 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.01 1u9o s THR 97 CO 0.21 0.00 0.05 -0.90 -2.21 0.00 0.00 174.62 171.77 1u9o n ASP 98 N 1.39 -0.96 0.16 8.08 5.68 -1.26 -4.63 116.55 125.00 1u9o n ASP 98 Ca -0.15 -0.05 0.04 0.00 -0.50 0.00 0.00 54.79 54.12 1u9o n ASP 98 Cb 0.57 -0.17 0.14 0.00 -1.14 0.00 0.00 41.12 40.52 1u9o n ASP 98 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1u9o h ARG 99 N 0.00 0.00 0.00 0.11 0.11 -2.00 -3.08 114.38 109.52 1u9o h ARG 99 Ca -0.02 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.00 1u9o h ARG 99 Cb 0.07 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.15 1u9o h ARG 99 CO 0.01 0.47 -0.28 1.49 0.10 0.00 0.00 179.97 181.76 1u9o h GLU 100 N 0.00 0.00 0.08 0.08 4.81 -2.01 -3.05 114.58 114.49 1u9o h GLU 100 Ca -0.00 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 58.91 1u9o h GLU 100 Cb 1.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1u9o h GLU 100 CO 0.06 0.28 -1.68 -0.91 -0.73 0.00 0.00 179.01 176.03 1u9o h ASN 101 N 0.00 0.27 -0.79 1.04 4.21 -1.88 -1.86 115.58 116.58 1u9o h ASN 101 Ca -0.00 -0.47 0.22 0.00 1.21 0.00 0.00 56.30 57.25 1u9o h ASN 101 Cb 0.57 -0.09 -0.04 0.00 -1.12 0.00 0.00 38.32 37.65 1u9o h ASN 101 CO 0.04 1.41 0.56 -0.03 -1.29 0.00 0.00 177.43 178.11 1u9o h MET 102 N 0.05 0.07 0.00 0.81 4.05 -1.44 0.14 114.93 118.61 1u9o h MET 102 Ca -0.29 -0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.05 1u9o h MET 102 Cb 2.01 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 32.78 1u9o h MET 102 CO 0.12 0.05 -0.74 0.91 0.23 0.00 0.00 176.91 177.48 1u9o n TRP 103 N -4.34 0.96 -0.23 1.39 7.02 -1.20 -4.12 117.44 116.92 1u9o n TRP 103 Ca 0.16 0.42 -0.11 0.00 -1.02 0.00 0.00 57.50 56.95 1u9o n TRP 103 Cb 0.81 -0.87 -0.07 0.00 -2.42 0.00 0.00 31.31 28.75 1u9o n TRP 103 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 1u9o h ARG 104 N -1.00 -0.23 -0.17 -0.99 2.43 -0.99 0.85 114.38 114.28 1u9o h ARG 104 Ca -0.11 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.13 1u9o h ARG 104 Cb 0.75 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 1u9o h ARG 104 CO -0.07 -0.16 0.46 1.79 -1.51 0.00 0.00 179.97 180.49 1u9o h THR 105 N -0.24 0.11 0.00 0.20 1.35 -0.95 -0.30 112.91 113.08 1u9o h THR 105 Ca 0.14 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.96 1u9o h THR 105 Cb 0.55 0.58 -0.00 0.00 -1.73 0.00 0.00 68.15 67.54 1u9o h THR 105 CO -0.71 0.00 -0.20 1.23 -0.25 0.00 0.00 175.52 175.59 1u9o h GLY 106 N 0.00 0.01 1.12 5.82 0.00 -0.99 -3.27 103.07 105.76 1u9o h GLY 106 Ca 0.08 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.41 1u9o h GLY 106 CO -0.00 0.02 0.55 -2.22 0.00 0.00 0.00 176.54 174.89 1u9o h ILE 107 N -0.99 1.17 0.00 2.60 2.04 -0.99 -1.05 117.51 120.30 1u9o h ILE 107 Ca -0.05 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 1u9o h ILE 107 Cb 1.06 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1u9o h ILE 107 CO -0.03 0.20 -0.02 -1.13 0.00 0.00 0.00 178.15 177.17 1u9o h ASN 108 N 1.08 0.00 0.74 1.72 -0.00 -1.19 0.33 115.58 118.25 1u9o h ASN 108 Ca 0.32 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.59 1u9o h ASN 108 Cb -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.27 1u9o h ASN 108 CO -0.08 0.02 -0.47 0.58 -0.00 0.00 0.00 177.43 177.48 1u9o h VAL 109 N 0.00 0.06 -0.48 2.57 2.07 -1.23 0.85 116.25 120.10 1u9o h VAL 109 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1u9o h VAL 109 Cb 0.05 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 29.85 1u9o h VAL 109 CO 0.00 0.00 0.27 -0.26 0.02 0.00 0.00 177.57 177.60 1u9o h PHE 110 N -1.14 0.50 0.44 1.57 -1.00 -1.28 1.25 116.94 117.27 1u9o h PHE 110 Ca -0.10 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.68 1u9o h PHE 110 Cb 0.92 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1u9o h PHE 110 CO -0.11 0.27 -0.23 0.35 -1.61 0.00 0.00 178.31 176.97 1u9o h PHE 111 N 0.53 -0.61 -0.45 -0.55 -0.00 -0.69 -2.28 116.94 112.89 1u9o h PHE 111 Ca 0.20 -0.01 0.08 0.00 -0.00 0.00 0.00 57.97 58.24 1u9o h PHE 111 Cb 0.06 0.21 -0.10 0.00 -0.00 0.00 0.00 35.95 36.13 1u9o h PHE 111 CO -0.08 -0.36 -0.38 1.49 -0.00 0.00 0.00 178.31 178.98 1u9o h GLU 112 N -0.62 -0.26 0.00 1.11 4.81 0.95 0.44 114.58 121.01 1u9o h GLU 112 Ca -0.06 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1u9o h GLU 112 Cb 0.48 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1u9o h GLU 112 CO 0.08 -0.17 0.00 2.41 -0.73 0.00 0.00 179.01 180.60 1u9o n THR 113 N -5.42 0.00 -0.34 0.32 -1.04 0.43 -2.32 114.28 105.91 1u9o n THR 113 Ca 0.01 0.72 0.34 0.00 -2.04 0.00 0.00 64.05 63.08 1u9o n THR 113 Cb 0.35 -1.65 0.72 0.00 -1.82 0.00 0.00 70.33 67.93 1u9o n THR 113 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1u9o h PHE 114 N 0.00 0.10 0.00 -1.42 -1.00 -1.50 1.75 116.94 114.88 1u9o h PHE 114 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1u9o h PHE 114 Cb 0.00 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.53 1u9o h PHE 114 CO 0.00 0.00 0.00 0.78 -1.61 0.00 0.00 178.31 177.48 1u9o h GLY 115 N 0.06 0.00 1.01 -1.45 0.00 -0.09 -1.53 103.07 101.06 1u9o h GLY 115 Ca 0.59 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.62 1u9o h GLY 115 CO -0.06 0.00 -1.69 1.76 0.00 0.00 0.00 176.54 176.55 1u9o h SER 116 N 0.00 0.11 -1.77 0.19 0.02 0.31 -3.38 113.55 109.03 1u9o h SER 116 Ca 0.00 -0.22 -0.67 0.00 -0.84 0.00 0.00 61.79 60.07 1u9o h SER 116 Cb 0.08 -0.03 -0.36 0.00 0.14 0.00 0.00 62.40 62.23 1u9o h SER 116 CO 0.00 1.19 0.01 1.41 -1.14 0.00 0.00 176.83 178.30 1u9o n HIS 117 N -3.18 3.27 -0.22 3.45 8.25 -0.60 -4.83 115.22 121.36 1u9o n HIS 117 Ca -0.18 -2.85 -0.01 0.00 -0.26 0.00 0.00 57.72 54.41 1u9o n HIS 117 Cb 1.04 -0.56 0.05 0.00 1.12 0.00 0.00 29.99 31.65 1u9o n HIS 117 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1u9o h LYS 118 N 2.82 -0.05 -0.44 -0.41 1.57 -1.68 0.10 116.57 118.48 1u9o h LYS 118 Ca 0.40 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.27 1u9o h LYS 118 Cb 0.54 0.01 -0.10 0.00 0.08 0.00 0.00 32.23 32.76 1u9o h LYS 118 CO 1.08 -0.03 -0.35 0.00 -0.57 0.00 0.00 179.45 179.58 1u9o h ALA 119 N 1.49 -0.20 -0.26 3.86 0.00 -1.88 0.57 119.26 122.84 1u9o h ALA 119 Ca 0.30 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 1u9o h ALA 119 Cb 0.51 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1u9o h ALA 119 CO -0.69 -0.74 -0.08 0.28 0.00 0.00 0.00 179.25 178.02 1u9o h VAL 120 N -0.25 1.20 0.35 0.00 2.07 -1.53 0.23 116.25 118.32 1u9o h VAL 120 Ca 0.18 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 1u9o h VAL 120 Cb 0.55 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1u9o h VAL 120 CO -0.57 0.28 -0.17 0.74 0.02 0.00 0.00 177.57 177.87 1u9o h THR 121 N 0.40 0.62 -0.88 2.57 2.02 0.10 0.51 112.91 118.26 1u9o h THR 121 Ca 0.08 -0.55 0.14 0.00 0.77 0.00 0.00 66.41 66.85 1u9o h THR 121 Cb 0.39 0.88 -0.07 0.00 -1.74 0.00 0.00 68.15 67.61 1u9o h THR 121 CO 0.02 0.10 0.57 0.03 0.37 0.00 0.00 175.52 176.60 1u9o h ARG 122 N -0.80 0.65 -0.06 6.66 3.08 0.21 0.89 114.38 125.01 1u9o h ARG 122 Ca -0.05 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 1u9o h ARG 122 Cb 0.52 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1u9o h ARG 122 CO 0.08 0.43 -0.07 0.00 -1.07 0.00 0.00 179.97 179.34 1u9o h ALA 123 N 1.60 0.08 -0.41 0.04 0.00 -0.25 -2.69 119.26 117.64 1u9o h ALA 123 Ca 0.44 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1u9o h ALA 123 Cb 0.72 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1u9o h ALA 123 CO -0.19 -0.10 0.26 0.78 0.00 0.00 0.00 179.25 180.00 1u9o h GLY 124 N -0.32 0.58 0.00 0.00 0.00 0.77 -3.27 103.07 100.84 1u9o h GLY 124 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1u9o h GLY 124 CO 0.02 0.22 0.00 -0.18 0.00 0.00 0.00 176.54 176.60 1u9o n GLN 125 N -4.78 0.00 0.00 4.80 -0.06 0.24 -2.21 117.38 115.36 1u9o n GLN 125 Ca 0.01 0.13 0.00 0.00 -2.00 0.00 0.00 57.00 55.14 1u9o n GLN 125 Cb 0.04 -0.91 0.00 0.00 -4.06 0.00 0.00 30.24 25.31 1u9o n GLN 125 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1u9o n ALA 126 N -1.08 1.13 -1.82 1.69 0.00 -1.01 0.26 120.51 119.68 1u9o n ALA 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1u9o n ALA 126 Cb 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1u9o n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u9o n ALA 127 N 2.30 0.00 0.06 0.00 0.00 -1.12 -4.86 120.51 116.89 1u9o n ALA 127 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1u9o n ALA 127 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 1u9o n ALA 127 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1u9o h ARG 128 N 0.00 0.33 0.00 0.00 2.43 0.39 -2.81 114.38 114.73 1u9o h ARG 128 Ca 0.00 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1u9o h ARG 128 Cb 0.42 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1u9o h ARG 128 CO 0.00 0.88 0.00 0.00 -1.51 0.00 0.00 179.97 179.34 1u9o n ALA 129 N -2.49 2.07 -0.91 2.80 0.00 -1.26 -3.05 120.51 117.67 1u9o n ALA 129 Ca -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1u9o n ALA 129 Cb 0.66 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1u9o n ALA 129 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1u9o n THR 130 N -0.90 0.06 -3.50 0.00 -2.24 -1.07 -5.02 114.28 101.61 1u9o n THR 130 Ca 0.09 -0.07 -0.23 0.00 -2.27 0.00 0.00 64.05 61.57 1u9o n THR 130 Cb 0.04 1.29 -0.13 0.00 -2.10 0.00 0.00 70.33 69.43 1u9o n THR 130 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1u9o s SER 131 N -0.06 2.34 0.30 3.42 0.15 -1.12 -4.98 113.70 113.75 1u9o s SER 131 Ca 0.00 -0.79 0.03 0.00 0.70 0.00 0.00 55.95 55.89 1u9o s SER 131 Cb 0.00 0.07 0.60 0.00 -1.71 0.00 0.00 66.02 64.98 1u9o s SER 131 CO 0.00 -0.39 1.87 -0.37 1.20 0.00 0.00 173.24 175.55 1u9o h VAL 132 N 6.35 0.95 -0.45 4.45 -1.51 -1.91 -0.43 116.25 123.70 1u9o h VAL 132 Ca -0.17 -0.33 0.09 0.00 -1.23 0.00 0.00 66.70 65.07 1u9o h VAL 132 Cb 1.08 -0.08 -0.10 0.00 -2.13 0.00 0.00 31.29 30.06 1u9o h VAL 132 CO 0.35 0.17 -0.26 -0.33 -1.23 0.00 0.00 177.57 176.27 1u9o h GLU 133 N 0.95 -0.16 0.18 5.19 3.07 -1.95 0.31 114.58 122.17 1u9o h GLU 133 Ca 0.45 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.32 1u9o h GLU 133 Cb 0.44 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1u9o h GLU 133 CO -0.21 -0.11 -0.09 0.28 -1.40 0.00 0.00 179.01 177.48 1u9o h VAL 134 N -0.17 0.90 -0.68 3.13 2.07 -1.59 0.13 116.25 120.05 1u9o h VAL 134 Ca 0.20 -0.42 0.14 0.00 0.82 0.00 0.00 66.70 67.44 1u9o h VAL 134 Cb 0.50 1.16 -0.11 0.00 -1.52 0.00 0.00 31.29 31.32 1u9o h VAL 134 CO -0.55 0.10 0.09 0.00 0.02 0.00 0.00 177.57 177.23 1u9o h ALA 135 N 0.32 0.78 0.68 1.67 0.00 -0.41 0.32 119.26 122.62 1u9o h ALA 135 Ca -0.02 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1u9o h ALA 135 Cb 0.35 0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1u9o h ALA 135 CO 0.04 -0.36 -0.32 0.93 0.00 0.00 0.00 179.25 179.53 1u9o h GLU 136 N 0.20 -0.88 -1.41 0.00 5.08 -0.26 0.67 114.58 117.98 1u9o h GLU 136 Ca 0.37 0.06 0.47 0.00 -1.00 0.00 0.00 59.36 59.26 1u9o h GLU 136 Cb 0.61 0.20 -0.13 0.00 0.50 0.00 0.00 28.75 29.93 1u9o h GLU 136 CO -0.52 -0.58 0.93 -0.11 -1.00 0.00 0.00 179.01 177.73 1u9o n LEU 137 N -5.23 0.18 -0.06 1.33 7.94 0.43 0.75 117.00 122.33 1u9o n LEU 137 Ca -0.11 1.29 -0.05 0.00 -1.11 0.00 0.00 56.01 56.03 1u9o n LEU 137 Cb 0.36 -0.63 -0.03 0.00 0.53 0.00 0.00 43.42 43.65 1u9o n LEU 137 CO 0.27 -1.39 -0.13 -0.25 -1.11 0.00 0.00 177.39 174.78 1u9o h TRP 138 N 0.00 0.00 0.00 1.96 2.91 -0.73 -3.28 115.95 116.81 1u9o h TRP 138 Ca 0.86 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.88 1u9o h TRP 138 Cb 2.87 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 31.52 1u9o h TRP 138 CO -0.01 0.23 0.45 1.03 -1.03 0.00 0.00 178.44 179.11 1u9o h SER 139 N -1.00 0.00 0.00 2.65 0.87 0.38 -1.65 113.55 114.81 1u9o h SER 139 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1u9o h SER 139 Cb 0.40 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1u9o h SER 139 CO -0.02 0.00 0.00 0.41 -0.53 0.00 0.00 176.83 176.69 1u9o n THR 140 N -2.34 0.00 -0.32 2.23 -1.04 0.23 -4.14 114.28 108.90 1u9o n THR 140 Ca -0.01 0.09 0.22 0.00 -2.04 0.00 0.00 64.05 62.30 1u9o n THR 140 Cb 0.48 -0.33 0.43 0.00 -1.82 0.00 0.00 70.33 69.09 1u9o n THR 140 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1u9o h PHE 141 N 0.00 0.61 -0.29 -1.42 -1.00 -1.53 1.23 116.94 114.54 1u9o h PHE 141 Ca 0.00 0.05 0.08 0.00 2.81 0.00 0.00 57.97 60.91 1u9o h PHE 141 Cb 0.00 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 1u9o h PHE 141 CO 0.00 -0.30 0.57 0.52 -1.61 0.00 0.00 178.31 177.50 1u9o h MET 142 N 0.17 0.00 0.04 1.51 2.86 -1.51 0.51 114.93 118.51 1u9o h MET 142 Ca 0.69 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 58.04 1u9o h MET 142 Cb 1.60 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.22 1u9o h MET 142 CO -0.71 0.00 -1.65 1.96 1.06 0.00 0.00 176.91 177.58 1u9o h GLN 143 N 0.00 0.09 -0.20 1.72 4.20 0.14 -1.53 115.11 119.53 1u9o h GLN 143 Ca 0.14 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 1u9o h GLN 143 Cb 1.28 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.12 1u9o h GLN 143 CO -0.00 0.78 -0.24 -0.22 -0.67 0.00 0.00 178.83 178.47 1u9o h LYS 144 N 0.02 0.52 -0.40 1.46 3.64 -0.05 -0.32 116.57 121.44 1u9o h LYS 144 Ca -0.27 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 58.74 1u9o h LYS 144 Cb 1.99 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.82 1u9o h LYS 144 CO 0.10 0.88 -0.06 -1.49 -2.27 0.00 0.00 179.45 176.61 1u9o h TRP 145 N 0.19 0.84 -0.14 1.91 6.55 -1.00 0.37 115.95 124.67 1u9o h TRP 145 Ca 0.03 -0.17 -0.04 0.00 0.95 0.00 0.00 58.89 59.66 1u9o h TRP 145 Cb 0.81 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.89 1u9o h TRP 145 CO 0.08 0.86 -0.08 0.97 -1.05 0.00 0.00 178.44 179.23 1u9o h ILE 146 N 0.57 1.14 0.18 1.49 2.10 -1.21 -1.96 117.51 119.82 1u9o h ILE 146 Ca 0.11 -0.59 -0.01 0.00 1.08 0.00 0.00 64.86 65.45 1u9o h ILE 146 Cb 0.57 1.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.42 1u9o h ILE 146 CO 0.03 0.19 -0.09 0.00 -1.08 0.00 0.00 178.15 177.20 1u9o h ALA 147 N 1.73 -0.24 -0.95 0.18 0.00 -0.51 -2.70 119.26 116.77 1u9o h ALA 147 Ca 0.04 -0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.02 1u9o h ALA 147 Cb 0.27 0.09 -0.18 0.00 0.00 0.00 0.00 17.79 17.97 1u9o h ALA 147 CO 0.01 -0.24 -0.25 0.98 0.00 0.00 0.00 179.25 179.75 1u9o n TYR 148 N -4.93 0.31 0.00 0.00 9.36 0.12 -0.21 117.16 121.82 1u9o n TYR 148 Ca -0.05 1.16 0.00 0.00 3.32 0.00 0.00 57.90 62.33 1u9o n TYR 148 Cb 0.16 -1.03 0.00 0.00 -0.63 0.00 0.00 39.34 37.84 1u9o n TYR 148 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1u9o n THR 149 N -5.53 0.00 -0.32 2.97 -1.04 -0.75 -2.14 114.28 107.48 1u9o n THR 149 Ca 0.15 1.46 0.30 0.00 -2.04 0.00 0.00 64.05 63.91 1u9o n THR 149 Cb 0.46 -2.34 0.55 0.00 -1.82 0.00 0.00 70.33 67.19 1u9o n THR 149 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1u9o n ALA 150 N -2.09 0.96 0.09 2.41 0.00 -0.46 0.38 120.51 121.79 1u9o n ALA 150 Ca 0.00 1.02 -0.10 0.00 0.00 0.00 0.00 53.44 54.36 1u9o n ALA 150 Cb 0.00 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 1u9o n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u9o h ALA 151 N 1.98 -0.85 -1.00 0.00 0.00 -0.08 -1.79 119.26 117.52 1u9o h ALA 151 Ca 0.81 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.83 1u9o h ALA 151 Cb 2.12 0.69 -0.10 0.00 0.00 0.00 0.00 17.79 20.50 1u9o h ALA 151 CO -0.78 -0.92 0.61 0.28 0.00 0.00 0.00 179.25 178.44 1u9o h VAL 152 N -0.48 0.74 -0.87 0.00 2.07 0.46 0.19 116.25 118.36 1u9o h VAL 152 Ca -0.01 -0.27 0.18 0.00 0.82 0.00 0.00 66.70 67.42 1u9o h VAL 152 Cb 0.47 -0.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.05 1u9o h VAL 152 CO -0.15 0.15 0.57 0.40 0.02 0.00 0.00 177.57 178.56 1u9o h ILE 153 N 0.80 0.72 0.09 4.57 1.08 -0.29 -0.23 117.51 124.26 1u9o h ILE 153 Ca 0.57 -0.15 -0.22 0.00 -0.39 0.00 0.00 64.86 64.66 1u9o h ILE 153 Cb 0.83 0.24 -0.00 0.00 -3.07 0.00 0.00 36.82 34.82 1u9o h ILE 153 CO -0.36 0.08 -1.09 0.44 -0.69 0.00 0.00 178.15 176.53 1u9o h ASP 154 N 0.45 0.31 0.00 1.72 3.45 -0.12 -3.26 116.42 118.96 1u9o h ASP 154 Ca 0.44 -0.85 0.00 0.00 0.43 0.00 0.00 57.03 57.05 1u9o h ASP 154 Cb 1.04 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.71 1u9o h ASP 154 CO -0.17 1.48 0.00 0.00 -1.57 0.00 0.00 179.24 178.98 1u9o n ALA 155 N -2.91 1.58 -1.22 3.45 0.00 0.11 0.21 120.51 121.73 1u9o n ALA 155 Ca -0.22 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.27 1u9o n ALA 155 Cb 0.81 -1.02 0.08 0.00 0.00 0.00 0.00 19.45 19.31 1u9o n ALA 155 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1u9o n GLU 156 N -0.84 1.03 0.00 0.00 4.07 -0.19 -4.51 120.64 120.20 1u9o n GLU 156 Ca 0.01 -1.91 0.00 0.00 -0.06 0.00 0.00 57.16 55.20 1u9o n GLU 156 Cb 0.01 -1.11 0.00 0.00 -0.06 0.00 0.00 31.44 30.27 1u9o n GLU 156 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1u9o n ARG 157 N -0.86 2.17 0.00 5.31 1.74 0.55 0.95 116.66 126.52 1u9o n ARG 157 Ca 0.09 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.30 1u9o n ARG 157 Cb 0.61 -0.77 0.46 0.00 -1.02 0.00 0.00 32.46 31.74 1u9o n ARG 157 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1u9o n ASP 158 N -1.33 0.28 -1.12 0.55 10.43 -0.33 -2.11 116.55 122.91 1u9o n ASP 158 Ca 0.00 0.04 0.11 0.00 2.57 0.00 0.00 54.79 57.51 1u9o n ASP 158 Cb 0.27 -0.13 0.23 0.00 1.84 0.00 0.00 41.12 43.34 1u9o n ASP 158 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 1u9o n ARG 159 N -1.43 2.53 -0.94 -1.24 1.85 -1.26 -4.96 116.66 111.21 1u9o n ARG 159 Ca 0.07 -2.33 0.00 0.00 -1.00 0.00 0.00 57.85 54.59 1u9o n ARG 159 Cb 0.33 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.25 1u9o n ARG 159 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1u9o n GLY 160 N 1.38 0.36 0.16 2.89 0.00 -0.90 -4.92 105.19 104.17 1u9o n GLY 160 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 1u9o n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9o h ALA 161 N 0.00 0.76 -3.45 4.61 0.00 -1.77 -3.45 119.26 115.96 1u9o h ALA 161 Ca 0.00 -0.34 -0.57 0.00 0.00 0.00 0.00 54.91 54.01 1u9o h ALA 161 Cb 0.32 -0.06 -0.33 0.00 0.00 0.00 0.00 17.79 17.72 1u9o h ALA 161 CO 0.00 0.46 -0.84 0.00 0.00 0.00 0.00 179.25 178.87 1u9o s ALA 162 N -3.03 1.56 0.51 0.00 0.00 0.27 -4.97 121.76 116.09 1u9o s ALA 162 Ca 0.05 -0.61 -0.23 0.00 0.00 0.00 0.00 51.96 51.17 1u9o s ALA 162 Cb 0.07 -0.63 -0.06 0.00 0.00 0.00 0.00 23.12 22.50 1u9o s ALA 162 CO 0.73 0.18 1.40 -1.25 0.00 0.00 0.00 175.76 176.82 1u9o s PRO 163 N 0.50 3.34 -1.30 0.00 0.04 -1.26 -4.49 135.00 131.83 1u9o s PRO 163 Ca -0.15 2.33 -0.17 0.00 0.04 0.00 0.00 61.00 63.06 1u9o s PRO 163 Cb -0.16 -2.41 0.08 0.00 0.04 0.00 0.00 34.50 32.05 1u9o s PRO 163 CO 0.05 -1.07 1.74 0.54 0.04 0.00 0.00 177.00 178.31 1u9o n ARG 164 N -0.71 3.20 0.00 4.56 1.74 -1.26 -4.74 116.66 119.45 1u9o n ARG 164 Ca 0.08 -3.31 0.00 0.00 -0.77 0.00 0.00 57.85 53.86 1u9o n ARG 164 Cb 0.44 -3.41 0.00 0.00 -1.02 0.00 0.00 32.46 28.47 1u9o n ARG 164 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1u9o n THR 165 N 5.98 0.00 -4.04 0.55 -2.24 -1.26 -5.05 114.28 108.22 1u9o n THR 165 Ca 0.47 0.14 -0.22 0.00 -2.27 0.00 0.00 64.05 62.18 1u9o n THR 165 Cb 0.45 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.73 1u9o n THR 165 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1u9o s LEU 166 N -3.02 3.86 -0.27 3.22 1.43 -1.26 -5.04 118.68 117.59 1u9o s LEU 166 Ca 0.00 -0.23 -0.29 0.00 -1.03 0.00 0.00 54.13 52.58 1u9o s LEU 166 Cb 0.00 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.79 1u9o s LEU 166 CO 0.00 -0.09 1.72 -2.84 0.23 0.00 0.00 176.35 175.37 1u9o s PRO 167 N -3.89 3.56 0.04 1.29 0.02 -1.26 -4.87 135.00 129.89 1u9o s PRO 167 Ca 0.34 1.55 -0.08 0.00 0.02 0.00 0.00 61.00 62.83 1u9o s PRO 167 Cb -0.08 -4.12 -0.02 0.00 0.02 0.00 0.00 34.50 30.30 1u9o s PRO 167 CO 0.26 -1.58 0.54 0.00 -0.33 0.00 0.00 177.00 175.88 1u9o n ALA 168 N 9.39 -0.17 -0.17 -1.55 0.00 -1.26 -0.72 120.51 126.03 1u9o n ALA 168 Ca 0.21 0.23 -0.04 0.00 0.00 0.00 0.00 53.44 53.84 1u9o n ALA 168 Cb 0.46 0.02 0.02 0.00 0.00 0.00 0.00 19.45 19.95 1u9o n ALA 168 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1u9o h HIS 169 N 0.00 -0.66 0.69 0.00 -0.00 -1.90 1.50 115.15 114.79 1u9o h HIS 169 Ca 0.04 0.06 -0.03 0.00 -0.00 0.00 0.00 60.37 60.44 1u9o h HIS 169 Cb 0.11 0.37 -0.00 0.00 -0.00 0.00 0.00 27.41 27.89 1u9o h HIS 169 CO -0.39 -0.33 -0.41 0.93 -0.00 0.00 0.00 177.93 177.72 1u9o h GLU 170 N -0.13 -0.99 -0.71 5.26 5.08 -1.31 0.15 114.58 121.92 1u9o h GLU 170 Ca 0.23 0.07 0.13 0.00 -1.00 0.00 0.00 59.36 58.79 1u9o h GLU 170 Cb 0.50 0.23 -0.13 0.00 0.50 0.00 0.00 28.75 29.84 1u9o h GLU 170 CO -0.60 -0.66 -0.25 1.25 -1.00 0.00 0.00 179.01 177.75 1u9o h LEU 171 N -1.03 -0.91 -1.17 1.33 5.85 -0.62 0.37 115.31 119.13 1u9o h LEU 171 Ca -0.09 0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.92 1u9o h LEU 171 Cb 0.82 0.52 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 1u9o h LEU 171 CO 0.10 -0.27 0.58 0.00 -0.34 0.00 0.00 178.44 178.51 1u9o h ALA 172 N 1.47 1.53 -0.11 1.25 0.00 0.24 -2.49 119.26 121.15 1u9o h ALA 172 Ca 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1u9o h ALA 172 Cb 0.55 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1u9o h ALA 172 CO -0.76 0.33 0.03 1.15 0.00 0.00 0.00 179.25 180.01 1u9o h THR 173 N 1.00 1.19 -0.17 0.00 2.02 0.26 0.13 112.91 117.34 1u9o h THR 173 Ca 0.38 -0.59 0.05 0.00 0.77 0.00 0.00 66.41 67.01 1u9o h THR 173 Cb 0.20 1.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.94 1u9o h THR 173 CO -0.14 0.17 -0.13 0.00 0.37 0.00 0.00 175.52 175.79 1u9o h ALA 174 N 0.83 -0.00 0.25 6.16 0.00 -1.03 0.42 119.26 125.88 1u9o h ALA 174 Ca 0.03 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1u9o h ALA 174 Cb 0.24 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1u9o h ALA 174 CO 0.00 -0.57 -0.19 -0.07 0.00 0.00 0.00 179.25 178.42 1u9o h LEU 175 N -0.14 -0.51 -0.78 0.00 3.38 -1.36 -0.10 115.31 115.80 1u9o h LEU 175 Ca 0.11 0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.26 1u9o h LEU 175 Cb 0.30 0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.06 1u9o h LEU 175 CO -0.26 -0.27 -0.23 0.78 0.09 0.00 0.00 178.44 178.54 1u9o h ASN 176 N -0.43 -0.86 -0.91 -0.43 2.35 -0.50 0.20 115.58 115.00 1u9o h ASN 176 Ca -0.03 0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1u9o h ASN 176 Cb 0.36 0.53 -0.04 0.00 0.05 0.00 0.00 38.32 39.21 1u9o h ASN 176 CO 0.01 -0.27 0.51 -0.07 -1.65 0.00 0.00 177.43 175.96 1u9o h LEU 177 N -0.03 1.13 -0.28 1.61 3.38 -0.03 -2.34 115.31 118.75 1u9o h LEU 177 Ca 0.36 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1u9o h LEU 177 Cb 0.58 -0.29 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 1u9o h LEU 177 CO -0.81 0.90 -0.20 -0.03 0.09 0.00 0.00 178.44 178.38 1u9o h MET 178 N 1.27 -0.18 -0.40 1.13 4.05 0.13 -2.25 114.93 118.69 1u9o h MET 178 Ca 0.32 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.80 1u9o h MET 178 Cb 0.01 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 30.78 1u9o h MET 178 CO -0.05 -0.12 -0.41 -0.91 0.23 0.00 0.00 176.91 175.64 1u9o h ASN 179 N -0.18 -1.42 -0.39 1.39 -0.26 -0.80 0.22 115.58 114.13 1u9o h ASN 179 Ca 0.15 0.19 0.03 0.00 -0.56 0.00 0.00 56.30 56.12 1u9o h ASN 179 Cb 0.42 0.59 -0.05 0.00 -1.06 0.00 0.00 38.32 38.22 1u9o h ASN 179 CO -0.39 -0.26 -0.23 1.21 -1.06 0.00 0.00 177.43 176.70 1u9o n GLU 180 N -4.65 -0.17 -0.19 0.81 2.13 -0.87 0.14 120.64 117.84 1u9o n GLU 180 Ca -0.02 1.19 -0.06 0.00 0.66 0.00 0.00 57.16 58.93 1u9o n GLU 180 Cb 0.23 -1.76 0.04 0.00 0.27 0.00 0.00 31.44 30.22 1u9o n GLU 180 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 1u9o h ARG 181 N 0.00 0.70 0.41 5.31 9.65 -1.23 -1.76 114.38 127.46 1u9o h ARG 181 Ca 0.06 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1u9o h ARG 181 Cb 0.16 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 1u9o h ARG 181 CO -0.36 0.46 -0.20 1.15 2.80 0.00 0.00 179.97 183.82 1u9o h THR 182 N 0.72 0.46 0.00 0.20 2.02 0.40 -2.27 112.91 114.44 1u9o h THR 182 Ca 0.22 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1u9o h THR 182 Cb -0.03 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1u9o h THR 182 CO -0.07 0.08 0.00 -0.07 0.37 0.00 0.00 175.52 175.83 1u9o h LEU 183 N -0.93 0.00 0.00 2.58 3.38 0.12 -2.72 115.31 117.75 1u9o h LEU 183 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1u9o h LEU 183 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1u9o h LEU 183 CO 0.09 0.00 -0.11 0.15 0.09 0.00 0.00 178.44 178.66 1u9o h PHE 184 N 0.00 0.00 0.00 1.13 3.57 -1.17 -3.19 116.94 117.28 1u9o h PHE 184 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1u9o h PHE 184 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1u9o h PHE 184 CO 0.00 0.00 0.30 0.00 -2.23 0.00 0.00 178.31 176.38 1u9o n ALA 185 N -2.68 0.48 0.06 2.41 0.00 -0.87 0.18 120.51 120.09 1u9o n ALA 185 Ca -0.02 0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.24 1u9o n ALA 185 Cb 0.06 -0.52 -0.15 0.00 0.00 0.00 0.00 19.45 18.85 1u9o n ALA 185 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1u9o h SER 186 N 0.00 0.54 1.17 0.00 0.02 -1.58 -2.62 113.55 111.07 1u9o h SER 186 Ca 0.00 -0.83 -0.16 0.00 -0.84 0.00 0.00 61.79 59.96 1u9o h SER 186 Cb 0.61 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1u9o h SER 186 CO 0.00 1.70 -0.86 -0.26 -1.14 0.00 0.00 176.83 176.28 1u9o h PHE 187 N 0.09 0.00 -0.01 3.45 0.05 0.20 -3.22 116.94 117.51 1u9o h PHE 187 Ca -0.33 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.46 1u9o h PHE 187 Cb 2.08 0.00 0.00 0.00 2.00 0.00 0.00 35.95 40.03 1u9o h PHE 187 CO 0.09 0.70 -0.19 0.00 -0.18 0.00 0.00 178.31 178.73 1u9o n ALA 188 N -2.31 2.93 -1.19 2.45 0.00 0.45 -4.92 120.51 117.93 1u9o n ALA 188 Ca -0.01 -0.33 -0.06 0.00 0.00 0.00 0.00 53.44 53.03 1u9o n ALA 188 Cb 0.83 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 1u9o n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u9o n GLY 189 N 1.32 0.77 3.16 0.00 0.00 -1.18 -4.98 105.19 104.28 1u9o n GLY 189 Ca 0.13 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1u9o n GLY 189 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1u9o n GLU 190 N -1.48 -3.55 -3.52 1.61 1.02 -1.00 -5.02 120.64 108.71 1u9o n GLU 190 Ca -0.06 -1.05 -0.06 0.00 -0.02 0.00 0.00 57.16 55.96 1u9o n GLU 190 Cb 0.38 -1.75 -0.08 0.00 -0.02 0.00 0.00 31.44 29.97 1u9o n GLU 190 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1u9o s GLN 191 N -4.31 0.38 0.41 3.49 2.00 -1.26 -4.15 119.66 116.22 1u9o s GLN 191 Ca 0.54 0.94 -0.26 0.00 -2.00 0.00 0.00 55.36 54.58 1u9o s GLN 191 Cb -0.11 0.19 -0.09 0.00 0.80 0.00 0.00 33.01 33.80 1u9o s GLN 191 CO 0.48 -0.40 1.40 -1.25 -0.50 0.00 0.00 175.29 175.03 1u9o s PRO 192 N 2.65 3.91 0.29 1.67 0.04 -1.26 -5.21 135.00 137.10 1u9o s PRO 192 Ca 0.04 2.37 -0.19 0.00 0.04 0.00 0.00 61.00 63.27 1u9o s PRO 192 Cb -0.13 -2.79 0.06 0.00 0.04 0.00 0.00 34.50 31.68 1u9o s PRO 192 CO -0.15 -0.62 0.90 -1.54 0.04 0.00 0.00 177.00 175.63 1u9o s SER 193 N -0.48 -0.00 -0.26 6.66 1.04 -1.26 -4.93 113.70 114.47 1u9o s SER 193 Ca 0.57 -0.92 0.01 0.00 0.48 0.00 0.00 55.95 56.09 1u9o s SER 193 Cb -0.43 0.69 0.07 0.00 0.10 0.00 0.00 66.02 66.46 1u9o s SER 193 CO 0.56 -1.37 -0.02 -0.69 0.98 0.00 0.00 173.24 172.69 1u9o s VAL 194 N -2.29 1.59 -0.11 5.02 1.01 -1.26 -5.07 120.40 119.29 1u9o s VAL 194 Ca 0.18 -1.42 -0.21 0.00 0.00 0.00 0.00 61.98 60.53 1u9o s VAL 194 Cb -0.04 -1.93 -0.10 0.00 0.00 0.00 0.00 36.38 34.31 1u9o s VAL 194 CO 0.09 -0.23 0.64 -0.81 0.00 0.00 0.00 175.10 174.78 1u9o n PRO 195 N 4.62 0.00 -0.32 2.72 -0.04 -1.26 -4.17 135.00 136.55 1u9o n PRO 195 Ca -0.09 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.52 1u9o n PRO 195 Cb 0.43 -0.74 0.29 0.00 -0.04 0.00 0.00 33.50 33.45 1u9o n PRO 195 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1u9o n GLU 196 N 1.28 -0.07 0.00 0.54 2.13 -1.26 -0.40 120.64 122.85 1u9o n GLU 196 Ca 0.12 1.40 0.00 0.00 0.66 0.00 0.00 57.16 59.35 1u9o n GLU 196 Cb 0.01 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 29.48 1u9o n GLU 196 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1u9o n ALA 197 N -3.15 1.96 0.00 4.31 0.00 -1.26 -3.18 120.51 119.19 1u9o n ALA 197 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1u9o n ALA 197 Cb 0.75 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.20 1u9o n ALA 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1u9o n ARG 198 N -0.29 0.38 -0.35 0.00 5.12 0.46 -4.84 116.66 117.13 1u9o n ARG 198 Ca 0.00 0.00 0.33 0.00 -1.93 0.00 0.00 57.85 56.25 1u9o n ARG 198 Cb 0.04 -0.62 0.50 0.00 -1.16 0.00 0.00 32.46 31.21 1u9o n ARG 198 CO 0.00 0.00 0.00 1.55 -1.93 0.00 0.00 177.63 177.25 1u9o n VAL 199 N -1.41 0.00 0.02 1.55 3.14 -0.98 -1.52 118.33 119.13 1u9o n VAL 199 Ca 0.00 1.16 -0.01 0.00 -2.96 0.00 0.00 64.34 62.53 1u9o n VAL 199 Cb 0.12 -2.01 -0.00 0.00 -1.06 0.00 0.00 33.84 30.89 1u9o n VAL 199 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 1u9o h LEU 200 N 0.00 -0.06 -0.96 6.55 6.46 -1.89 -1.51 115.31 123.91 1u9o h LEU 200 Ca 0.57 0.00 0.21 0.00 -0.12 0.00 0.00 57.88 58.55 1u9o h LEU 200 Cb 2.81 0.01 -0.11 0.00 -0.73 0.00 0.00 40.66 42.64 1u9o h LEU 200 CO -0.01 0.00 0.54 0.44 -0.62 0.00 0.00 178.44 178.79 1u9o h ASP 201 N -0.15 0.62 -0.96 1.25 3.45 -1.66 0.70 116.42 119.67 1u9o h ASP 201 Ca -0.01 0.12 0.07 0.00 0.43 0.00 0.00 57.03 57.64 1u9o h ASP 201 Cb 0.05 0.03 -0.07 0.00 -0.56 0.00 0.00 39.33 38.78 1u9o h ASP 201 CO 0.01 0.15 0.62 0.74 -1.57 0.00 0.00 179.24 179.20 1u9o h THR 202 N 0.61 1.07 0.00 0.35 2.02 -1.36 -1.29 112.91 114.30 1u9o h THR 202 Ca 0.58 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 1u9o h THR 202 Cb 1.01 -0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1u9o h THR 202 CO -0.44 0.20 -0.03 -0.07 0.37 0.00 0.00 175.52 175.55 1u9o h LEU 203 N 1.10 0.00 -0.85 2.58 3.38 0.13 -3.24 115.31 118.41 1u9o h LEU 203 Ca 0.42 -0.52 0.20 0.00 0.09 0.00 0.00 57.88 58.07 1u9o h LEU 203 Cb 0.21 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.84 1u9o h LEU 203 CO -0.17 0.78 0.31 0.58 0.09 0.00 0.00 178.44 180.03 1u9o h VAL 204 N -1.00 0.47 0.28 1.22 2.07 -0.48 0.16 116.25 118.98 1u9o h VAL 204 Ca -0.01 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1u9o h VAL 204 Cb 0.54 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1u9o h VAL 204 CO -0.00 0.06 -0.18 -0.74 0.02 0.00 0.00 177.57 176.72 1u9o h HIS 205 N 0.35 -0.48 -0.07 1.57 -0.00 -1.39 -0.85 115.15 114.28 1u9o h HIS 205 Ca 0.51 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.90 1u9o h HIS 205 Cb 0.95 0.17 -0.00 0.00 -0.00 0.00 0.00 27.41 28.53 1u9o h HIS 205 CO -0.19 -0.29 0.05 0.82 -0.00 0.00 0.00 177.93 178.32 1u9o h ILE 206 N -0.46 0.96 0.00 6.26 2.04 -0.82 0.14 117.51 125.63 1u9o h ILE 206 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1u9o h ILE 206 Cb 0.39 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1u9o h ILE 206 CO 0.02 0.00 0.00 0.79 0.00 0.00 0.00 178.15 178.96 1u9o n TRP 207 N -4.51 0.00 -0.20 1.37 7.02 0.16 -3.35 117.44 117.92 1u9o n TRP 207 Ca -0.01 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.35 1u9o n TRP 207 Cb 0.16 -0.50 -0.08 0.00 -2.42 0.00 0.00 31.31 28.47 1u9o n TRP 207 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1u9o h VAL 208 N 0.00 0.02 -1.04 -0.99 2.07 -0.98 0.41 116.25 115.74 1u9o h VAL 208 Ca 0.00 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.82 1u9o h VAL 208 Cb 0.00 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.75 1u9o h VAL 208 CO 0.00 0.00 0.75 0.71 0.02 0.00 0.00 177.57 179.05 1u9o h THR 209 N -0.29 0.48 0.04 2.57 1.35 -1.14 0.51 112.91 116.44 1u9o h THR 209 Ca 0.12 -0.01 -0.30 0.00 -0.55 0.00 0.00 66.41 65.66 1u9o h THR 209 Cb 0.56 0.44 -0.03 0.00 -1.73 0.00 0.00 68.15 67.39 1u9o h THR 209 CO -0.68 0.01 -1.66 -1.54 -0.25 0.00 0.00 175.52 171.40 1u9o n SER 210 N -4.26 1.97 -0.32 5.36 3.41 -0.02 -0.27 113.62 119.50 1u9o n SER 210 Ca 0.22 0.32 0.09 0.00 -0.26 0.00 0.00 58.87 59.25 1u9o n SER 210 Cb 1.09 -0.90 0.26 0.00 -0.26 0.00 0.00 64.21 64.39 1u9o n SER 210 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1u9o h ILE 211 N -0.59 0.72 0.00 -1.33 1.08 0.56 -3.28 117.51 114.68 1u9o h ILE 211 Ca -0.41 -0.23 -0.35 0.00 -0.39 0.00 0.00 64.86 63.47 1u9o h ILE 211 Cb 1.61 -0.02 -0.06 0.00 -3.07 0.00 0.00 36.82 35.28 1u9o h ILE 211 CO -0.12 0.12 -2.26 -1.22 -0.69 0.00 0.00 178.15 173.98 1u9o n TYR 212 N -4.83 0.00 -0.83 1.37 4.02 0.09 -4.70 117.16 112.28 1u9o n TYR 212 Ca 0.19 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.81 1u9o n TYR 212 Cb 0.48 -0.84 0.02 0.00 -0.02 0.00 0.00 39.34 38.98 1u9o n TYR 212 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u9o n GLY 213 N 2.10 -2.80 0.00 2.72 0.00 0.63 -4.41 105.19 103.43 1u9o n GLY 213 Ca -0.41 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1u9o n GLY 213 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1u9o n GLU 214 N 1.41 0.00 0.00 1.61 4.07 -1.26 -4.83 120.64 121.64 1u9o n GLU 214 Ca 0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 1u9o n GLU 214 Cb 0.37 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.75 1u9o n GLU 214 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36