#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m47 h VAL 6 N 0.00 1.16 -0.04 1.55 3.04 -1.98 -3.00 116.25 116.98 3m47 h VAL 6 Ca 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 3m47 h VAL 6 Cb 0.00 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 29.83 3m47 h VAL 6 CO 0.00 0.18 0.00 -0.90 -1.01 0.00 0.00 177.57 175.84 3m47 n ASP 7 N -4.39 0.99 -4.47 3.17 5.75 -1.26 -4.82 116.55 111.51 3m47 n ASP 7 Ca 0.04 -1.40 -0.24 0.00 -0.01 0.00 0.00 54.79 53.19 3m47 n ASP 7 Cb 0.12 -0.02 -0.10 0.00 -1.03 0.00 0.00 41.12 40.09 3m47 n ASP 7 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3m47 s VAL 8 N -1.96 2.15 0.41 2.12 -7.23 -1.13 -5.11 120.40 109.64 3m47 s VAL 8 Ca 0.39 -2.26 -0.27 0.00 -1.81 0.00 0.00 61.98 58.03 3m47 s VAL 8 Cb 0.20 -2.42 -0.10 0.00 0.56 0.00 0.00 36.38 34.61 3m47 s VAL 8 CO 0.32 -0.33 1.41 1.15 -0.31 0.00 0.00 175.10 177.33 3m47 n MET 9 N -0.65 2.33 -3.21 4.82 0.00 -1.26 -4.84 117.12 114.30 3m47 n MET 9 Ca -0.05 0.82 -0.40 0.00 0.00 0.00 0.00 57.70 58.07 3m47 n MET 9 Cb 0.62 -2.57 -0.07 0.00 0.00 0.00 0.00 33.22 31.20 3m47 n MET 9 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3m47 s ASP 10 N -0.35 6.44 -0.26 3.17 1.11 -1.26 -4.98 116.67 120.55 3m47 s ASP 10 Ca 0.58 0.50 -0.09 0.00 0.18 0.00 0.00 52.55 53.72 3m47 s ASP 10 Cb -0.48 -2.29 -0.04 0.00 1.07 0.00 0.00 42.92 41.18 3m47 s ASP 10 CO 0.60 -0.32 0.11 -0.69 1.18 0.00 0.00 175.17 176.05 3m47 s VAL 11 N 2.36 4.70 0.21 -1.27 1.01 -1.26 -5.02 120.40 121.13 3m47 s VAL 11 Ca 0.22 -0.04 -0.32 0.00 0.00 0.00 0.00 61.98 61.84 3m47 s VAL 11 Cb -0.16 -3.21 -0.12 0.00 0.00 0.00 0.00 36.38 32.89 3m47 s VAL 11 CO 0.10 0.32 1.70 0.80 0.00 0.00 0.00 175.10 178.01 3m47 n MET 12 N 4.88 2.69 -1.12 2.72 1.56 -1.26 -1.72 117.12 124.88 3m47 n MET 12 Ca -0.15 0.97 -0.06 0.00 -0.27 0.00 0.00 57.70 58.19 3m47 n MET 12 Cb 0.52 -2.80 -0.02 0.00 2.15 0.00 0.00 33.22 33.06 3m47 n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3m47 n ASN 13 N 3.80 -5.44 -2.35 6.12 3.02 -1.26 -2.91 115.26 116.23 3m47 n ASN 13 Ca 0.16 0.14 -0.20 0.00 -0.03 0.00 0.00 54.58 54.65 3m47 n ASN 13 Cb 0.34 -3.66 -0.01 0.00 -0.61 0.00 0.00 39.78 35.84 3m47 n ASN 13 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3m47 n ARG 14 N -0.02 -1.75 -3.86 3.52 1.74 -0.70 -4.96 116.66 110.64 3m47 n ARG 14 Ca -0.06 0.96 -0.27 0.00 -0.77 0.00 0.00 57.85 57.72 3m47 n ARG 14 Cb 0.52 -5.60 -0.17 0.00 -1.02 0.00 0.00 32.46 26.19 3m47 n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3m47 s LEU 15 N -5.89 1.31 -0.21 0.55 2.96 -1.15 -1.04 118.68 115.22 3m47 s LEU 15 Ca 0.00 -0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 53.32 3m47 s LEU 15 Cb 0.00 -0.79 -0.04 0.00 0.50 0.00 0.00 46.19 45.86 3m47 s LEU 15 CO 0.00 -0.18 0.10 -0.63 -1.32 0.00 0.00 176.35 174.31 3m47 s ILE 16 N 1.73 4.93 -0.24 6.68 1.01 0.47 -4.61 121.20 131.17 3m47 s ILE 16 Ca 0.02 0.02 -0.27 0.00 0.00 0.00 0.00 60.65 60.43 3m47 s ILE 16 Cb -0.14 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.07 3m47 s ILE 16 CO -0.07 0.41 0.94 -0.22 0.00 0.00 0.00 174.94 175.99 3m47 s LEU 17 N 0.76 4.09 -0.76 2.97 2.96 -0.87 -0.85 118.68 126.98 3m47 s LEU 17 Ca 0.05 1.21 -0.23 0.00 -0.22 0.00 0.00 54.13 54.94 3m47 s LEU 17 Cb -0.13 -3.37 0.07 0.00 0.50 0.00 0.00 46.19 43.26 3m47 s LEU 17 CO 0.02 -0.59 1.11 0.00 -1.32 0.00 0.00 176.35 175.57 3m47 s ALA 18 N 3.02 3.03 -1.02 5.97 0.00 0.26 -0.47 121.76 132.55 3m47 s ALA 18 Ca 0.39 -1.94 -0.17 0.00 0.00 0.00 0.00 51.96 50.24 3m47 s ALA 18 Cb -0.15 -4.05 0.15 0.00 0.00 0.00 0.00 23.12 19.07 3m47 s ALA 18 CO 0.07 -3.01 1.22 1.41 0.00 0.00 0.00 175.76 175.45 3m47 s MET 19 N 4.29 3.77 0.00 0.00 1.75 -0.36 -4.46 119.30 124.29 3m47 s MET 19 Ca 0.29 -2.07 0.23 0.00 -1.25 0.00 0.00 55.69 52.89 3m47 s MET 19 Cb -0.11 -4.95 0.45 0.00 2.84 0.00 0.00 34.83 33.06 3m47 s MET 19 CO 0.06 -1.76 1.41 -0.25 -0.65 0.00 0.00 175.02 173.83 3m47 n ASP 20 N 6.15 3.21 -4.76 1.11 10.43 -1.26 -4.54 116.55 126.90 3m47 n ASP 20 Ca 0.28 -1.96 -0.38 0.00 2.57 0.00 0.00 54.79 55.30 3m47 n ASP 20 Cb 0.47 -0.21 0.02 0.00 1.84 0.00 0.00 41.12 43.24 3m47 n ASP 20 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3m47 s LEU 21 N -1.54 3.91 0.00 0.64 1.43 -1.26 -4.83 118.68 117.03 3m47 s LEU 21 Ca 0.37 2.63 0.17 0.00 -1.03 0.00 0.00 54.13 56.27 3m47 s LEU 21 Cb 0.22 -4.25 -0.17 0.00 0.03 0.00 0.00 46.19 42.02 3m47 s LEU 21 CO 0.31 -1.36 0.76 0.23 0.23 0.00 0.00 176.35 176.53 3m47 n MET 22 N -0.83 1.26 -4.57 1.70 2.81 -1.26 -4.45 117.12 111.77 3m47 n MET 22 Ca 0.09 -0.10 -0.34 0.00 -1.81 0.00 0.00 57.70 55.55 3m47 n MET 22 Cb 0.46 -1.33 -0.11 0.00 -0.71 0.00 0.00 33.22 31.53 3m47 n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3m47 s ASN 23 N -2.59 4.70 0.18 7.83 4.22 -1.26 -4.65 114.94 123.37 3m47 s ASN 23 Ca 0.08 -0.03 -0.13 0.00 -2.14 0.00 0.00 52.86 50.64 3m47 s ASN 23 Cb 0.13 -1.18 0.11 0.00 1.28 0.00 0.00 41.25 41.59 3m47 s ASN 23 CO 0.69 0.35 1.83 -0.09 -2.04 0.00 0.00 177.10 177.84 3m47 h ARG 24 N 5.10 0.70 0.03 3.55 2.43 -1.93 -1.27 114.38 122.99 3m47 h ARG 24 Ca -0.49 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 58.66 3m47 h ARG 24 Cb 1.17 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 3m47 h ARG 24 CO 0.53 0.46 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.85 3m47 h ASP 25 N 0.72 -0.45 -0.51 -3.80 3.32 -1.99 -0.45 116.42 113.27 3m47 h ASP 25 Ca 0.22 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 3m47 h ASP 25 Cb -0.03 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 3m47 h ASP 25 CO -0.08 -0.22 0.22 0.44 -1.72 0.00 0.00 179.24 177.88 3m47 h ASP 26 N -0.28 0.69 -0.16 6.45 3.32 -1.94 -0.18 116.42 124.31 3m47 h ASP 26 Ca 0.04 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3m47 h ASP 26 Cb 0.33 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3m47 h ASP 26 CO -0.13 0.65 0.09 0.00 -1.72 0.00 0.00 179.24 178.14 3m47 h ALA 27 N 1.06 0.21 -0.58 3.45 0.00 -1.01 -0.93 119.26 121.46 3m47 h ALA 27 Ca 0.17 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3m47 h ALA 27 Cb 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3m47 h ALA 27 CO -0.02 -0.25 0.07 -0.07 0.00 0.00 0.00 179.25 178.98 3m47 h LEU 28 N 0.16 0.94 0.40 0.00 3.38 -1.05 -1.92 115.31 117.23 3m47 h LEU 28 Ca 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 3m47 h LEU 28 Cb 0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3m47 h LEU 28 CO -0.01 0.98 -0.31 -0.09 0.09 0.00 0.00 178.44 179.10 3m47 h ARG 29 N 0.87 -0.68 -0.82 1.13 2.43 -0.76 -1.93 114.38 114.61 3m47 h ARG 29 Ca 0.17 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.41 3m47 h ARG 29 Cb 0.46 0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.12 3m47 h ARG 29 CO 0.02 -0.46 0.54 0.28 -1.51 0.00 0.00 179.97 178.84 3m47 h VAL 30 N -0.71 1.17 -0.20 0.20 2.07 -1.19 -3.22 116.25 114.38 3m47 h VAL 30 Ca -0.04 -0.37 -0.06 0.00 0.82 0.00 0.00 66.70 67.06 3m47 h VAL 30 Cb 0.61 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3m47 h VAL 30 CO -0.00 0.19 -0.10 0.74 0.02 0.00 0.00 177.57 178.42 3m47 h THR 31 N 1.07 1.31 -0.99 2.57 2.02 -1.22 -3.14 112.91 114.53 3m47 h THR 31 Ca 0.32 -1.16 0.14 0.00 0.77 0.00 0.00 66.41 66.47 3m47 h THR 31 Cb -0.06 1.65 -0.09 0.00 -1.74 0.00 0.00 68.15 67.91 3m47 h THR 31 CO -0.09 0.35 0.62 1.23 0.37 0.00 0.00 175.52 178.00 3m47 h GLY 32 N 0.11 1.61 1.79 2.16 0.00 -1.37 -1.16 103.07 106.21 3m47 h GLY 32 Ca 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.98 3m47 h GLY 32 CO 0.03 0.09 0.00 1.18 0.00 0.00 0.00 176.54 177.84 3m47 n GLU 33 N -4.65 0.10 0.00 4.80 1.02 -1.19 -2.75 120.64 117.98 3m47 n GLU 33 Ca 0.20 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 3m47 n GLU 33 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 3m47 n GLU 33 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3m47 n VAL 34 N -1.40 0.20 0.32 2.62 0.24 -0.46 -4.21 118.33 115.64 3m47 n VAL 34 Ca 0.05 -0.58 0.19 0.00 -2.04 0.00 0.00 64.34 61.97 3m47 n VAL 34 Cb 0.14 0.94 1.06 0.00 -1.47 0.00 0.00 33.84 34.51 3m47 n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3m47 h ARG 35 N 0.00 0.00 0.00 7.34 9.65 -1.31 0.41 114.38 130.47 3m47 h ARG 35 Ca 0.00 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.84 3m47 h ARG 35 Cb 0.13 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 3m47 h ARG 35 CO 0.00 0.01 -0.19 1.49 2.80 0.00 0.00 179.97 184.08 3m47 h GLU 36 N 0.00 0.00 0.00 0.20 4.81 -1.85 -3.26 114.58 114.48 3m47 h GLU 36 Ca -0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3m47 h GLU 36 Cb 0.06 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3m47 h GLU 36 CO 0.00 0.19 -1.82 0.66 -0.73 0.00 0.00 179.01 177.32 3m47 n TYR 37 N -3.45 0.00 -4.62 0.92 4.01 0.13 -4.98 117.16 109.16 3m47 n TYR 37 Ca -0.00 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.52 3m47 n TYR 37 Cb 0.37 -0.52 -0.15 0.00 -0.31 0.00 0.00 39.34 38.74 3m47 n TYR 37 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3m47 s ILE 38 N -2.68 1.09 0.00 -0.72 1.01 -0.06 -4.59 121.20 115.25 3m47 s ILE 38 Ca -0.06 -0.60 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3m47 s ILE 38 Cb 0.07 -0.91 0.00 0.00 0.01 0.00 0.00 42.46 41.63 3m47 s ILE 38 CO 0.59 0.30 0.64 -0.90 0.00 0.00 0.00 174.94 175.57 3m47 n ASP 39 N 2.72 1.26 -3.92 3.58 5.75 -1.26 -4.35 116.55 120.33 3m47 n ASP 39 Ca -0.14 -1.31 -0.25 0.00 -0.01 0.00 0.00 54.79 53.08 3m47 n ASP 39 Cb 0.55 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.47 3m47 n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3m47 s THR 40 N -0.31 0.93 -0.06 2.12 2.01 -1.26 -0.30 115.64 118.77 3m47 s THR 40 Ca 0.00 -0.28 0.04 0.00 0.31 0.00 0.00 61.69 61.75 3m47 s THR 40 Cb 0.00 -0.93 0.00 0.00 0.01 0.00 0.00 72.50 71.58 3m47 s THR 40 CO 0.00 0.34 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.41 3m47 s VAL 41 N 1.34 1.44 -0.22 3.82 1.01 -0.17 -2.05 120.40 125.56 3m47 s VAL 41 Ca -0.03 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 3m47 s VAL 41 Cb -0.14 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 3m47 s VAL 41 CO -0.04 0.42 0.19 -0.75 0.00 0.00 0.00 175.10 174.92 3m47 s LYS 42 N 0.27 4.11 0.11 2.72 2.20 0.38 -1.14 119.74 128.39 3m47 s LYS 42 Ca -0.09 -0.19 0.09 0.00 -0.36 0.00 0.00 55.97 55.41 3m47 s LYS 42 Cb -0.14 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.63 3m47 s LYS 42 CO 0.04 0.10 -0.22 0.96 -0.36 0.00 0.00 175.35 175.87 3m47 s ILE 43 N 0.93 1.82 0.15 5.43 -5.25 -0.50 -1.23 121.20 122.55 3m47 s ILE 43 Ca 0.09 -1.57 0.00 0.00 -0.99 0.00 0.00 60.65 58.18 3m47 s ILE 43 Cb -0.13 -1.64 -0.00 0.00 2.95 0.00 0.00 42.46 43.64 3m47 s ILE 43 CO 0.04 -0.02 0.01 0.61 -1.79 0.00 0.00 174.94 173.78 3m47 n GLY 44 N 1.08 3.98 0.31 6.27 0.00 -1.26 -0.20 105.19 115.37 3m47 n GLY 44 Ca -0.19 -2.22 -0.02 0.00 0.00 0.00 0.00 46.02 43.59 3m47 n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3m47 h TYR 45 N 1.10 0.87 -0.71 1.61 0.99 -1.96 -2.89 116.97 115.97 3m47 h TYR 45 Ca -0.13 -0.07 0.09 0.00 2.00 0.00 0.00 58.73 60.63 3m47 h TYR 45 Cb 0.39 -0.26 -0.07 0.00 1.00 0.00 0.00 36.73 37.79 3m47 h TYR 45 CO 0.00 0.70 0.36 -1.35 -0.00 0.00 0.00 178.16 177.87 3m47 h PRO 46 N 0.83 0.61 0.02 4.88 0.11 -1.95 0.30 132.00 136.79 3m47 h PRO 46 Ca 0.19 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 3m47 h PRO 46 Cb 0.24 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3m47 h PRO 46 CO -0.01 0.40 -0.01 1.25 -0.21 0.00 0.00 178.00 179.42 3m47 h LEU 47 N 0.63 -0.02 -0.81 2.35 5.85 -1.76 -2.34 115.31 119.20 3m47 h LEU 47 Ca 0.34 -0.40 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 3m47 h LEU 47 Cb 0.34 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 3m47 h LEU 47 CO -0.25 0.39 -0.33 -0.37 -0.34 0.00 0.00 178.44 177.54 3m47 h VAL 48 N -0.44 1.29 -0.11 1.05 -1.51 -1.26 0.77 116.25 116.04 3m47 h VAL 48 Ca -0.00 -1.43 -0.12 0.00 -1.23 0.00 0.00 66.70 63.92 3m47 h VAL 48 Cb 0.42 1.46 -0.01 0.00 -2.13 0.00 0.00 31.29 31.02 3m47 h VAL 48 CO 0.00 0.45 -0.46 -0.07 -1.23 0.00 0.00 177.57 176.27 3m47 h LEU 49 N 0.44 0.27 0.04 4.19 3.38 -0.49 0.22 115.31 123.36 3m47 h LEU 49 Ca 0.05 -0.12 -0.27 0.00 0.09 0.00 0.00 57.88 57.62 3m47 h LEU 49 Cb 0.79 -0.08 0.02 0.00 0.09 0.00 0.00 40.66 41.48 3m47 h LEU 49 CO 0.06 0.70 -1.17 0.28 0.09 0.00 0.00 178.44 178.40 3m47 h SER 50 N 0.21 0.68 0.00 -0.43 0.02 -1.00 -3.39 113.55 109.63 3m47 h SER 50 Ca 0.01 -0.62 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 3m47 h SER 50 Cb 0.89 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.22 3m47 h SER 50 CO 0.07 1.45 -0.57 -0.62 -1.14 0.00 0.00 176.83 176.02 3m47 n GLU 51 N -3.72 3.62 0.00 3.45 -0.58 0.23 -5.05 120.64 118.58 3m47 n GLU 51 Ca -0.11 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 3m47 n GLU 51 Cb 0.96 -0.92 0.00 0.00 -0.57 0.00 0.00 31.44 30.91 3m47 n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3m47 n GLY 52 N 1.38 2.30 0.15 0.62 0.00 0.77 -4.72 105.19 105.68 3m47 n GLY 52 Ca 0.01 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.42 3m47 n GLY 52 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3m47 n MET 53 N 1.73 0.19 0.24 1.61 2.81 -1.25 -2.20 117.12 120.26 3m47 n MET 53 Ca 0.00 0.49 0.17 0.00 -1.81 0.00 0.00 57.70 56.54 3m47 n MET 53 Cb 0.00 -1.92 0.83 0.00 -0.71 0.00 0.00 33.22 31.43 3m47 n MET 53 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3m47 h ASP 54 N 0.00 0.00 0.44 7.83 3.32 -1.92 -1.92 116.42 124.17 3m47 h ASP 54 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3m47 h ASP 54 Cb 0.28 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 3m47 h ASP 54 CO 0.00 0.00 -0.09 -0.29 -1.72 0.00 0.00 179.24 177.14 3m47 h ILE 55 N 0.00 0.41 0.18 0.35 2.10 -1.73 -2.61 117.51 116.21 3m47 h ILE 55 Ca 0.00 -0.49 -0.01 0.00 1.08 0.00 0.00 64.86 65.44 3m47 h ILE 55 Cb 0.13 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 37.21 3m47 h ILE 55 CO 0.00 0.09 -0.09 0.40 -1.08 0.00 0.00 178.15 177.47 3m47 h ILE 56 N 0.00 0.90 -0.09 2.19 2.04 -1.59 -1.50 117.51 119.46 3m47 h ILE 56 Ca -0.00 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 3m47 h ILE 56 Cb 0.34 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 3m47 h ILE 56 CO 0.01 0.08 -0.03 0.00 0.00 0.00 0.00 178.15 178.21 3m47 h ALA 57 N 0.39 1.79 -0.40 1.87 0.00 -1.56 -2.40 119.26 118.95 3m47 h ALA 57 Ca -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3m47 h ALA 57 Cb 0.31 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3m47 h ALA 57 CO 0.04 0.16 0.07 1.49 0.00 0.00 0.00 179.25 181.01 3m47 h GLU 58 N 0.12 0.66 -0.17 0.00 4.81 -1.09 -1.21 114.58 117.70 3m47 h GLU 58 Ca 0.03 -0.18 0.02 0.00 -0.13 0.00 0.00 59.36 59.10 3m47 h GLU 58 Cb 0.14 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3m47 h GLU 58 CO 0.01 0.71 0.05 0.74 -0.73 0.00 0.00 179.01 179.78 3m47 h PHE 59 N 0.51 0.09 -0.81 0.92 -1.00 -0.81 -0.07 116.94 115.77 3m47 h PHE 59 Ca 0.12 0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.87 3m47 h PHE 59 Cb 0.36 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 39.87 3m47 h PHE 59 CO 0.02 0.04 0.36 0.00 -1.61 0.00 0.00 178.31 177.12 3m47 h ARG 60 N 0.13 1.19 -0.12 1.51 3.08 -1.31 -0.79 114.38 118.07 3m47 h ARG 60 Ca 0.07 -0.20 -0.13 0.00 0.07 0.00 0.00 59.98 59.80 3m47 h ARG 60 Cb 0.05 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.91 3m47 h ARG 60 CO -0.09 0.94 -0.44 0.87 -1.07 0.00 0.00 179.97 180.19 3m47 h LYS 61 N 1.17 0.51 0.00 0.04 1.57 -1.10 0.18 116.57 118.93 3m47 h LYS 61 Ca 0.28 -0.39 -0.12 0.00 -1.87 0.00 0.00 60.65 58.55 3m47 h LYS 61 Cb 0.17 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 3m47 h LYS 61 CO -0.03 1.01 -0.57 0.00 -0.57 0.00 0.00 179.45 179.29 3m47 h ARG 62 N 0.11 0.00 0.00 3.15 3.08 -0.88 -3.35 114.38 116.48 3m47 h ARG 62 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3m47 h ARG 62 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 3m47 h ARG 62 CO 0.09 0.57 -0.09 1.19 -1.07 0.00 0.00 179.97 180.66 3m47 n PHE 63 N -3.59 0.00 -2.11 3.04 0.99 -0.31 -5.01 117.46 110.47 3m47 n PHE 63 Ca -0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.27 3m47 n PHE 63 Cb 0.63 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 39.09 3m47 n PHE 63 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3m47 n GLY 64 N 1.03 0.20 3.92 1.37 0.00 0.64 -5.00 105.19 107.36 3m47 n GLY 64 Ca 0.00 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 3m47 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 s ARG 66 N -3.82 4.51 -0.17 0.00 3.52 0.59 -4.42 118.95 119.15 3m47 s ARG 66 Ca 0.42 1.66 0.00 0.00 -0.13 0.00 0.00 55.73 57.68 3m47 s ARG 66 Cb -0.10 -2.98 0.00 0.00 -1.56 0.00 0.00 34.95 30.31 3m47 s ARG 66 CO 0.32 0.14 -0.16 0.42 -0.81 0.00 0.00 175.30 175.21 3m47 s ILE 67 N -1.33 2.52 -0.27 4.11 -1.09 -1.26 -1.00 121.20 122.87 3m47 s ILE 67 Ca 0.48 -0.81 -0.10 0.00 -2.23 0.00 0.00 60.65 58.00 3m47 s ILE 67 Cb -0.28 -2.07 -0.04 0.00 -1.58 0.00 0.00 42.46 38.49 3m47 s ILE 67 CO 0.35 0.51 0.15 -0.63 -1.23 0.00 0.00 174.94 174.10 3m47 s ILE 68 N 1.02 4.96 -0.52 2.92 1.01 -0.29 -1.12 121.20 129.19 3m47 s ILE 68 Ca -0.02 0.05 -0.25 0.00 0.00 0.00 0.00 60.65 60.43 3m47 s ILE 68 Cb -0.15 -3.35 0.04 0.00 0.01 0.00 0.00 42.46 39.01 3m47 s ILE 68 CO -0.04 0.28 0.94 0.00 0.00 0.00 0.00 174.94 176.11 3m47 s ALA 69 N 1.71 3.18 -1.27 9.38 0.00 0.32 -1.41 121.76 133.67 3m47 s ALA 69 Ca 0.07 -1.08 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 3m47 s ALA 69 Cb -0.16 -3.70 0.14 0.00 0.00 0.00 0.00 23.12 19.40 3m47 s ALA 69 CO 0.08 -2.27 1.70 -3.47 0.00 0.00 0.00 175.76 171.80 3m47 n ASP 70 N 7.37 5.02 -0.62 0.00 2.03 0.72 -1.36 116.55 129.71 3m47 n ASP 70 Ca 0.03 -3.00 0.09 0.00 0.52 0.00 0.00 54.79 52.44 3m47 n ASP 70 Cb 0.48 -1.57 0.04 0.00 -0.72 0.00 0.00 41.12 39.35 3m47 n ASP 70 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3m47 n PHE 71 N 5.47 0.00 -4.15 -0.67 0.99 -1.25 -4.18 117.46 113.68 3m47 n PHE 71 Ca 0.41 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 57.45 3m47 n PHE 71 Cb 0.41 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.87 3m47 n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3m47 n LYS 72 N 0.57 -0.45 -1.74 -1.08 5.02 -0.62 -4.75 118.16 115.10 3m47 n LYS 72 Ca 0.10 0.05 -0.42 0.00 -2.02 0.00 0.00 58.31 56.02 3m47 n LYS 72 Cb 0.44 -2.71 -0.03 0.00 -0.02 0.00 0.00 35.03 32.71 3m47 n LYS 72 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3m47 s VAL 73 N -3.83 2.11 -0.34 -0.18 1.01 -0.93 -4.40 120.40 113.84 3m47 s VAL 73 Ca 0.33 0.05 0.15 0.00 0.00 0.00 0.00 61.98 62.51 3m47 s VAL 73 Cb -0.18 -3.03 0.43 0.00 0.00 0.00 0.00 36.38 33.60 3m47 s VAL 73 CO 0.96 0.00 1.26 0.00 0.00 0.00 0.00 175.10 177.32 3m47 n ALA 74 N 4.13 2.42 -4.11 5.51 0.00 -1.26 -0.99 120.51 126.21 3m47 n ALA 74 Ca 0.16 -1.93 -0.11 0.00 0.00 0.00 0.00 53.44 51.55 3m47 n ALA 74 Cb 0.36 -0.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 3m47 n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3m47 n ASP 75 N -0.70 2.27 -4.75 0.00 -0.08 -1.26 -4.97 116.55 107.07 3m47 n ASP 75 Ca -0.02 -1.75 -0.30 0.00 -1.51 0.00 0.00 54.79 51.20 3m47 n ASP 75 Cb 0.84 0.09 0.11 0.00 2.34 0.00 0.00 41.12 44.50 3m47 n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3m47 s ILE 76 N -1.47 3.05 0.19 5.18 -4.36 -1.26 -4.70 121.20 117.83 3m47 s ILE 76 Ca 0.03 0.34 -0.13 0.00 -0.26 0.00 0.00 60.65 60.63 3m47 s ILE 76 Cb -0.00 -2.83 0.11 0.00 1.25 0.00 0.00 42.46 40.99 3m47 s ILE 76 CO 0.02 -0.45 1.72 -0.65 0.24 0.00 0.00 174.94 175.82 3m47 h PRO 77 N -1.30 0.23 -0.61 0.37 0.11 -1.88 0.21 132.00 129.14 3m47 h PRO 77 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 3m47 h PRO 77 Cb 1.25 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3m47 h PRO 77 CO 0.53 0.15 0.17 1.49 -0.21 0.00 0.00 178.00 180.13 3m47 h GLU 78 N 0.24 0.93 -0.16 1.05 4.81 -1.94 -0.73 114.58 118.77 3m47 h GLU 78 Ca 0.25 -0.19 -0.21 0.00 -0.13 0.00 0.00 59.36 59.09 3m47 h GLU 78 Cb 0.34 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.59 3m47 h GLU 78 CO -0.33 0.81 -0.72 1.15 -0.73 0.00 0.00 179.01 179.19 3m47 h THR 79 N 0.90 1.30 -0.80 0.32 2.02 -1.82 -2.85 112.91 111.97 3m47 h THR 79 Ca 0.20 -1.96 0.06 0.00 0.77 0.00 0.00 66.41 65.48 3m47 h THR 79 Cb 0.29 1.94 -0.06 0.00 -1.74 0.00 0.00 68.15 68.57 3m47 h THR 79 CO -0.01 0.62 0.49 0.78 0.37 0.00 0.00 175.52 177.77 3m47 h ASN 80 N 0.50 0.76 -0.52 4.18 4.21 -0.40 -0.41 115.58 123.91 3m47 h ASN 80 Ca -0.03 0.02 0.07 0.00 1.21 0.00 0.00 56.30 57.57 3m47 h ASN 80 Cb 1.33 -0.14 -0.06 0.00 -1.12 0.00 0.00 38.32 38.33 3m47 h ASN 80 CO 0.14 0.49 0.19 -0.33 -1.29 0.00 0.00 177.43 176.64 3m47 h GLU 81 N 0.89 0.36 -0.32 0.81 5.08 -1.05 -0.67 114.58 119.68 3m47 h GLU 81 Ca 0.35 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.54 3m47 h GLU 81 Cb 0.16 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3m47 h GLU 81 CO -0.17 0.24 -0.39 0.87 -1.00 0.00 0.00 179.01 178.56 3m47 h LYS 82 N 0.37 0.76 -0.27 2.33 1.57 -1.13 -0.25 116.57 119.95 3m47 h LYS 82 Ca 0.25 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 3m47 h LYS 82 Cb 0.27 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3m47 h LYS 82 CO -0.25 1.02 0.13 0.82 -0.57 0.00 0.00 179.45 180.59 3m47 h ILE 83 N 0.62 1.15 -0.58 1.86 2.04 -0.82 -1.18 117.51 120.61 3m47 h ILE 83 Ca 0.05 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.43 3m47 h ILE 83 Cb 0.94 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 3m47 h ILE 83 CO 0.09 0.16 0.24 0.00 0.00 0.00 0.00 178.15 178.64 3m47 h ARG 85 N 0.80 0.69 -0.65 0.00 2.43 -0.87 0.42 114.38 117.20 3m47 h ARG 85 Ca 0.20 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3m47 h ARG 85 Cb 0.19 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3m47 h ARG 85 CO -0.02 0.62 0.20 0.00 -1.51 0.00 0.00 179.97 179.26 3m47 h ALA 86 N 1.03 1.14 -0.25 2.80 0.00 -1.07 0.31 119.26 123.22 3m47 h ALA 86 Ca 0.15 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 3m47 h ALA 86 Cb 0.18 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3m47 h ALA 86 CO -0.01 0.60 -0.45 1.15 0.00 0.00 0.00 179.25 180.53 3m47 h THR 87 N 0.96 1.30 -0.36 0.00 2.02 -0.78 -1.95 112.91 114.08 3m47 h THR 87 Ca 0.21 -1.65 -0.13 0.00 0.77 0.00 0.00 66.41 65.61 3m47 h THR 87 Cb 0.27 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3m47 h THR 87 CO -0.01 0.53 -0.29 -0.26 0.37 0.00 0.00 175.52 175.86 3m47 h PHE 88 N 0.49 0.90 -0.57 3.16 0.04 -0.83 -2.44 116.94 117.69 3m47 h PHE 88 Ca 0.02 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.55 3m47 h PHE 88 Cb 1.06 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.97 3m47 h PHE 88 CO 0.08 0.97 0.33 0.87 -0.60 0.00 0.00 178.31 179.96 3m47 h LYS 89 N 0.66 0.77 0.00 1.51 1.57 -0.83 0.60 116.57 120.86 3m47 h LYS 89 Ca 0.08 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3m47 h LYS 89 Cb 0.82 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3m47 h LYS 89 CO 0.07 0.55 0.00 0.00 -0.57 0.00 0.00 179.45 179.50 3m47 n ALA 90 N -2.45 2.07 0.00 3.86 0.00 -0.74 -4.87 120.51 118.37 3m47 n ALA 90 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3m47 n ALA 90 Cb 0.08 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.22 3m47 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m47 n GLY 91 N 0.30 0.69 3.77 0.00 0.00 0.20 -3.60 105.19 106.55 3m47 n GLY 91 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3m47 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 s ALA 92 N -2.00 3.65 0.07 4.61 0.00 -0.94 -4.84 121.76 122.31 3m47 s ALA 92 Ca 0.00 1.58 0.09 0.00 0.00 0.00 0.00 51.96 53.63 3m47 s ALA 92 Cb 0.00 -3.63 -0.11 0.00 0.00 0.00 0.00 23.12 19.38 3m47 s ALA 92 CO 0.00 -1.03 1.34 -0.44 0.00 0.00 0.00 175.76 175.63 3m47 h ASP 93 N 3.77 0.00 -5.11 0.00 3.32 -1.47 -3.42 116.42 113.52 3m47 h ASP 93 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 3m47 h ASP 93 Cb 1.23 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3m47 h ASP 93 CO 0.70 0.87 -0.09 0.00 -1.72 0.00 0.00 179.24 179.00 3m47 s ALA 94 N -2.82 -0.77 0.00 3.45 0.00 -1.01 -1.94 121.76 118.68 3m47 s ALA 94 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 51.96 51.74 3m47 s ALA 94 Cb 0.10 0.75 -0.00 0.00 0.00 0.00 0.00 23.12 23.96 3m47 s ALA 94 CO 0.80 -0.68 -0.02 -1.50 0.00 0.00 0.00 175.76 174.36 3m47 s ILE 95 N -3.85 0.14 -0.18 0.00 2.07 -0.63 -0.52 121.20 118.24 3m47 s ILE 95 Ca 0.07 -0.15 -0.13 0.00 -1.41 0.00 0.00 60.65 59.03 3m47 s ILE 95 Cb 0.01 -0.14 -0.05 0.00 0.13 0.00 0.00 42.46 42.42 3m47 s ILE 95 CO -0.08 -0.01 0.25 -0.63 -1.91 0.00 0.00 174.94 172.57 3m47 s ILE 96 N -0.16 5.33 0.03 2.00 1.01 -0.46 -0.55 121.20 128.40 3m47 s ILE 96 Ca -0.01 0.45 0.05 0.00 0.00 0.00 0.00 60.65 61.15 3m47 s ILE 96 Cb -0.01 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.84 3m47 s ILE 96 CO -0.00 0.39 -0.15 0.68 0.00 0.00 0.00 174.94 175.87 3m47 s VAL 97 N 0.50 1.16 0.43 2.92 -7.23 -0.03 -1.59 120.40 116.56 3m47 s VAL 97 Ca 0.14 -0.92 -0.23 0.00 -1.81 0.00 0.00 61.98 59.16 3m47 s VAL 97 Cb -0.13 -1.03 -0.08 0.00 0.56 0.00 0.00 36.38 35.71 3m47 s VAL 97 CO 0.03 0.10 1.11 -1.00 -0.31 0.00 0.00 175.10 175.02 3m47 s HIS 98 N -0.72 3.06 -0.37 2.82 3.76 -0.16 -0.78 115.29 122.90 3m47 s HIS 98 Ca 0.03 1.59 0.22 0.00 -0.15 0.00 0.00 55.06 56.75 3m47 s HIS 98 Cb -0.07 -3.25 -0.11 0.00 1.11 0.00 0.00 32.58 30.26 3m47 s HIS 98 CO 0.01 -1.07 0.84 0.41 -0.85 0.00 0.00 174.74 174.08 3m47 n GLY 99 N 0.36 -1.18 0.37 -2.22 0.00 -1.24 -4.51 105.19 96.77 3m47 n GLY 99 Ca 0.06 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.77 3m47 n GLY 99 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3m47 h PHE 100 N 0.00 0.71 0.00 1.61 3.57 -1.94 0.03 116.94 120.93 3m47 h PHE 100 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3m47 h PHE 100 Cb 0.86 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.37 3m47 h PHE 100 CO 0.00 0.30 0.00 -2.30 -2.23 0.00 0.00 178.31 174.08 3m47 n PRO 101 N -4.52 0.65 0.00 6.41 -0.02 -1.26 -4.98 135.00 131.28 3m47 n PRO 101 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3m47 n PRO 101 Cb 0.41 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 3m47 n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m47 n GLY 102 N 0.28 0.69 0.26 -1.23 0.00 -0.01 -4.57 105.19 100.62 3m47 n GLY 102 Ca 0.14 -2.09 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 3m47 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m47 h ALA 103 N 0.00 0.58 -0.13 4.61 0.00 -1.94 -2.46 119.26 119.92 3m47 h ALA 103 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 3m47 h ALA 103 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3m47 h ALA 103 CO 0.00 0.61 -0.36 0.38 0.00 0.00 0.00 179.25 179.88 3m47 h ASP 104 N 0.73 0.28 -0.29 0.00 3.04 -1.99 0.12 116.42 118.30 3m47 h ASP 104 Ca 0.08 -0.11 -0.13 0.00 -3.24 0.00 0.00 57.03 53.64 3m47 h ASP 104 Cb 0.87 -0.08 -0.01 0.00 -1.04 0.00 0.00 39.33 39.07 3m47 h ASP 104 CO 0.08 0.62 -0.27 0.28 -2.04 0.00 0.00 179.24 177.91 3m47 h SER 105 N 0.23 0.82 -0.32 4.15 0.02 -1.76 -1.70 113.55 114.99 3m47 h SER 105 Ca 0.03 -0.32 -0.12 0.00 -0.84 0.00 0.00 61.79 60.54 3m47 h SER 105 Cb 0.75 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3m47 h SER 105 CO 0.06 1.04 -0.26 0.58 -1.14 0.00 0.00 176.83 177.11 3m47 h VAL 106 N 0.68 1.29 -0.70 2.27 2.07 -0.96 -3.20 116.25 117.69 3m47 h VAL 106 Ca 0.08 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.19 3m47 h VAL 106 Cb 0.80 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 3m47 h VAL 106 CO 0.07 0.46 0.45 -0.09 0.02 0.00 0.00 177.57 178.47 3m47 h ARG 107 N 0.49 0.94 -0.99 1.57 2.43 -0.59 -1.14 114.38 117.10 3m47 h ARG 107 Ca 0.06 -0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 3m47 h ARG 107 Cb 0.82 -0.21 -0.08 0.00 -0.42 0.00 0.00 29.97 30.08 3m47 h ARG 107 CO 0.07 0.63 0.63 0.00 -1.51 0.00 0.00 179.97 179.79 3m47 h ALA 108 N 1.54 1.54 -0.18 2.80 0.00 -1.31 0.14 119.26 123.80 3m47 h ALA 108 Ca 0.26 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 3m47 h ALA 108 Cb -0.08 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 3m47 h ALA 108 CO -0.05 0.23 -0.28 0.00 0.00 0.00 0.00 179.25 179.15 3m47 h LEU 110 N 0.15 0.93 -0.23 0.00 3.38 -0.55 -1.06 115.31 117.93 3m47 h LEU 110 Ca 0.02 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3m47 h LEU 110 Cb 0.85 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3m47 h LEU 110 CO 0.06 0.67 0.14 0.78 0.09 0.00 0.00 178.44 180.18 3m47 h ASN 111 N 1.09 0.24 -0.48 -0.43 2.35 -0.68 -0.66 115.58 117.01 3m47 h ASN 111 Ca 0.31 -0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.93 3m47 h ASN 111 Cb -0.10 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 3m47 h ASN 111 CO -0.07 0.17 -0.20 0.58 -1.65 0.00 0.00 177.43 176.26 3m47 h VAL 112 N 0.29 1.27 -0.72 2.81 2.07 -1.32 -1.95 116.25 118.70 3m47 h VAL 112 Ca 0.09 -1.36 0.04 0.00 0.82 0.00 0.00 66.70 66.28 3m47 h VAL 112 Cb -0.02 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 3m47 h VAL 112 CO -0.03 0.47 0.45 0.00 0.02 0.00 0.00 177.57 178.48 3m47 h ALA 113 N 0.86 0.95 -0.37 1.67 0.00 -1.01 -0.24 119.26 121.12 3m47 h ALA 113 Ca 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3m47 h ALA 113 Cb 0.78 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3m47 h ALA 113 CO 0.06 0.22 -0.01 1.49 0.00 0.00 0.00 179.25 181.01 3m47 h GLU 114 N 0.87 0.66 -0.66 0.00 4.81 -0.95 0.13 114.58 119.43 3m47 h GLU 114 Ca 0.29 -0.21 0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3m47 h GLU 114 Cb 0.04 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.30 3m47 h GLU 114 CO -0.12 0.77 0.32 1.49 -0.73 0.00 0.00 179.01 180.74 3m47 h GLU 115 N 0.47 0.55 -0.03 1.92 4.81 -1.07 -3.08 114.58 118.15 3m47 h GLU 115 Ca 0.10 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3m47 h GLU 115 Cb 0.48 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.73 3m47 h GLU 115 CO 0.02 0.37 0.00 -1.33 -0.73 0.00 0.00 179.01 177.34 3m47 n MET 116 N -4.88 2.20 -2.70 1.92 2.81 -0.13 -4.96 117.12 111.40 3m47 n MET 116 Ca 0.09 -1.74 -0.10 0.00 -1.81 0.00 0.00 57.70 54.14 3m47 n MET 116 Cb 0.24 -1.46 0.02 0.00 -0.71 0.00 0.00 33.22 31.31 3m47 n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3m47 n GLY 117 N 1.32 0.22 1.56 3.03 0.00 0.03 -5.05 105.19 106.30 3m47 n GLY 117 Ca 0.15 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 3m47 n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m47 n ARG 118 N -2.21 1.39 -4.45 1.61 5.12 0.23 -5.03 116.66 113.31 3m47 n ARG 118 Ca -0.03 -1.59 -0.24 0.00 -1.93 0.00 0.00 57.85 54.06 3m47 n ARG 118 Cb 0.54 0.48 -0.13 0.00 -1.16 0.00 0.00 32.46 32.19 3m47 n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3m47 s GLU 119 N -2.78 1.22 -0.14 5.56 0.41 -0.82 -4.47 118.70 117.68 3m47 s GLU 119 Ca 0.01 -1.01 -0.02 0.00 -0.41 0.00 0.00 54.97 53.54 3m47 s GLU 119 Cb 0.00 -1.38 -0.02 0.00 -1.78 0.00 0.00 34.13 30.95 3m47 s GLU 119 CO 0.01 0.34 -0.08 0.08 -0.49 0.00 0.00 175.26 175.12 3m47 s VAL 120 N -0.97 3.51 -0.20 2.63 1.01 -1.26 -1.60 120.40 123.53 3m47 s VAL 120 Ca 0.06 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.46 3m47 s VAL 120 Cb -0.09 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 3m47 s VAL 120 CO 0.03 0.51 0.08 -0.36 0.00 0.00 0.00 175.10 175.36 3m47 s PHE 121 N 0.27 3.23 -0.22 5.22 0.40 0.29 -4.07 117.98 123.10 3m47 s PHE 121 Ca -0.06 0.03 -0.19 0.00 -0.60 0.00 0.00 56.93 56.10 3m47 s PHE 121 Cb -0.15 -2.13 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 3m47 s PHE 121 CO 0.04 0.07 0.57 -1.17 0.70 0.00 0.00 175.22 175.43 3m47 s LEU 122 N 0.64 4.12 -0.41 -0.37 2.96 0.01 -0.85 118.68 124.77 3m47 s LEU 122 Ca 0.04 0.70 -0.27 0.00 -0.22 0.00 0.00 54.13 54.39 3m47 s LEU 122 Cb -0.13 -2.78 0.02 0.00 0.50 0.00 0.00 46.19 43.80 3m47 s LEU 122 CO 0.01 -0.26 0.99 -0.22 -1.32 0.00 0.00 176.35 175.55 3m47 s LEU 123 N 1.96 3.91 0.11 -0.68 2.96 0.04 -0.80 118.68 126.19 3m47 s LEU 123 Ca 0.25 0.49 0.19 0.00 -0.22 0.00 0.00 54.13 54.85 3m47 s LEU 123 Cb -0.16 -3.34 -0.09 0.00 0.50 0.00 0.00 46.19 43.11 3m47 s LEU 123 CO 0.10 -0.99 0.88 0.35 -1.32 0.00 0.00 176.35 175.36 3m47 n THR 124 N 6.26 0.90 -3.59 3.68 -2.24 -0.81 -3.61 114.28 114.86 3m47 n THR 124 Ca 0.08 -0.63 -0.07 0.00 -2.27 0.00 0.00 64.05 61.16 3m47 n THR 124 Cb 0.48 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 68.16 3m47 n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3m47 s GLU 125 N -3.13 1.07 0.16 -0.78 2.12 -1.26 -4.28 118.70 112.60 3m47 s GLU 125 Ca -0.02 -0.48 0.04 0.00 0.36 0.00 0.00 54.97 54.87 3m47 s GLU 125 Cb 0.09 0.44 -0.05 0.00 0.26 0.00 0.00 34.13 34.87 3m47 s GLU 125 CO 0.81 -0.48 -0.08 -1.64 -0.54 0.00 0.00 175.26 173.33 3m47 s MET 126 N -3.32 1.11 0.00 4.30 -1.94 -1.26 -4.48 119.30 113.70 3m47 s MET 126 Ca 0.07 -1.49 0.09 0.00 -1.71 0.00 0.00 55.69 52.65 3m47 s MET 126 Cb -0.01 -0.60 0.03 0.00 2.01 0.00 0.00 34.83 36.25 3m47 s MET 126 CO -0.05 0.04 0.68 -1.13 -0.01 0.00 0.00 175.02 174.54 3m47 n SER 127 N -0.24 1.41 -4.81 3.03 3.41 -1.26 -4.80 113.62 110.36 3m47 n SER 127 Ca -0.09 -1.20 -0.32 0.00 -0.26 0.00 0.00 58.87 57.00 3m47 n SER 127 Cb 0.61 0.29 0.04 0.00 -0.26 0.00 0.00 64.21 64.89 3m47 n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3m47 s HIS 128 N -1.10 3.01 0.24 7.33 -3.43 -1.26 -4.92 115.29 115.15 3m47 s HIS 128 Ca 0.09 1.47 -0.05 0.00 -0.80 0.00 0.00 55.06 55.78 3m47 s HIS 128 Cb 0.08 -2.96 0.42 0.00 -1.43 0.00 0.00 32.58 28.69 3m47 s HIS 128 CO 0.19 -1.23 1.75 -1.35 -2.00 0.00 0.00 174.74 172.10 3m47 h PRO 129 N -0.22 0.50 0.00 -0.38 0.11 -2.05 -0.01 132.00 129.95 3m47 h PRO 129 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3m47 h PRO 129 Cb 1.22 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3m47 h PRO 129 CO 0.57 0.33 0.02 0.78 -0.21 0.00 0.00 178.00 179.49 3m47 h GLY 130 N 0.52 0.00 2.00 -0.55 0.00 -1.99 -2.53 103.07 100.53 3m47 h GLY 130 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 3m47 h GLY 130 CO -0.35 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.19 3m47 h ALA 131 N 1.95 1.00 0.00 3.60 0.00 -1.30 -2.13 119.26 122.38 3m47 h ALA 131 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3m47 h ALA 131 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3m47 h ALA 131 CO 0.00 0.00 -0.16 1.49 0.00 0.00 0.00 179.25 180.58 3m47 h GLU 132 N 0.00 0.00 -0.24 0.00 4.22 -1.64 0.05 114.58 116.97 3m47 h GLU 132 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 3m47 h GLU 132 Cb 0.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3m47 h GLU 132 CO 0.00 0.16 0.06 0.52 -2.18 0.00 0.00 179.01 177.58 3m47 h MET 133 N 0.00 0.38 0.00 1.92 0.00 -1.63 -3.41 114.93 112.18 3m47 h MET 133 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 59.70 59.61 3m47 h MET 133 Cb 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 31.60 31.89 3m47 h MET 133 CO 0.02 0.48 -0.27 1.19 0.00 0.00 0.00 176.91 178.32 3m47 n PHE 134 N -4.74 0.00 -0.04 -0.22 3.01 -1.23 -4.89 117.46 109.34 3m47 n PHE 134 Ca -0.03 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.29 3m47 n PHE 134 Cb 0.17 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.56 3m47 n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3m47 h ILE 135 N 0.00 1.40 -0.48 4.37 2.04 -1.67 -3.14 117.51 120.03 3m47 h ILE 135 Ca 0.00 -1.54 0.06 0.00 1.00 0.00 0.00 64.86 64.38 3m47 h ILE 135 Cb 0.27 2.14 -0.05 0.00 -0.74 0.00 0.00 36.82 38.44 3m47 h ILE 135 CO 0.00 0.45 0.17 -0.61 0.00 0.00 0.00 178.15 178.16 3m47 h GLN 136 N -0.11 0.34 0.00 2.37 4.15 -1.24 -1.20 115.11 119.41 3m47 h GLN 136 Ca -0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3m47 h GLN 136 Cb 0.83 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3m47 h GLN 136 CO 0.05 0.22 0.00 0.78 -1.93 0.00 0.00 178.83 177.95 3m47 h GLY 137 N 0.35 0.00 0.09 2.39 0.00 -1.82 -2.76 103.07 101.32 3m47 h GLY 137 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3m47 h GLY 137 CO -0.23 0.00 -1.06 0.00 0.00 0.00 0.00 176.54 175.25 3m47 n ALA 138 N -1.96 4.46 -0.01 3.60 0.00 -0.53 -4.69 120.51 121.39 3m47 n ALA 138 Ca -0.00 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.77 3m47 n ALA 138 Cb 0.20 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 18.80 3m47 n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m47 h ALA 139 N 2.89 0.11 -0.72 0.00 0.00 -1.05 0.37 119.26 120.86 3m47 h ALA 139 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3m47 h ALA 139 Cb 0.55 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3m47 h ALA 139 CO 0.00 -0.45 0.42 -0.44 0.00 0.00 0.00 179.25 178.78 3m47 h ASP 140 N 0.05 0.88 -0.08 0.00 5.19 -1.83 -0.49 116.42 120.14 3m47 h ASP 140 Ca 0.06 -0.08 -0.11 0.00 -0.62 0.00 0.00 57.03 56.28 3m47 h ASP 140 Cb 0.06 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 3m47 h ASP 140 CO -0.09 0.70 -0.31 -0.08 -3.12 0.00 0.00 179.24 176.34 3m47 h GLU 141 N 0.99 0.54 -0.44 3.56 4.81 -1.75 -0.92 114.58 121.37 3m47 h GLU 141 Ca 0.26 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 3m47 h GLU 141 Cb -0.01 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 3m47 h GLU 141 CO -0.05 0.79 0.09 0.82 -0.73 0.00 0.00 179.01 179.93 3m47 h ILE 142 N 0.47 1.24 -0.57 2.32 2.04 -0.49 0.23 117.51 122.74 3m47 h ILE 142 Ca 0.06 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.06 3m47 h ILE 142 Cb 0.77 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 3m47 h ILE 142 CO 0.06 0.30 0.37 0.00 0.00 0.00 0.00 178.15 178.89 3m47 h ALA 143 N 0.95 0.72 -0.56 1.87 0.00 -0.82 -1.14 119.26 120.28 3m47 h ALA 143 Ca 0.14 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3m47 h ALA 143 Cb 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3m47 h ALA 143 CO 0.01 0.17 0.10 0.00 0.00 0.00 0.00 179.25 179.53 3m47 h ARG 144 N 0.77 0.89 -0.43 0.00 3.08 -0.96 -1.56 114.38 116.17 3m47 h ARG 144 Ca 0.21 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.08 3m47 h ARG 144 Cb -0.08 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 3m47 h ARG 144 CO -0.04 0.82 0.25 1.98 -1.07 0.00 0.00 179.97 181.90 3m47 h MET 145 N 0.84 0.48 -0.22 0.04 4.05 -0.41 -0.43 114.93 119.28 3m47 h MET 145 Ca 0.18 -0.03 0.05 0.00 -0.28 0.00 0.00 59.70 59.62 3m47 h MET 145 Cb 0.36 -0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 31.00 3m47 h MET 145 CO 0.01 0.32 -0.11 0.78 0.23 0.00 0.00 176.91 178.13 3m47 h GLY 146 N 0.50 0.07 0.73 1.39 0.00 -0.71 -1.81 103.07 103.25 3m47 h GLY 146 Ca 0.18 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.70 3m47 h GLY 146 CO -0.09 -0.13 0.43 -2.08 0.00 0.00 0.00 176.54 174.67 3m47 h VAL 147 N -0.09 1.02 0.00 4.60 2.07 -0.86 -0.31 116.25 122.68 3m47 h VAL 147 Ca 0.12 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3m47 h VAL 147 Cb 0.26 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 3m47 h VAL 147 CO -0.27 0.15 -0.13 0.44 0.02 0.00 0.00 177.57 177.77 3m47 h ASP 148 N 0.81 0.00 0.03 0.57 3.32 -0.65 -1.77 116.42 118.72 3m47 h ASP 148 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 3m47 h ASP 148 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3m47 h ASP 148 CO -0.16 0.13 -0.09 0.18 -1.72 0.00 0.00 179.24 177.57 3m47 n LEU 149 N -3.43 1.86 -0.13 1.55 4.77 -0.59 -4.95 117.00 116.08 3m47 n LEU 149 Ca -0.01 -0.61 -0.02 0.00 -0.03 0.00 0.00 56.01 55.34 3m47 n LEU 149 Cb 0.30 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 3m47 n LEU 149 CO 0.30 0.32 -0.02 0.61 -1.33 0.00 0.00 177.39 177.27 3m47 n GLY 150 N 1.28 0.52 3.75 -0.72 0.00 -0.67 -5.01 105.19 104.34 3m47 n GLY 150 Ca 0.15 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 3m47 n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m47 s VAL 151 N -2.05 2.13 -0.57 1.61 1.01 -0.23 -4.91 120.40 117.38 3m47 s VAL 151 Ca 0.00 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.15 3m47 s VAL 151 Cb 0.00 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 3m47 s VAL 151 CO 0.00 0.02 0.47 0.29 0.00 0.00 0.00 175.10 175.88 3m47 n LYS 152 N 2.31 2.80 -4.44 2.72 4.76 -1.26 -4.64 118.16 120.41 3m47 n LYS 152 Ca 0.08 -0.40 -0.23 0.00 -2.87 0.00 0.00 58.31 54.90 3m47 n LYS 152 Cb 0.38 -0.95 -0.16 0.00 -1.84 0.00 0.00 35.03 32.45 3m47 n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3m47 s ASN 153 N -1.19 1.45 0.04 4.39 0.01 -1.26 -0.26 114.94 118.11 3m47 s ASN 153 Ca 0.05 -0.23 0.03 0.00 -0.71 0.00 0.00 52.86 52.00 3m47 s ASN 153 Cb 0.05 -0.64 -0.02 0.00 0.41 0.00 0.00 41.25 41.05 3m47 s ASN 153 CO 0.19 0.01 -0.10 -0.31 -1.51 0.00 0.00 177.10 175.38 3m47 s TYR 154 N 0.66 0.90 -0.19 2.20 1.51 0.59 -0.81 117.35 122.22 3m47 s TYR 154 Ca -0.12 -0.37 -0.02 0.00 -1.01 0.00 0.00 57.07 55.55 3m47 s TYR 154 Cb -0.14 -0.54 -0.01 0.00 -0.11 0.00 0.00 41.96 41.16 3m47 s TYR 154 CO 0.02 -0.01 -0.08 0.08 -1.11 0.00 0.00 175.55 174.46 3m47 s VAL 155 N -0.94 3.25 0.52 0.71 1.01 0.01 -1.42 120.40 123.55 3m47 s VAL 155 Ca -0.03 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.47 3m47 s VAL 155 Cb -0.08 -2.44 0.07 0.00 0.00 0.00 0.00 36.38 33.93 3m47 s VAL 155 CO 0.01 0.47 0.56 0.61 0.00 0.00 0.00 175.10 176.75 3m47 n GLY 156 N 4.30 2.36 3.77 4.51 0.00 -0.54 -1.93 105.19 117.66 3m47 n GLY 156 Ca -0.18 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.18 3m47 n GLY 156 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m47 s PRO 157 N -4.26 4.19 0.06 1.61 0.02 -1.26 -4.64 135.00 130.72 3m47 s PRO 157 Ca 0.43 2.31 -0.29 0.00 0.02 0.00 0.00 61.00 63.47 3m47 s PRO 157 Cb -0.03 -2.97 -0.14 0.00 0.02 0.00 0.00 34.50 31.37 3m47 s PRO 157 CO 0.27 -0.36 1.44 1.03 -0.33 0.00 0.00 177.00 179.05 3m47 h SER 158 N 3.11 -1.08 -2.17 2.53 0.87 -1.90 -3.41 113.55 111.49 3m47 h SER 158 Ca -0.50 0.08 -0.43 0.00 -1.23 0.00 0.00 61.79 59.71 3m47 h SER 158 Cb 1.23 0.35 0.04 0.00 -0.44 0.00 0.00 62.40 63.58 3m47 h SER 158 CO 0.64 -0.55 -0.11 0.42 -0.53 0.00 0.00 176.83 176.70 3m47 s THR 159 N -5.27 2.83 -0.05 2.23 -4.23 -1.26 -4.58 115.64 105.30 3m47 s THR 159 Ca -0.14 -0.77 -0.01 0.00 -1.18 0.00 0.00 61.69 59.59 3m47 s THR 159 Cb 0.03 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.85 3m47 s THR 159 CO 0.48 -0.01 0.03 0.54 -0.54 0.00 0.00 174.62 175.11 3m47 n ARG 160 N -2.17 -0.48 -0.30 3.99 1.74 -1.26 -4.80 116.66 113.37 3m47 n ARG 160 Ca 0.08 0.82 0.00 0.00 -0.77 0.00 0.00 57.85 57.98 3m47 n ARG 160 Cb 0.59 -1.82 0.07 0.00 -1.02 0.00 0.00 32.46 30.28 3m47 n ARG 160 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3m47 h PRO 161 N 0.41 -0.04 0.00 5.56 0.11 -1.96 0.01 132.00 136.10 3m47 h PRO 161 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3m47 h PRO 161 Cb 0.05 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.17 3m47 h PRO 161 CO 0.02 -0.02 0.00 1.05 -0.21 0.00 0.00 178.00 178.84 3m47 h GLU 162 N -0.04 0.00 -0.03 1.05 9.09 -2.00 -0.12 114.58 122.53 3m47 h GLU 162 Ca 0.35 0.00 -0.23 0.00 0.05 0.00 0.00 59.36 59.53 3m47 h GLU 162 Cb 0.60 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.71 3m47 h GLU 162 CO -0.87 0.00 -0.93 0.00 0.05 0.00 0.00 179.01 177.26 3m47 h ARG 163 N 0.00 0.54 -0.67 1.06 2.47 -1.30 -2.93 114.38 113.55 3m47 h ARG 163 Ca 0.00 -0.55 -0.07 0.00 -1.26 0.00 0.00 59.98 58.09 3m47 h ARG 163 Cb 0.08 0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 3m47 h ARG 163 CO 0.00 1.18 0.13 1.25 0.56 0.00 0.00 179.97 183.08 3m47 h LEU 164 N 0.32 1.05 -0.82 3.04 5.85 -0.94 -0.31 115.31 123.51 3m47 h LEU 164 Ca -0.09 -0.24 -0.11 0.00 0.84 0.00 0.00 57.88 58.28 3m47 h LEU 164 Cb 1.57 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 3m47 h LEU 164 CO 0.17 1.03 -0.29 0.77 -0.34 0.00 0.00 178.44 179.78 3m47 h SER 165 N 1.03 0.57 -0.33 1.25 4.64 -1.54 0.17 113.55 119.34 3m47 h SER 165 Ca 0.21 -0.21 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 3m47 h SER 165 Cb 0.41 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 3m47 h SER 165 CO 0.01 0.84 0.01 -0.09 -0.87 0.00 0.00 176.83 176.72 3m47 h ARG 166 N 0.48 0.58 -0.26 4.77 9.65 -1.30 0.44 114.38 128.75 3m47 h ARG 166 Ca 0.06 -0.18 -0.00 0.00 -1.10 0.00 0.00 59.98 58.76 3m47 h ARG 166 Cb 0.75 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.26 3m47 h ARG 166 CO 0.06 0.70 0.16 1.25 2.80 0.00 0.00 179.97 184.94 3m47 h LEU 167 N 0.39 0.30 -0.97 3.80 6.46 -0.73 -1.66 115.31 122.90 3m47 h LEU 167 Ca 0.10 -0.04 0.01 0.00 -0.12 0.00 0.00 57.88 57.82 3m47 h LEU 167 Cb 0.43 -0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 40.24 3m47 h LEU 167 CO 0.02 0.26 0.64 -0.09 -0.62 0.00 0.00 178.44 178.64 3m47 h ARG 168 N 0.32 1.28 -0.50 1.25 9.65 -0.54 -0.16 114.38 125.68 3m47 h ARG 168 Ca 0.09 -0.08 0.06 0.00 -1.10 0.00 0.00 59.98 58.95 3m47 h ARG 168 Cb 0.01 -0.29 -0.05 0.00 -1.39 0.00 0.00 29.97 28.25 3m47 h ARG 168 CO -0.02 0.85 0.20 1.49 2.80 0.00 0.00 179.97 185.29 3m47 h GLU 169 N 1.32 0.39 -0.27 0.20 4.81 -0.51 -0.77 114.58 119.75 3m47 h GLU 169 Ca 0.36 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.48 3m47 h GLU 169 Cb -0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 3m47 h GLU 169 CO -0.08 0.26 -0.14 0.82 -0.73 0.00 0.00 179.01 179.14 3m47 h ILE 170 N 0.40 1.30 0.00 2.32 2.04 -0.34 -3.27 117.51 119.96 3m47 h ILE 170 Ca 0.23 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3m47 h ILE 170 Cb 0.21 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 3m47 h ILE 170 CO -0.21 0.39 -0.30 2.30 0.00 0.00 0.00 178.15 180.32 3m47 n ILE 171 N -4.45 0.18 0.00 -0.67 -5.35 -0.17 -4.94 119.36 103.97 3m47 n ILE 171 Ca -0.04 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 3m47 n ILE 171 Cb 0.36 -0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.06 3m47 n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3m47 n GLY 172 N 1.43 -0.67 0.02 3.28 0.00 -0.31 -4.44 105.19 104.50 3m47 n GLY 172 Ca 0.05 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.50 3m47 n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m47 n GLN 173 N -0.73 0.10 -0.09 1.61 1.13 -1.26 -4.12 117.38 114.01 3m47 n GLN 173 Ca 0.00 -0.03 -0.08 0.00 -1.94 0.00 0.00 57.00 54.95 3m47 n GLN 173 Cb 0.00 -1.50 -0.15 0.00 0.11 0.00 0.00 30.24 28.70 3m47 n GLN 173 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3m47 n ASP 174 N -1.42 0.37 -4.68 1.08 10.43 -1.26 -4.98 116.55 116.08 3m47 n ASP 174 Ca 0.07 0.00 -0.33 0.00 2.57 0.00 0.00 54.79 57.11 3m47 n ASP 174 Cb 0.33 1.01 0.14 0.00 1.84 0.00 0.00 41.12 44.44 3m47 n ASP 174 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3m47 n SER 175 N -2.67 0.79 -4.71 -2.24 7.64 -1.26 -4.88 113.62 106.30 3m47 n SER 175 Ca -0.29 0.54 -0.38 0.00 1.01 0.00 0.00 58.87 59.75 3m47 n SER 175 Cb 1.08 -1.50 -0.07 0.00 -1.01 0.00 0.00 64.21 62.72 3m47 n SER 175 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3m47 s PHE 176 N -2.26 3.45 -0.08 1.43 5.36 0.64 -4.98 117.98 121.54 3m47 s PHE 176 Ca 0.71 0.73 0.02 0.00 -0.96 0.00 0.00 56.93 57.43 3m47 s PHE 176 Cb -0.27 -2.49 0.01 0.00 -0.34 0.00 0.00 43.02 39.93 3m47 s PHE 176 CO 0.53 0.12 -0.13 -1.17 -1.46 0.00 0.00 175.22 173.11 3m47 s LEU 177 N 0.82 1.63 0.08 6.12 2.96 -1.26 -0.30 118.68 128.73 3m47 s LEU 177 Ca 0.21 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 53.87 3m47 s LEU 177 Cb -0.14 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.60 3m47 s LEU 177 CO 0.08 0.02 -0.23 0.27 -1.32 0.00 0.00 176.35 175.16 3m47 s ILE 178 N 0.85 2.43 0.07 6.68 -4.36 -0.51 0.21 121.20 126.57 3m47 s ILE 178 Ca -0.11 -1.46 -0.11 0.00 -0.26 0.00 0.00 60.65 58.72 3m47 s ILE 178 Cb -0.15 -2.03 0.01 0.00 1.25 0.00 0.00 42.46 41.54 3m47 s ILE 178 CO 0.01 0.25 0.24 -0.44 0.24 0.00 0.00 174.94 175.24 3m47 s SER 179 N -1.64 0.00 -1.30 4.36 0.01 -1.04 -1.47 113.70 112.63 3m47 s SER 179 Ca 0.14 -0.43 -0.13 0.00 1.31 0.00 0.00 55.95 56.83 3m47 s SER 179 Cb -0.10 0.34 0.12 0.00 0.21 0.00 0.00 66.02 66.60 3m47 s SER 179 CO 0.05 -0.67 1.77 -2.65 0.41 0.00 0.00 173.24 172.15 3m47 n PRO 180 N 0.27 3.31 0.00 12.44 -0.02 -1.26 -0.07 135.00 149.67 3m47 n PRO 180 Ca -0.17 -3.41 0.00 0.00 -2.02 0.00 0.00 63.50 57.90 3m47 n PRO 180 Cb 0.61 -3.15 0.00 0.00 -0.02 0.00 0.00 33.50 30.93 3m47 n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m47 n GLY 190 N 4.02 -0.12 0.19 -1.23 0.00 -1.26 -4.51 105.19 102.27 3m47 n GLY 190 Ca 0.43 0.23 -0.06 0.00 0.00 0.00 0.00 46.02 46.62 3m47 n GLY 190 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m47 h GLU 191 N 0.00 0.35 -0.90 1.61 4.39 -2.02 -3.30 114.58 114.71 3m47 h GLU 191 Ca 0.00 -0.22 0.05 0.00 0.34 0.00 0.00 59.36 59.52 3m47 h GLU 191 Cb 0.00 0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 3m47 h GLU 191 CO 0.00 0.82 0.57 1.15 -1.16 0.00 0.00 179.01 180.39 3m47 h THR 192 N 0.26 1.11 0.00 1.13 2.02 -1.96 -1.80 112.91 113.67 3m47 h THR 192 Ca 0.00 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.81 3m47 h THR 192 Cb 1.07 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 3m47 h THR 192 CO 0.09 0.20 0.00 0.18 0.37 0.00 0.00 175.52 176.36 3m47 n LEU 193 N -4.55 0.00 0.20 2.58 4.77 -1.24 -0.70 117.00 118.06 3m47 n LEU 193 Ca 0.12 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.19 3m47 n LEU 193 Cb 0.13 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.51 3m47 n LEU 193 CO 0.33 0.00 0.72 0.03 -1.33 0.00 0.00 177.39 177.14 3m47 h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.48 -3.40 114.38 115.81 3m47 h ARG 194 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3m47 h ARG 194 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3m47 h ARG 194 CO 0.00 0.24 -0.95 1.19 -1.07 0.00 0.00 179.97 179.38 3m47 n PHE 195 N -3.26 0.00 -3.33 3.04 3.01 -0.61 -5.05 117.46 111.26 3m47 n PHE 195 Ca 0.01 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.16 3m47 n PHE 195 Cb 0.53 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.95 3m47 n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3m47 s ALA 196 N -1.95 3.52 -0.02 4.37 0.00 0.12 -4.84 121.76 122.95 3m47 s ALA 196 Ca 0.00 -0.24 0.12 0.00 0.00 0.00 0.00 51.96 51.84 3m47 s ALA 196 Cb 0.00 -2.49 -0.14 0.00 0.00 0.00 0.00 23.12 20.48 3m47 s ALA 196 CO 0.00 0.43 1.08 -0.44 0.00 0.00 0.00 175.76 176.84 3m47 h ASP 197 N 2.36 0.00 -5.03 0.00 3.32 -0.56 -3.39 116.42 113.12 3m47 h ASP 197 Ca -0.47 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.47 3m47 h ASP 197 Cb 1.17 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.54 3m47 h ASP 197 CO 0.68 0.82 -0.34 0.00 -1.72 0.00 0.00 179.24 178.68 3m47 s ALA 198 N -2.77 -0.54 0.01 3.45 0.00 -1.19 -4.76 121.76 115.96 3m47 s ALA 198 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.94 3m47 s ALA 198 Cb 0.09 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 3m47 s ALA 198 CO 0.80 -0.32 0.02 0.96 0.00 0.00 0.00 175.76 177.22 3m47 s ILE 199 N -2.06 4.30 -0.22 0.00 -4.36 -0.20 -2.50 121.20 116.16 3m47 s ILE 199 Ca -0.09 -0.59 -0.11 0.00 -0.26 0.00 0.00 60.65 59.59 3m47 s ILE 199 Cb -0.03 -2.95 -0.05 0.00 1.25 0.00 0.00 42.46 40.68 3m47 s ILE 199 CO -0.01 0.34 0.20 -0.63 0.24 0.00 0.00 174.94 175.08 3m47 s ILE 200 N -1.14 5.34 -0.05 8.37 1.01 0.90 -0.39 121.20 135.23 3m47 s ILE 200 Ca 0.21 0.29 0.03 0.00 0.00 0.00 0.00 60.65 61.18 3m47 s ILE 200 Cb -0.12 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.82 3m47 s ILE 200 CO 0.12 0.35 -0.14 -0.69 0.00 0.00 0.00 174.94 174.59 3m47 s VAL 201 N 0.93 1.18 0.00 2.92 1.01 -0.03 -4.43 120.40 121.98 3m47 s VAL 201 Ca 0.10 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.53 3m47 s VAL 201 Cb -0.13 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.20 3m47 s VAL 201 CO 0.04 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.10 3m47 n GLY 202 N 3.43 0.79 0.27 4.51 0.00 -1.26 -0.58 105.19 112.35 3m47 n GLY 202 Ca -0.20 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.86 3m47 n GLY 202 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3m47 h ARG 203 N 0.00 0.40 -1.30 1.61 3.08 -1.96 0.48 114.38 116.68 3m47 h ARG 203 Ca 0.00 -0.02 0.41 0.00 0.07 0.00 0.00 59.98 60.44 3m47 h ARG 203 Cb 0.00 -0.09 -0.12 0.00 0.08 0.00 0.00 29.97 29.84 3m47 h ARG 203 CO 0.00 0.26 0.85 0.77 -1.07 0.00 0.00 179.97 180.79 3m47 h SER 204 N 0.41 0.25 0.00 7.04 0.02 -1.95 -0.81 113.55 118.51 3m47 h SER 204 Ca 0.40 0.11 -0.27 0.00 -0.84 0.00 0.00 61.79 61.19 3m47 h SER 204 Cb 0.61 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.21 3m47 h SER 204 CO -0.41 -0.12 -1.87 -0.38 -1.14 0.00 0.00 176.83 172.91 3m47 n ILE 205 N -4.61 1.52 0.54 3.27 5.41 0.03 -4.25 119.36 121.26 3m47 n ILE 205 Ca 0.35 -0.16 0.13 0.00 1.00 0.00 0.00 62.75 64.06 3m47 n ILE 205 Cb 1.36 -2.08 0.45 0.00 -0.71 0.00 0.00 39.64 38.66 3m47 n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3m47 n TYR 206 N -4.35 0.85 -0.58 1.39 0.18 -0.42 -1.80 117.16 112.43 3m47 n TYR 206 Ca -0.38 0.28 0.09 0.00 1.88 0.00 0.00 57.90 59.77 3m47 n TYR 206 Cb 0.73 -0.96 0.30 0.00 -0.38 0.00 0.00 39.34 39.03 3m47 n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3m47 n LEU 207 N -2.23 4.25 -4.83 -3.48 4.77 -0.32 -4.98 117.00 110.17 3m47 n LEU 207 Ca 0.04 -2.43 -0.35 0.00 -0.03 0.00 0.00 56.01 53.25 3m47 n LEU 207 Cb 0.34 -0.50 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 3m47 n LEU 207 CO 0.26 0.79 0.38 0.00 -1.33 0.00 0.00 177.39 177.48 3m47 s ALA 208 N -1.79 3.42 0.34 -1.18 0.00 -0.75 -4.98 121.76 116.83 3m47 s ALA 208 Ca 0.44 0.06 0.04 0.00 0.00 0.00 0.00 51.96 52.50 3m47 s ALA 208 Cb 0.29 -2.74 0.63 0.00 0.00 0.00 0.00 23.12 21.30 3m47 s ALA 208 CO 0.21 0.36 1.92 -0.44 0.00 0.00 0.00 175.76 177.81 3m47 h ASP 209 N 3.07 0.56 -3.43 0.00 5.19 -1.93 -3.31 116.42 116.57 3m47 h ASP 209 Ca -0.48 -0.07 -0.62 0.00 -0.62 0.00 0.00 57.03 55.24 3m47 h ASP 209 Cb 1.19 -0.14 -0.41 0.00 0.18 0.00 0.00 39.33 40.14 3m47 h ASP 209 CO 0.66 0.55 -0.67 0.21 -3.12 0.00 0.00 179.24 176.86 3m47 s ASN 210 N -6.67 4.06 0.33 6.45 3.84 -1.26 -4.96 114.94 116.73 3m47 s ASN 210 Ca -0.08 -3.29 0.07 0.00 0.21 0.00 0.00 52.86 49.76 3m47 s ASN 210 Cb 0.16 -1.37 0.76 0.00 -0.55 0.00 0.00 41.25 40.25 3m47 s ASN 210 CO 0.76 -0.17 1.84 -0.65 -2.79 0.00 0.00 177.10 176.09 3m47 h PRO 211 N 5.98 0.74 -0.81 0.43 0.11 -1.76 0.19 132.00 136.89 3m47 h PRO 211 Ca 0.07 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.16 3m47 h PRO 211 Cb 0.84 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 31.74 3m47 h PRO 211 CO 0.62 0.49 0.52 0.00 -0.21 0.00 0.00 178.00 179.42 3m47 h ALA 212 N 1.60 1.05 -0.04 -0.75 0.00 -1.91 0.09 119.26 119.30 3m47 h ALA 212 Ca 0.50 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 55.12 3m47 h ALA 212 Cb 0.76 -0.29 0.02 0.00 0.00 0.00 0.00 17.79 18.28 3m47 h ALA 212 CO -0.26 0.36 -0.95 0.00 0.00 0.00 0.00 179.25 178.40 3m47 h ALA 213 N 1.33 0.16 -0.62 0.00 0.00 -1.28 -2.19 119.26 116.65 3m47 h ALA 213 Ca 0.31 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 3m47 h ALA 213 Cb -0.03 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3m47 h ALA 213 CO -0.10 0.66 0.31 0.00 0.00 0.00 0.00 179.25 180.12 3m47 h ALA 214 N 0.43 0.80 -0.14 0.00 0.00 -0.44 0.25 119.26 120.16 3m47 h ALA 214 Ca -0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3m47 h ALA 214 Cb 1.60 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3m47 h ALA 214 CO 0.19 0.36 0.08 0.00 0.00 0.00 0.00 179.25 179.88 3m47 h ALA 215 N 1.14 0.17 -0.91 0.00 0.00 -1.03 -1.45 119.26 117.19 3m47 h ALA 215 Ca 0.22 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.16 3m47 h ALA 215 Cb 0.10 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 3m47 h ALA 215 CO -0.03 -0.31 0.56 0.00 0.00 0.00 0.00 179.25 179.47 3m47 h ALA 216 N 1.00 1.27 -0.24 0.00 0.00 -0.75 -0.08 119.26 120.46 3m47 h ALA 216 Ca 0.05 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3m47 h ALA 216 Cb 0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3m47 h ALA 216 CO -0.01 0.29 -0.20 0.78 0.00 0.00 0.00 179.25 180.11 3m47 h GLY 217 N 1.00 0.62 0.79 0.00 0.00 -0.81 -0.70 103.07 103.97 3m47 h GLY 217 Ca 0.41 -0.61 0.05 0.00 0.00 0.00 0.00 47.33 47.18 3m47 h GLY 217 CO -0.19 0.55 0.58 0.00 0.00 0.00 0.00 176.54 177.48 3m47 h ALA 218 N 0.69 1.23 -0.12 3.60 0.00 -0.72 -0.68 119.26 123.26 3m47 h ALA 218 Ca 0.04 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3m47 h ALA 218 Cb 0.75 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3m47 h ALA 218 CO 0.05 0.38 -0.48 0.82 0.00 0.00 0.00 179.25 180.03 3m47 h ILE 219 N 1.08 1.33 -0.36 0.00 2.04 -0.90 -2.33 117.51 118.38 3m47 h ILE 219 Ca 0.38 -1.68 -0.11 0.00 1.00 0.00 0.00 64.86 64.45 3m47 h ILE 219 Cb 0.10 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 3m47 h ILE 219 CO -0.15 0.50 -0.19 -0.33 0.00 0.00 0.00 178.15 177.98 3m47 h GLU 220 N 0.24 0.77 0.00 2.37 4.39 -0.38 -2.69 114.58 119.28 3m47 h GLU 220 Ca 0.01 -0.34 -0.01 0.00 0.34 0.00 0.00 59.36 59.36 3m47 h GLU 220 Cb 0.93 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.56 3m47 h GLU 220 CO 0.08 0.96 -0.07 0.66 -1.16 0.00 0.00 179.01 179.48 3m47 h SER 221 N 0.55 0.00 0.00 1.42 4.64 -1.04 -3.51 113.55 115.62 3m47 h SER 221 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3m47 h SER 221 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3m47 h SER 221 CO 0.06 0.07 0.00 -0.38 -0.87 0.00 0.00 176.83 175.70