#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m90 s GLN 2 N 0.00 2.91 -0.24 2.12 1.03 -1.26 -1.25 119.66 122.96 1m90 s GLN 2 Ca 0.00 -0.54 0.02 0.00 0.04 0.00 0.00 55.36 54.88 1m90 s GLN 2 Cb 0.00 -2.75 0.06 0.00 0.03 0.00 0.00 33.01 30.34 1m90 s GLN 2 CO 0.00 0.65 -0.10 0.00 -2.54 0.00 0.00 175.29 173.30 1m90 s ALA 3 N -1.08 2.31 -0.55 2.60 0.00 0.34 -4.71 121.76 120.67 1m90 s ALA 3 Ca 0.19 -1.55 -0.27 0.00 0.00 0.00 0.00 51.96 50.33 1m90 s ALA 3 Cb -0.12 -1.48 -0.00 0.00 0.00 0.00 0.00 23.12 21.52 1m90 s ALA 3 CO 0.10 -1.10 1.63 0.99 0.00 0.00 0.00 175.76 177.38 1m90 s THR 4 N 1.23 3.58 0.36 0.00 2.01 -1.26 -0.86 115.64 120.70 1m90 s THR 4 Ca -0.06 0.46 -0.27 0.00 0.31 0.00 0.00 61.69 62.13 1m90 s THR 4 Cb -0.19 -4.16 -0.09 0.00 0.01 0.00 0.00 72.50 68.07 1m90 s THR 4 CO -0.06 -0.99 1.15 -0.63 -0.69 0.00 0.00 174.62 173.39 1m90 s ILE 5 N 7.25 3.27 0.11 1.82 1.01 -1.12 -4.38 121.20 129.17 1m90 s ILE 5 Ca 0.61 1.14 0.10 0.00 0.00 0.00 0.00 60.65 62.49 1m90 s ILE 5 Cb -0.13 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1m90 s ILE 5 CO 0.24 0.16 -0.24 -0.31 0.00 0.00 0.00 174.94 174.80 1m90 s TYR 6 N -1.34 2.04 0.47 3.97 1.51 -1.03 -1.54 117.35 121.42 1m90 s TYR 6 Ca 0.53 -0.40 0.05 0.00 -1.01 0.00 0.00 57.07 56.23 1m90 s TYR 6 Cb -0.31 -1.11 0.02 0.00 -0.11 0.00 0.00 41.96 40.44 1m90 s TYR 6 CO 0.39 0.27 0.65 0.16 -1.11 0.00 0.00 175.55 175.91 1m90 s ASP 7 N -1.96 5.54 0.00 2.29 -4.77 -0.97 -0.77 116.67 116.03 1m90 s ASP 7 Ca 0.10 -0.19 0.01 0.00 -3.30 0.00 0.00 52.55 49.17 1m90 s ASP 7 Cb -0.10 -0.85 0.04 0.00 -1.09 0.00 0.00 42.92 40.91 1m90 s ASP 7 CO 0.05 -0.88 0.21 0.18 0.70 0.00 0.00 175.17 175.43 1m90 n LEU 8 N -2.04 0.00 -0.00 2.11 4.77 -1.26 -0.21 117.00 120.36 1m90 n LEU 8 Ca 0.07 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.10 1m90 n LEU 8 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 1m90 n LEU 8 CO 0.42 0.00 -0.11 0.47 -1.33 0.00 0.00 177.39 176.85 1m90 n ASP 9 N -0.60 0.77 0.00 -1.43 8.00 -1.26 -4.76 116.55 117.27 1m90 n ASP 9 Ca 0.00 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.86 1m90 n ASP 9 Cb 0.00 1.07 0.00 0.00 -0.02 0.00 0.00 41.12 42.17 1m90 n ASP 9 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1m90 n GLY 10 N 1.33 0.78 3.84 0.44 0.00 0.70 -4.92 105.19 107.36 1m90 n GLY 10 Ca 0.01 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 1m90 n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m90 s ASN 11 N -2.13 6.25 0.62 1.61 0.01 -1.26 -4.86 114.94 115.19 1m90 s ASN 11 Ca 0.00 0.41 -0.18 0.00 -0.71 0.00 0.00 52.86 52.38 1m90 s ASN 11 Cb 0.00 -2.02 -0.05 0.00 0.41 0.00 0.00 41.25 39.59 1m90 s ASN 11 CO 0.00 0.38 0.74 0.35 -1.51 0.00 0.00 177.10 177.06 1m90 n THR 12 N 2.19 2.88 -2.79 1.60 -2.24 -1.26 -2.29 114.28 112.37 1m90 n THR 12 Ca -0.19 -0.48 -0.10 0.00 -2.27 0.00 0.00 64.05 61.01 1m90 n THR 12 Cb 0.55 -0.91 0.07 0.00 -2.10 0.00 0.00 70.33 67.94 1m90 n THR 12 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1m90 n ASP 13 N -0.34 -1.88 0.00 3.42 -0.08 -0.59 -4.79 116.55 112.29 1m90 n ASP 13 Ca 0.13 -3.58 0.00 0.00 -1.51 0.00 0.00 54.79 49.83 1m90 n ASP 13 Cb 0.48 1.55 0.00 0.00 2.34 0.00 0.00 41.12 45.49 1m90 n ASP 13 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1m90 n GLY 14 N 0.32 -1.79 3.62 0.27 0.00 -1.26 -4.72 105.19 101.63 1m90 n GLY 14 Ca 0.08 -1.80 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 1m90 n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1m90 s GLU 15 N 0.00 0.31 0.35 1.61 -1.05 -1.26 -2.80 118.70 115.86 1m90 s GLU 15 Ca 0.00 0.19 0.09 0.00 -0.15 0.00 0.00 54.97 55.10 1m90 s GLU 15 Cb 0.00 0.15 -0.06 0.00 -0.44 0.00 0.00 34.13 33.78 1m90 s GLU 15 CO 0.00 -0.07 -0.02 0.08 0.95 0.00 0.00 175.26 176.20 1m90 s VAL 16 N -0.54 2.40 0.08 1.83 1.01 -0.04 -4.87 120.40 120.29 1m90 s VAL 16 Ca 0.04 -2.05 -0.30 0.00 0.00 0.00 0.00 61.98 59.67 1m90 s VAL 16 Cb -0.03 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.53 1m90 s VAL 16 CO -0.07 -0.17 1.15 -1.81 0.00 0.00 0.00 175.10 174.20 1m90 s ASP 17 N -3.69 7.16 -0.26 3.32 1.01 -1.26 0.13 116.67 123.09 1m90 s ASP 17 Ca 0.34 1.99 -0.29 0.00 0.71 0.00 0.00 52.55 55.30 1m90 s ASP 17 Cb 0.02 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1m90 s ASP 17 CO 0.18 -0.38 1.39 -0.22 0.21 0.00 0.00 175.17 176.35 1m90 s LEU 18 N 0.68 3.93 0.84 1.23 2.96 -0.38 -4.81 118.68 123.13 1m90 s LEU 18 Ca 0.55 1.40 -0.15 0.00 -0.22 0.00 0.00 54.13 55.72 1m90 s LEU 18 Cb -0.28 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.85 1m90 s LEU 18 CO 0.31 -1.09 0.32 -0.81 -1.32 0.00 0.00 176.35 173.76 1m90 n PRO 19 N 7.32 0.01 -0.18 0.98 -0.04 -1.26 -4.07 135.00 137.76 1m90 n PRO 19 Ca 0.16 0.04 -0.01 0.00 -0.04 0.00 0.00 63.50 63.66 1m90 n PRO 19 Cb 0.46 -1.73 0.09 0.00 -0.04 0.00 0.00 33.50 32.28 1m90 n PRO 19 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1m90 h ASP 20 N -0.93 0.04 -1.37 3.54 3.32 -1.93 -2.72 116.42 116.37 1m90 h ASP 20 Ca -0.44 0.10 0.41 0.00 0.02 0.00 0.00 57.03 57.12 1m90 h ASP 20 Cb 1.32 0.12 -0.10 0.00 0.22 0.00 0.00 39.33 40.90 1m90 h ASP 20 CO 0.37 0.04 0.93 -0.37 -1.72 0.00 0.00 179.24 178.49 1m90 h VAL 21 N 0.27 0.23 0.00 -1.35 -1.51 -1.90 1.27 116.25 113.26 1m90 h VAL 21 Ca 0.29 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.72 1m90 h VAL 21 Cb 0.40 0.12 0.00 0.00 -2.13 0.00 0.00 31.29 29.67 1m90 h VAL 21 CO -0.35 0.02 0.00 0.49 -1.23 0.00 0.00 177.57 176.50 1m90 n PHE 22 N -4.43 0.00 0.39 5.19 3.01 -1.03 -0.21 117.46 120.38 1m90 n PHE 22 Ca 0.34 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.85 1m90 n PHE 22 Cb 1.41 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.90 1m90 n PHE 22 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1m90 n GLU 23 N -0.74 1.07 -1.77 -1.08 1.02 0.44 -4.66 120.64 114.92 1m90 n GLU 23 Ca 0.05 -0.86 -0.42 0.00 -0.02 0.00 0.00 57.16 55.92 1m90 n GLU 23 Cb 0.02 -1.12 -0.03 0.00 -0.02 0.00 0.00 31.44 30.29 1m90 n GLU 23 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1m90 s THR 24 N -0.98 2.63 -0.01 2.62 2.01 0.70 -4.87 115.64 117.75 1m90 s THR 24 Ca 0.09 0.16 -0.35 0.00 0.31 0.00 0.00 61.69 61.91 1m90 s THR 24 Cb 0.08 -3.10 -0.13 0.00 0.01 0.00 0.00 72.50 69.35 1m90 s THR 24 CO 0.16 0.00 1.70 -0.81 -0.69 0.00 0.00 174.62 174.98 1m90 n PRO 25 N 5.52 1.93 -1.71 4.92 -0.04 -1.26 -4.70 135.00 139.66 1m90 n PRO 25 Ca 0.17 0.70 -0.42 0.00 -0.04 0.00 0.00 63.50 63.91 1m90 n PRO 25 Cb 0.39 -2.48 -0.03 0.00 -0.04 0.00 0.00 33.50 31.34 1m90 n PRO 25 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1m90 s VAL 26 N 2.54 3.11 -0.75 0.52 1.01 -1.26 -4.80 120.40 120.76 1m90 s VAL 26 Ca 0.88 0.12 0.02 0.00 0.00 0.00 0.00 61.98 63.00 1m90 s VAL 26 Cb -0.76 -3.10 0.18 0.00 0.00 0.00 0.00 36.38 32.70 1m90 s VAL 26 CO 0.48 -0.04 0.57 -0.60 0.00 0.00 0.00 175.10 175.51 1m90 s ARG 27 N 5.21 2.71 0.61 2.72 6.06 -1.26 -4.95 118.95 130.05 1m90 s ARG 27 Ca 0.91 -3.24 0.32 0.00 -2.50 0.00 0.00 55.73 51.22 1m90 s ARG 27 Cb -0.37 -3.61 1.89 0.00 0.06 0.00 0.00 34.95 32.93 1m90 s ARG 27 CO 0.37 -1.26 2.22 0.66 -2.50 0.00 0.00 175.30 174.79 1m90 h SER 28 N 5.75 0.00 -0.11 -2.12 4.64 -1.94 -1.11 113.55 118.66 1m90 h SER 28 Ca 0.13 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.36 1m90 h SER 28 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1m90 h SER 28 CO 0.76 0.00 -0.25 -2.24 -0.87 0.00 0.00 176.83 174.23 1m90 h ASP 29 N 0.00 0.42 -0.05 4.97 2.03 -1.94 -0.58 116.42 121.27 1m90 h ASP 29 Ca 0.02 -0.57 -0.09 0.00 -0.73 0.00 0.00 57.03 55.67 1m90 h ASP 29 Cb 0.17 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 38.54 1m90 h ASP 29 CO -0.00 0.91 -0.22 -0.07 -1.03 0.00 0.00 179.24 178.83 1m90 h LEU 30 N -0.05 0.46 -0.13 0.15 3.38 -1.74 -2.18 115.31 115.19 1m90 h LEU 30 Ca 0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1m90 h LEU 30 Cb 0.85 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1m90 h LEU 30 CO 0.06 0.68 -0.02 0.40 0.09 0.00 0.00 178.44 179.65 1m90 h ILE 31 N 0.41 1.28 -0.97 1.22 2.04 -1.20 -2.29 117.51 118.01 1m90 h ILE 31 Ca 0.06 -0.94 0.12 0.00 1.00 0.00 0.00 64.86 65.10 1m90 h ILE 31 Cb 0.62 1.65 -0.08 0.00 -0.74 0.00 0.00 36.82 38.27 1m90 h ILE 31 CO 0.04 0.27 0.61 1.23 0.00 0.00 0.00 178.15 180.31 1m90 h GLY 32 N -0.06 1.51 1.83 5.37 0.00 -0.87 -0.05 103.07 110.81 1m90 h GLY 32 Ca 0.03 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.88 1m90 h GLY 32 CO 0.01 0.15 -0.35 1.70 0.00 0.00 0.00 176.54 178.06 1m90 h LYS 33 N 0.92 0.19 -0.15 4.80 3.64 -1.21 -0.26 116.57 124.49 1m90 h LYS 33 Ca 0.48 -0.08 -0.22 0.00 -1.27 0.00 0.00 60.65 59.56 1m90 h LYS 33 Cb 0.53 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1m90 h LYS 33 CO -0.24 0.52 -0.76 0.00 -2.27 0.00 0.00 179.45 176.70 1m90 h ALA 34 N 1.48 0.36 -0.10 5.00 0.00 -0.47 -2.69 119.26 122.83 1m90 h ALA 34 Ca 0.02 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 1m90 h ALA 34 Cb 0.70 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1m90 h ALA 34 CO 0.05 0.69 -0.12 0.28 0.00 0.00 0.00 179.25 180.16 1m90 h VAL 35 N 0.52 1.37 -0.75 0.00 2.07 -1.09 -2.60 116.25 115.77 1m90 h VAL 35 Ca -0.05 -1.30 0.16 0.00 0.82 0.00 0.00 66.70 66.33 1m90 h VAL 35 Cb 1.38 2.00 -0.11 0.00 -1.52 0.00 0.00 31.29 33.04 1m90 h VAL 35 CO 0.15 0.37 0.22 -0.09 0.02 0.00 0.00 177.57 178.24 1m90 h ARG 36 N -0.16 0.30 0.05 1.57 2.43 -1.07 0.76 114.38 118.25 1m90 h ARG 36 Ca 0.01 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1m90 h ARG 36 Cb 0.65 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1m90 h ARG 36 CO 0.03 0.20 -0.02 0.00 -1.51 0.00 0.00 179.97 178.66 1m90 h ALA 37 N 1.61 -0.07 -0.72 2.80 0.00 -1.47 -1.35 119.26 120.06 1m90 h ALA 37 Ca 0.43 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.28 1m90 h ALA 37 Cb 0.73 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1m90 h ALA 37 CO -0.49 -0.39 0.47 0.00 0.00 0.00 0.00 179.25 178.84 1m90 h ALA 38 N 0.57 1.82 -0.02 0.00 0.00 -0.96 0.26 119.26 120.93 1m90 h ALA 38 Ca -0.01 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1m90 h ALA 38 Cb 0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1m90 h ALA 38 CO 0.01 0.04 -0.77 1.96 0.00 0.00 0.00 179.25 180.50 1m90 h GLN 39 N 0.65 0.16 0.08 0.00 4.20 -0.70 -3.26 115.11 116.23 1m90 h GLN 39 Ca 0.33 -0.15 -0.20 0.00 0.06 0.00 0.00 58.65 58.68 1m90 h GLN 39 Cb 0.42 0.04 0.02 0.00 0.30 0.00 0.00 27.48 28.26 1m90 h GLN 39 CO -0.11 0.85 -0.84 0.00 -0.67 0.00 0.00 178.83 178.06 1m90 h ALA 40 N 1.10 -0.01 0.00 3.87 0.00 -0.16 -3.31 119.26 120.75 1m90 h ALA 40 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1m90 h ALA 40 Cb 1.35 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1m90 h ALA 40 CO 0.11 0.44 0.01 0.09 0.00 0.00 0.00 179.25 179.91 1m90 n ASN 41 N -4.08 0.00 -0.47 0.00 3.02 0.81 -1.17 115.26 113.37 1m90 n ASN 41 Ca -0.12 0.39 0.05 0.00 -0.03 0.00 0.00 54.58 54.87 1m90 n ASN 41 Cb 0.80 -0.39 0.07 0.00 -0.61 0.00 0.00 39.78 39.66 1m90 n ASN 41 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1m90 n ARG 42 N -1.39 1.09 -2.52 3.52 1.85 -1.24 -5.00 116.66 112.98 1m90 n ARG 42 Ca 0.00 -1.36 -0.38 0.00 -1.00 0.00 0.00 57.85 55.11 1m90 n ARG 42 Cb 0.01 -1.21 -0.04 0.00 -1.05 0.00 0.00 32.46 30.17 1m90 n ARG 42 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1m90 s LYS 43 N -0.90 4.32 0.00 2.89 3.01 -0.31 -5.04 119.74 123.71 1m90 s LYS 43 Ca 0.15 1.61 -0.11 0.00 -1.01 0.00 0.00 55.97 56.61 1m90 s LYS 43 Cb 0.09 -2.76 -0.05 0.00 -1.01 0.00 0.00 37.83 34.10 1m90 s LYS 43 CO 0.14 -0.02 0.34 -0.65 0.51 0.00 0.00 175.35 175.66 1m90 s GLN 44 N -2.14 3.74 0.30 1.68 -0.21 -1.26 -5.00 119.66 116.77 1m90 s GLN 44 Ca 0.53 0.18 -0.29 0.00 0.02 0.00 0.00 55.36 55.80 1m90 s GLN 44 Cb -0.25 -3.13 -0.10 0.00 1.00 0.00 0.00 33.01 30.52 1m90 s GLN 44 CO 0.32 0.67 1.42 -0.51 -2.12 0.00 0.00 175.29 175.07 1m90 s ASP 45 N -1.35 6.61 0.00 5.90 -0.00 -1.26 -5.01 116.67 121.56 1m90 s ASP 45 Ca 0.25 2.77 0.00 0.00 -0.00 0.00 0.00 52.55 55.57 1m90 s ASP 45 Cb -0.15 -2.64 0.00 0.00 -0.00 0.00 0.00 42.92 40.13 1m90 s ASP 45 CO 0.13 -0.70 0.00 0.00 -0.00 0.00 0.00 175.17 174.60 1m90 n TYR 46 N 1.49 -0.06 0.00 4.23 0.18 -1.26 -5.00 117.16 116.75 1m90 n TYR 46 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.82 1m90 n TYR 46 Cb 0.40 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.36 1m90 n TYR 46 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1m90 n GLY 47 N 0.00 4.70 3.71 -7.48 0.00 -1.26 -1.33 105.19 103.53 1m90 n GLY 47 Ca 0.00 -1.20 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1m90 n GLY 47 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1m90 s SER 48 N 0.00 3.53 0.15 1.61 1.04 -1.20 -4.84 113.70 113.98 1m90 s SER 48 Ca 0.00 1.75 -0.31 0.00 0.48 0.00 0.00 55.95 57.87 1m90 s SER 48 Cb 0.00 -2.39 -0.10 0.00 0.10 0.00 0.00 66.02 63.63 1m90 s SER 48 CO 0.00 -2.64 1.70 -0.62 0.98 0.00 0.00 173.24 172.66 1m90 s ASP 49 N -3.19 6.48 0.36 7.02 -1.08 -1.26 -4.88 116.67 120.13 1m90 s ASP 49 Ca 0.64 2.71 0.17 0.00 -0.52 0.00 0.00 52.55 55.54 1m90 s ASP 49 Cb -0.19 -2.58 1.12 0.00 -1.46 0.00 0.00 42.92 39.80 1m90 s ASP 49 CO 0.57 -0.93 1.68 -0.33 0.52 0.00 0.00 175.17 176.68 1m90 h GLU 50 N 7.61 0.32 -0.66 4.34 4.39 -1.98 -0.80 114.58 127.79 1m90 h GLU 50 Ca -0.44 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1m90 h GLU 50 Cb 1.21 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1m90 h GLU 50 CO 0.94 0.21 0.00 0.66 -1.16 0.00 0.00 179.01 179.66 1m90 n TYR 51 N -4.92 0.97 -1.72 4.33 4.02 -1.26 -4.94 117.16 113.64 1m90 n TYR 51 Ca 0.31 -0.52 -0.42 0.00 -0.01 0.00 0.00 57.90 57.26 1m90 n TYR 51 Cb 1.00 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 40.26 1m90 n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1m90 s ALA 52 N -1.12 3.49 0.00 -0.72 0.00 -0.31 -1.21 121.76 121.89 1m90 s ALA 52 Ca 0.45 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.61 1m90 s ALA 52 Cb 0.25 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1m90 s ALA 52 CO 0.29 -1.69 0.00 0.41 0.00 0.00 0.00 175.76 174.78 1m90 n GLY 53 N 4.62 0.87 0.55 0.00 0.00 -1.26 -4.23 105.19 105.73 1m90 n GLY 53 Ca 0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.30 1m90 n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1m90 n LEU 54 N 0.00 2.10 -3.91 0.99 4.77 -0.35 -3.71 117.00 116.90 1m90 n LEU 54 Ca 0.00 -0.93 -0.42 0.00 -0.03 0.00 0.00 56.01 54.62 1m90 n LEU 54 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1m90 n LEU 54 CO 0.00 0.38 2.23 0.54 -1.33 0.00 0.00 177.39 179.21 1m90 n ARG 55 N 0.59 3.24 -3.58 3.23 1.74 -1.24 -4.85 116.66 115.80 1m90 n ARG 55 Ca 0.08 -3.13 -0.08 0.00 -0.77 0.00 0.00 57.85 53.95 1m90 n ARG 55 Cb 0.37 -3.13 -0.04 0.00 -1.02 0.00 0.00 32.46 28.64 1m90 n ARG 55 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1m90 s THR 56 N 1.97 0.00 -1.05 0.55 -1.32 -1.26 -5.03 115.64 109.51 1m90 s THR 56 Ca 0.44 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 61.10 1m90 s THR 56 Cb 0.10 -1.00 0.75 0.00 -1.51 0.00 0.00 72.50 70.84 1m90 s THR 56 CO -0.03 0.00 1.66 -0.81 -2.21 0.00 0.00 174.62 173.23 1m90 n PRO 57 N 0.45 3.91 -1.29 7.08 -0.04 -1.26 -5.01 135.00 138.84 1m90 n PRO 57 Ca -0.07 -2.95 -0.42 0.00 -0.04 0.00 0.00 63.50 60.02 1m90 n PRO 57 Cb 0.59 -1.95 -0.01 0.00 -0.04 0.00 0.00 33.50 32.09 1m90 n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m90 n ALA 58 N 1.11 -2.93 -2.17 0.55 0.00 -1.26 -4.99 120.51 110.82 1m90 n ALA 58 Ca 0.26 0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 1m90 n ALA 58 Cb 0.94 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.82 1m90 n ALA 58 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1m90 s GLU 59 N -0.97 0.96 -0.14 0.00 2.02 -0.86 -4.72 118.70 114.99 1m90 s GLU 59 Ca 0.59 -1.45 -0.06 0.00 0.02 0.00 0.00 54.97 54.06 1m90 s GLU 59 Cb -0.69 0.25 -0.04 0.00 0.10 0.00 0.00 34.13 33.75 1m90 s GLU 59 CO 0.60 -0.28 0.07 0.45 0.02 0.00 0.00 175.26 176.12 1m90 s SER 60 N -3.06 5.77 0.35 -0.19 0.15 -1.26 0.99 113.70 116.44 1m90 s SER 60 Ca 0.26 0.22 0.27 0.00 0.70 0.00 0.00 55.95 57.40 1m90 s SER 60 Cb 0.07 -1.87 1.02 0.00 -1.71 0.00 0.00 66.02 63.53 1m90 s SER 60 CO 0.03 0.30 1.79 -0.26 1.20 0.00 0.00 173.24 176.30 1m90 h PHE 61 N 5.76 0.00 -0.07 3.44 -1.00 -1.90 -3.49 116.94 119.67 1m90 h PHE 61 Ca -0.46 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.32 1m90 h PHE 61 Cb 1.19 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.75 1m90 h PHE 61 CO 0.64 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.75 1m90 n GLY 62 N 0.29 -0.75 3.85 -1.45 0.00 -1.26 -4.85 105.19 101.01 1m90 n GLY 62 Ca 0.02 -1.16 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 1m90 n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m90 s SER 63 N -4.00 6.14 0.00 1.61 0.01 -1.26 -4.63 113.70 111.57 1m90 s SER 63 Ca 0.00 1.50 0.00 0.00 1.31 0.00 0.00 55.95 58.76 1m90 s SER 63 Cb 0.00 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.74 1m90 s SER 63 CO 0.00 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.33 1m90 n GLY 64 N -2.30 1.00 0.35 3.44 0.00 -1.26 -4.98 105.19 101.43 1m90 n GLY 64 Ca 0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.16 1m90 n GLY 64 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1m90 n ARG 65 N 0.00 1.50 -3.01 1.61 1.85 -1.26 -4.96 116.66 112.39 1m90 n ARG 65 Ca 0.00 -2.89 -0.21 0.00 -1.00 0.00 0.00 57.85 53.75 1m90 n ARG 65 Cb 0.00 -1.57 0.04 0.00 -1.05 0.00 0.00 32.46 29.87 1m90 n ARG 65 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1m90 n GLY 66 N -1.26 -0.44 3.25 2.89 0.00 -1.26 -5.00 105.19 103.37 1m90 n GLY 66 Ca 0.18 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 46.08 1m90 n GLY 66 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m90 s GLN 67 N -5.67 1.04 0.39 1.61 0.74 -1.26 -5.13 119.66 111.39 1m90 s GLN 67 Ca 0.30 -1.17 -0.25 0.00 0.05 0.00 0.00 55.36 54.29 1m90 s GLN 67 Cb -0.13 -1.11 -0.09 0.00 1.10 0.00 0.00 33.01 32.78 1m90 s GLN 67 CO 0.38 0.24 1.13 0.00 -0.55 0.00 0.00 175.29 176.48 1m90 s ALA 68 N -1.59 3.14 -0.94 1.58 0.00 -1.26 -4.84 121.76 117.84 1m90 s ALA 68 Ca 0.06 0.88 -0.22 0.00 0.00 0.00 0.00 51.96 52.68 1m90 s ALA 68 Cb -0.08 -3.34 -0.13 0.00 0.00 0.00 0.00 23.12 19.57 1m90 s ALA 68 CO 0.04 -0.41 1.92 0.72 0.00 0.00 0.00 175.76 178.03 1m90 n HIS 69 N 0.08 2.24 -5.22 0.00 -0.00 -1.26 -4.86 115.22 106.19 1m90 n HIS 69 Ca 0.04 -1.66 -0.32 0.00 -0.00 0.00 0.00 57.72 55.78 1m90 n HIS 69 Cb 0.47 -2.08 -0.17 0.00 -0.00 0.00 0.00 29.99 28.21 1m90 n HIS 69 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1m90 s VAL 70 N 7.52 2.09 0.21 1.59 1.01 -1.26 -4.99 120.40 126.57 1m90 s VAL 70 Ca 0.62 -1.03 -0.32 0.00 0.00 0.00 0.00 61.98 61.25 1m90 s VAL 70 Cb 0.08 -1.78 -0.13 0.00 0.00 0.00 0.00 36.38 34.55 1m90 s VAL 70 CO 0.13 0.56 1.59 -2.65 0.00 0.00 0.00 175.10 174.73 1m90 n PRO 71 N 3.32 2.38 -4.17 2.72 -0.02 -1.26 -4.44 135.00 133.53 1m90 n PRO 71 Ca -0.18 0.85 -0.14 0.00 -2.02 0.00 0.00 63.50 62.01 1m90 n PRO 71 Cb 0.53 -2.62 -0.11 0.00 -0.02 0.00 0.00 33.50 31.28 1m90 n PRO 71 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1m90 s LYS 72 N 0.49 0.83 -0.09 -0.52 1.02 0.28 -0.94 119.74 120.81 1m90 s LYS 72 Ca 0.73 -1.14 -0.04 0.00 0.02 0.00 0.00 55.97 55.55 1m90 s LYS 72 Cb -0.60 -0.52 0.04 0.00 -0.52 0.00 0.00 37.83 36.24 1m90 s LYS 72 CO 0.40 0.08 0.19 -1.17 -0.92 0.00 0.00 175.35 173.93 1m90 s LEU 73 N -2.40 0.40 -1.35 3.17 2.96 0.62 -2.04 118.68 120.04 1m90 s LEU 73 Ca 0.05 0.39 -0.04 0.00 -0.22 0.00 0.00 54.13 54.31 1m90 s LEU 73 Cb -0.03 0.48 0.02 0.00 0.50 0.00 0.00 46.19 47.16 1m90 s LEU 73 CO -0.00 -0.18 0.86 0.47 -1.32 0.00 0.00 176.35 176.18 1m90 n ASP 74 N 4.52 -2.68 -2.32 3.68 8.00 -1.26 -1.39 116.55 125.11 1m90 n ASP 74 Ca -0.20 -0.75 -0.13 0.00 0.71 0.00 0.00 54.79 54.41 1m90 n ASP 74 Cb 0.51 -4.26 -0.01 0.00 -0.02 0.00 0.00 41.12 37.34 1m90 n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1m90 n GLY 75 N -1.58 -0.31 3.01 0.44 0.00 -1.26 -4.95 105.19 100.54 1m90 n GLY 75 Ca -0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 1m90 n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m90 s ARG 76 N -4.83 1.68 0.49 1.61 3.52 -0.48 -5.10 118.95 115.84 1m90 s ARG 76 Ca 0.00 -0.40 -0.22 0.00 -0.13 0.00 0.00 55.73 54.98 1m90 s ARG 76 Cb 0.00 -1.42 -0.07 0.00 -1.56 0.00 0.00 34.95 31.90 1m90 s ARG 76 CO 0.00 0.00 1.22 0.00 -0.81 0.00 0.00 175.30 175.71 1m90 s ALA 77 N 0.75 2.92 0.33 6.12 0.00 -1.26 -0.28 121.76 130.34 1m90 s ALA 77 Ca -0.13 1.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.75 1m90 s ALA 77 Cb -0.16 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.55 1m90 s ALA 77 CO 0.03 -0.86 0.63 1.03 0.00 0.00 0.00 175.76 176.58 1m90 s ARG 78 N -2.77 1.94 0.00 0.00 0.52 -0.12 -4.76 118.95 113.76 1m90 s ARG 78 Ca 0.66 -1.42 0.00 0.00 -0.52 0.00 0.00 55.73 54.45 1m90 s ARG 78 Cb -0.32 0.54 0.00 0.00 0.52 0.00 0.00 34.95 35.69 1m90 s ARG 78 CO 0.38 -0.86 0.00 -2.13 0.02 0.00 0.00 175.30 172.71 1m90 n ARG 79 N -0.50 0.00 -1.45 3.54 0.63 -1.24 -4.54 116.66 113.10 1m90 n ARG 79 Ca -0.04 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.47 1m90 n ARG 79 Cb 0.61 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.52 1m90 n ARG 79 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1m90 n VAL 80 N 0.00 1.71 0.18 5.15 0.24 -1.26 0.11 118.33 124.46 1m90 n VAL 80 Ca 0.00 -0.50 0.16 0.00 -2.04 0.00 0.00 64.34 61.96 1m90 n VAL 80 Cb 0.00 -0.51 0.79 0.00 -1.47 0.00 0.00 33.84 32.65 1m90 n VAL 80 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1m90 h PRO 81 N 0.79 0.00 -0.00 7.34 0.11 -1.90 -1.19 132.00 137.15 1m90 h PRO 81 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1m90 h PRO 81 Cb 1.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.51 1m90 h PRO 81 CO 0.51 0.00 -0.09 0.00 -0.21 0.00 0.00 178.00 178.21 1m90 n GLN 82 N -3.98 0.85 -3.64 1.05 0.00 -1.26 -4.83 117.38 105.57 1m90 n GLN 82 Ca 0.02 -0.31 -0.37 0.00 0.00 0.00 0.00 57.00 56.34 1m90 n GLN 82 Cb 0.33 -1.49 -0.07 0.00 0.00 0.00 0.00 30.24 29.01 1m90 n GLN 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1m90 s ALA 83 N -2.37 3.69 0.15 2.61 0.00 -0.45 -5.02 121.76 120.37 1m90 s ALA 83 Ca 0.32 -0.49 -0.32 0.00 0.00 0.00 0.00 51.96 51.47 1m90 s ALA 83 Cb 0.20 -2.26 -0.12 0.00 0.00 0.00 0.00 23.12 20.94 1m90 s ALA 83 CO 0.45 0.29 1.75 0.28 0.00 0.00 0.00 175.76 178.53 1m90 n VAL 84 N 2.90 0.18 -0.70 0.00 0.31 -1.26 0.67 118.33 120.43 1m90 n VAL 84 Ca -0.15 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 1m90 n VAL 84 Cb 0.53 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 1m90 n VAL 84 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1m90 n LYS 85 N 4.68 0.00 -1.70 5.55 4.76 -1.26 -4.78 118.16 125.41 1m90 n LYS 85 Ca 0.17 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.32 1m90 n LYS 85 Cb 0.34 -1.80 0.12 0.00 -1.84 0.00 0.00 35.03 31.86 1m90 n LYS 85 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1m90 s GLY 86 N -1.74 1.60 1.01 0.72 0.00 0.21 -4.45 107.32 104.66 1m90 s GLY 86 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 44.72 43.97 1m90 s GLY 86 CO 0.00 -0.08 1.08 1.09 0.00 0.00 0.00 173.10 175.19 1m90 s ARG 87 N -5.44 0.33 -0.24 2.90 1.70 0.29 -4.72 118.95 113.77 1m90 s ARG 87 Ca 0.64 0.95 -0.15 0.00 -0.47 0.00 0.00 55.73 56.69 1m90 s ARG 87 Cb -0.12 -1.69 -0.04 0.00 -0.57 0.00 0.00 34.95 32.53 1m90 s ARG 87 CO 0.52 -2.91 0.38 0.45 -1.08 0.00 0.00 175.30 172.65 1m90 s SER 88 N -2.94 6.33 0.11 -2.89 0.15 -1.26 -4.04 113.70 109.15 1m90 s SER 88 Ca 0.66 0.38 -0.31 0.00 0.70 0.00 0.00 55.95 57.39 1m90 s SER 88 Cb -0.22 -2.22 -0.10 0.00 -1.71 0.00 0.00 66.02 61.78 1m90 s SER 88 CO 0.60 -0.13 1.59 0.00 1.20 0.00 0.00 173.24 176.51 1m90 h ALA 89 N 7.78 -0.72 -2.37 5.45 0.00 -1.94 -3.35 119.26 124.10 1m90 h ALA 89 Ca -0.34 -0.08 -0.59 0.00 0.00 0.00 0.00 54.91 53.91 1m90 h ALA 89 Cb 1.16 0.66 -0.40 0.00 0.00 0.00 0.00 17.79 19.21 1m90 h ALA 89 CO 0.68 -0.97 -0.86 0.72 0.00 0.00 0.00 179.25 178.82 1m90 n HIS 90 N -5.46 0.91 -2.04 0.00 8.25 -1.26 -5.12 115.22 110.50 1m90 n HIS 90 Ca -0.07 -3.74 -0.28 0.00 -0.26 0.00 0.00 57.72 53.37 1m90 n HIS 90 Cb 0.37 -0.24 0.13 0.00 1.12 0.00 0.00 29.99 31.37 1m90 n HIS 90 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1m90 s PRO 91 N -1.08 1.43 0.39 -0.41 0.04 -1.26 -5.03 135.00 129.09 1m90 s PRO 91 Ca 0.33 -0.30 -0.27 0.00 0.04 0.00 0.00 61.00 60.81 1m90 s PRO 91 Cb 0.08 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 1m90 s PRO 91 CO -0.13 -1.85 1.38 -2.14 0.04 0.00 0.00 177.00 174.30 1m90 s PRO 92 N -5.60 4.02 -0.06 0.56 0.02 -1.26 -4.97 135.00 127.72 1m90 s PRO 92 Ca 0.67 2.35 0.02 0.00 0.02 0.00 0.00 61.00 64.06 1m90 s PRO 92 Cb -0.07 -2.86 0.01 0.00 0.02 0.00 0.00 34.50 31.60 1m90 s PRO 92 CO 0.49 -0.52 -0.12 0.15 -0.33 0.00 0.00 177.00 176.68 1m90 s LYS 93 N -2.16 1.56 0.29 5.54 1.02 -1.25 -3.25 119.74 121.48 1m90 s LYS 93 Ca 0.55 -0.40 0.03 0.00 0.02 0.00 0.00 55.97 56.17 1m90 s LYS 93 Cb -0.42 -1.32 0.64 0.00 -0.52 0.00 0.00 37.83 36.21 1m90 s LYS 93 CO 0.56 0.06 1.78 1.15 -0.92 0.00 0.00 175.35 177.97 1m90 h THR 94 N 5.82 0.73 0.00 2.17 2.02 -1.53 -1.68 112.91 120.44 1m90 h THR 94 Ca -0.32 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1m90 h THR 94 Cb 1.18 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1m90 h THR 94 CO 0.48 0.13 0.00 -0.33 0.37 0.00 0.00 175.52 176.17 1m90 h GLU 95 N 0.73 0.00 -6.67 6.66 3.07 -1.95 -3.44 114.58 112.97 1m90 h GLU 95 Ca 0.53 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.86 1m90 h GLU 95 Cb 0.77 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 28.73 1m90 h GLU 95 CO -0.37 0.00 0.87 0.21 -1.40 0.00 0.00 179.01 178.33 1m90 s LYS 96 N -3.98 4.20 -0.46 2.33 2.20 -0.63 -4.94 119.74 118.46 1m90 s LYS 96 Ca -0.04 2.41 -0.28 0.00 -0.36 0.00 0.00 55.97 57.70 1m90 s LYS 96 Cb 0.11 -3.12 0.03 0.00 -1.51 0.00 0.00 37.83 33.35 1m90 s LYS 96 CO 0.39 -0.59 1.07 0.34 -0.36 0.00 0.00 175.35 176.19 1m90 s ASP 97 N 0.89 6.62 -0.14 1.43 3.68 -1.26 -4.88 116.67 123.00 1m90 s ASP 97 Ca 0.67 0.41 0.16 0.00 2.13 0.00 0.00 52.55 55.93 1m90 s ASP 97 Cb -0.45 -2.52 0.65 0.00 -1.45 0.00 0.00 42.92 39.16 1m90 s ASP 97 CO 0.36 -1.16 1.57 0.54 0.13 0.00 0.00 175.17 176.61 1m90 n ARG 98 N 7.56 3.72 -3.78 4.34 1.74 -1.26 -4.97 116.66 124.01 1m90 n ARG 98 Ca 0.10 -2.85 -0.27 0.00 -0.77 0.00 0.00 57.85 54.06 1m90 n ARG 98 Cb 0.49 -1.90 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 1m90 n ARG 98 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1m90 s SER 99 N -1.14 6.37 -0.12 0.55 1.04 -1.26 -4.54 113.70 114.60 1m90 s SER 99 Ca 0.47 0.32 0.03 0.00 0.48 0.00 0.00 55.95 57.24 1m90 s SER 99 Cb 0.33 -1.97 0.01 0.00 0.10 0.00 0.00 66.02 64.48 1m90 s SER 99 CO 0.18 -0.01 -0.21 -0.76 0.98 0.00 0.00 173.24 173.42 1m90 s LEU 100 N -3.31 2.01 0.75 2.42 1.43 -1.26 -5.01 118.68 115.71 1m90 s LEU 100 Ca 0.37 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.81 1m90 s LEU 100 Cb -0.11 -1.34 0.04 0.00 0.03 0.00 0.00 46.19 44.81 1m90 s LEU 100 CO 0.29 0.09 1.13 -1.81 0.23 0.00 0.00 176.35 176.27 1m90 s ASP 101 N 0.71 5.05 -0.29 2.29 1.11 -1.26 -4.90 116.67 119.38 1m90 s ASP 101 Ca -0.10 0.97 -0.15 0.00 0.18 0.00 0.00 52.55 53.45 1m90 s ASP 101 Cb -0.16 -1.64 0.15 0.00 1.07 0.00 0.00 42.92 42.34 1m90 s ASP 101 CO 0.01 -1.57 0.95 -0.22 1.18 0.00 0.00 175.17 175.51 1m90 s LEU 102 N -5.44 -0.61 0.33 1.23 2.96 -1.26 -5.02 118.68 110.88 1m90 s LEU 102 Ca 0.60 0.89 -0.29 0.00 -0.22 0.00 0.00 54.13 55.10 1m90 s LEU 102 Cb -0.11 1.77 -0.11 0.00 0.50 0.00 0.00 46.19 48.24 1m90 s LEU 102 CO 0.50 -0.13 1.54 0.20 -1.32 0.00 0.00 176.35 177.14 1m90 s ASN 103 N 2.00 6.37 0.21 3.68 -0.87 -1.26 -4.84 114.94 120.23 1m90 s ASN 103 Ca -0.06 2.99 -0.10 0.00 -1.57 0.00 0.00 52.86 54.12 1m90 s ASN 103 Cb -0.05 -2.65 0.29 0.00 -0.02 0.00 0.00 41.25 38.81 1m90 s ASN 103 CO -0.17 -0.89 1.71 0.44 -2.57 0.00 0.00 177.10 175.63 1m90 h ASP 104 N 3.97 0.03 0.16 -1.22 3.32 -2.01 0.03 116.42 120.71 1m90 h ASP 104 Ca -0.49 0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.68 1m90 h ASP 104 Cb 1.23 0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 1m90 h ASP 104 CO 0.72 0.02 -0.21 0.11 -1.72 0.00 0.00 179.24 178.16 1m90 h LYS 105 N 0.27 -0.42 -0.83 3.56 1.57 -1.98 0.44 116.57 119.18 1m90 h LYS 105 Ca 0.31 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.23 1m90 h LYS 105 Cb 0.45 0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.80 1m90 h LYS 105 CO -0.39 -0.28 0.54 1.49 -0.57 0.00 0.00 179.45 180.25 1m90 h GLU 106 N -0.43 0.73 0.00 3.15 4.81 -1.77 0.13 114.58 121.20 1m90 h GLU 106 Ca 0.01 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 58.93 1m90 h GLU 106 Cb 0.43 -0.16 0.02 0.00 0.63 0.00 0.00 28.75 29.67 1m90 h GLU 106 CO -0.09 0.48 -1.05 -0.09 -0.73 0.00 0.00 179.01 177.54 1m90 h ARG 107 N 0.75 0.71 -0.36 1.92 2.43 -0.24 -2.52 114.38 117.08 1m90 h ARG 107 Ca 0.39 -0.76 -0.12 0.00 -0.81 0.00 0.00 59.98 58.69 1m90 h ARG 107 Cb 0.50 0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1m90 h ARG 107 CO -0.16 1.33 -0.25 1.96 -1.51 0.00 0.00 179.97 181.34 1m90 h GLN 108 N 0.40 0.73 -0.71 0.20 4.20 0.43 -1.45 115.11 118.91 1m90 h GLN 108 Ca -0.13 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.24 1m90 h GLN 108 Cb 1.70 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.42 1m90 h GLN 108 CO 0.21 0.91 0.29 1.25 -0.67 0.00 0.00 178.83 180.81 1m90 h LEU 109 N 0.63 0.95 -0.82 1.46 5.85 -0.77 -1.28 115.31 121.33 1m90 h LEU 109 Ca 0.08 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 1m90 h LEU 109 Cb 0.76 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1m90 h LEU 109 CO 0.06 0.84 -0.13 0.00 -0.34 0.00 0.00 178.44 178.88 1m90 h ALA 110 N 1.30 1.00 -0.21 1.25 0.00 -1.03 -0.63 119.26 120.93 1m90 h ALA 110 Ca 0.24 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1m90 h ALA 110 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1m90 h ALA 110 CO -0.02 0.60 0.12 0.28 0.00 0.00 0.00 179.25 180.23 1m90 h VAL 111 N 0.68 1.09 -0.67 0.00 2.07 -0.41 0.12 116.25 119.13 1m90 h VAL 111 Ca 0.11 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1m90 h VAL 111 Cb 0.60 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1m90 h VAL 111 CO 0.04 0.09 0.35 0.03 0.02 0.00 0.00 177.57 178.10 1m90 h ARG 112 N 0.25 0.94 -0.40 1.57 3.08 -1.09 -1.31 114.38 117.42 1m90 h ARG 112 Ca 0.08 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 1m90 h ARG 112 Cb 0.03 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1m90 h ARG 112 CO -0.01 0.72 -0.02 1.03 -1.07 0.00 0.00 179.97 180.61 1m90 h SER 113 N 0.92 0.62 0.26 7.04 0.87 -0.71 -0.99 113.55 121.55 1m90 h SER 113 Ca 0.23 -0.14 -0.17 0.00 -1.23 0.00 0.00 61.79 60.48 1m90 h SER 113 Cb 0.06 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1m90 h SER 113 CO -0.04 0.70 -0.67 0.00 -0.53 0.00 0.00 176.83 176.30 1m90 h ALA 114 N 1.37 0.68 -0.22 6.23 0.00 -0.66 -1.80 119.26 124.86 1m90 h ALA 114 Ca 0.12 -0.58 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1m90 h ALA 114 Cb 0.41 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1m90 h ALA 114 CO 0.02 0.75 0.13 1.25 0.00 0.00 0.00 179.25 181.40 1m90 h LEU 115 N 0.26 0.22 -1.01 0.00 5.85 -0.67 -2.73 115.31 117.23 1m90 h LEU 115 Ca -0.02 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1m90 h LEU 115 Cb 1.22 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 1m90 h LEU 115 CO 0.11 0.16 0.30 0.00 -0.34 0.00 0.00 178.44 178.67 1m90 h ALA 116 N 1.09 1.22 0.00 1.25 0.00 -0.96 -1.36 119.26 120.50 1m90 h ALA 116 Ca 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1m90 h ALA 116 Cb -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1m90 h ALA 116 CO -0.03 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1m90 n ALA 117 N -2.44 1.40 0.19 0.00 0.00 -0.70 -1.77 120.51 117.19 1m90 n ALA 117 Ca 0.06 0.14 0.06 0.00 0.00 0.00 0.00 53.44 53.70 1m90 n ALA 117 Cb 0.16 -1.36 0.37 0.00 0.00 0.00 0.00 19.45 18.62 1m90 n ALA 117 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1m90 h THR 118 N 0.00 0.88 -0.32 0.00 2.02 -1.08 -3.08 112.91 111.34 1m90 h THR 118 Ca 0.00 -1.41 0.00 0.00 0.77 0.00 0.00 66.41 65.77 1m90 h THR 118 Cb 0.21 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1m90 h THR 118 CO 0.00 0.34 0.00 0.00 0.37 0.00 0.00 175.52 176.23 1m90 n ALA 119 N -2.31 2.69 -3.92 6.16 0.00 -0.73 -3.35 120.51 119.04 1m90 n ALA 119 Ca -0.01 -0.70 -0.33 0.00 0.00 0.00 0.00 53.44 52.41 1m90 n ALA 119 Cb 0.48 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.79 1m90 n ALA 119 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1m90 s ASP 120 N -0.78 4.87 0.48 0.00 -1.08 -1.16 -4.70 116.67 114.30 1m90 s ASP 120 Ca 0.24 -2.29 0.28 0.00 -0.52 0.00 0.00 52.55 50.26 1m90 s ASP 120 Cb 0.15 -1.70 1.36 0.00 -1.46 0.00 0.00 42.92 41.26 1m90 s ASP 120 CO 0.13 -0.40 1.80 0.00 0.52 0.00 0.00 175.17 177.22 1m90 h ALA 121 N 7.53 2.72 -0.14 3.66 0.00 -1.85 -1.32 119.26 129.85 1m90 h ALA 121 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1m90 h ALA 121 Cb 1.00 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1m90 h ALA 121 CO 0.60 -1.07 -0.23 -0.44 0.00 0.00 0.00 179.25 178.11 1m90 h ASP 122 N 0.16 0.45 0.42 0.00 3.32 -1.95 -1.99 116.42 116.83 1m90 h ASP 122 Ca 0.56 -0.53 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1m90 h ASP 122 Cb 1.87 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 41.28 1m90 h ASP 122 CO -0.13 0.90 -0.29 -0.07 -1.72 0.00 0.00 179.24 177.93 1m90 h LEU 123 N 0.02 -0.74 -1.39 1.55 3.38 -1.61 0.20 115.31 116.73 1m90 h LEU 123 Ca 0.01 0.05 0.27 0.00 0.09 0.00 0.00 57.88 58.30 1m90 h LEU 123 Cb 0.81 0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 1m90 h LEU 123 CO 0.05 -0.44 0.67 0.58 0.09 0.00 0.00 178.44 179.39 1m90 h VAL 124 N -0.69 0.52 0.02 1.22 2.07 -1.36 0.53 116.25 118.56 1m90 h VAL 124 Ca -0.04 -0.13 -0.22 0.00 0.82 0.00 0.00 66.70 67.13 1m90 h VAL 124 Cb 0.58 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1m90 h VAL 124 CO 0.02 0.07 -0.95 0.00 0.02 0.00 0.00 177.57 176.73 1m90 h ALA 125 N 1.61 0.40 -0.33 1.67 0.00 -0.56 -3.14 119.26 118.90 1m90 h ALA 125 Ca 0.59 -0.74 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1m90 h ALA 125 Cb 1.53 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1m90 h ALA 125 CO -0.28 0.88 -0.43 -0.44 0.00 0.00 0.00 179.25 178.97 1m90 h ASP 126 N 0.16 0.92 0.00 0.00 3.32 0.19 -2.38 116.42 118.62 1m90 h ASP 126 Ca -0.07 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1m90 h ASP 126 Cb 1.60 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1m90 h ASP 126 CO 0.16 1.22 0.17 -0.09 -1.72 0.00 0.00 179.24 178.97 1m90 h ARG 127 N 0.69 0.00 0.00 3.56 2.43 -0.53 -3.45 114.38 117.07 1m90 h ARG 127 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1m90 h ARG 127 Cb 1.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1m90 h ARG 127 CO 0.10 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.97 1m90 n GLY 128 N -1.16 1.83 3.76 2.80 0.00 -0.90 -5.11 105.19 106.41 1m90 n GLY 128 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1m90 n GLY 128 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1m90 n HIS 129 N -0.25 2.65 -3.65 1.61 8.25 -1.19 -4.99 115.22 117.64 1m90 n HIS 129 Ca 0.00 0.45 -0.37 0.00 -0.26 0.00 0.00 57.72 57.53 1m90 n HIS 129 Cb 0.00 -2.45 -0.11 0.00 1.12 0.00 0.00 29.99 28.55 1m90 n HIS 129 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1m90 s GLU 130 N -2.41 3.95 -0.08 -0.41 0.41 -1.26 -4.66 118.70 114.24 1m90 s GLU 130 Ca 0.61 -0.33 -0.30 0.00 -0.41 0.00 0.00 54.97 54.54 1m90 s GLU 130 Cb -0.46 -3.56 0.11 0.00 -1.78 0.00 0.00 34.13 28.45 1m90 s GLU 130 CO 0.58 -0.09 0.97 -0.59 -0.49 0.00 0.00 175.26 175.64 1m90 s PHE 131 N 1.47 -0.32 -0.59 1.61 -0.12 -1.26 -1.57 117.98 117.20 1m90 s PHE 131 Ca 0.07 0.31 0.06 0.00 -0.05 0.00 0.00 56.93 57.32 1m90 s PHE 131 Cb -0.15 0.51 0.25 0.00 -0.63 0.00 0.00 43.02 43.00 1m90 s PHE 131 CO 0.08 -0.44 0.69 -0.25 -0.05 0.00 0.00 175.22 175.25 1m90 n ASP 132 N 0.05 2.95 -4.06 1.98 8.00 -0.73 -5.04 116.55 119.69 1m90 n ASP 132 Ca -0.08 -3.27 -0.07 0.00 0.71 0.00 0.00 54.79 52.08 1m90 n ASP 132 Cb 0.60 -0.67 -0.10 0.00 -0.02 0.00 0.00 41.12 40.94 1m90 n ASP 132 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1m90 s ARG 133 N -2.16 0.63 -0.13 -1.24 3.52 -1.26 -4.81 118.95 113.50 1m90 s ARG 133 Ca 0.38 -1.17 0.06 0.00 -0.13 0.00 0.00 55.73 54.87 1m90 s ARG 133 Cb 0.15 0.22 -0.12 0.00 -1.56 0.00 0.00 34.95 33.64 1m90 s ARG 133 CO -0.04 -0.13 -0.04 -0.25 -0.81 0.00 0.00 175.30 174.03 1m90 n ASP 134 N 0.14 2.53 -4.88 -2.12 8.00 -1.26 -4.99 116.55 113.96 1m90 n ASP 134 Ca -0.14 -0.04 -0.30 0.00 0.71 0.00 0.00 54.79 55.02 1m90 n ASP 134 Cb 0.61 0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.97 1m90 n ASP 134 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1m90 s GLU 135 N -2.28 3.73 -0.29 -1.24 2.02 -1.26 -4.72 118.70 114.65 1m90 s GLU 135 Ca -0.12 0.33 -0.25 0.00 0.02 0.00 0.00 54.97 54.94 1m90 s GLU 135 Cb 0.04 -2.46 0.17 0.00 0.10 0.00 0.00 34.13 31.98 1m90 s GLU 135 CO 0.40 0.02 1.32 0.54 0.02 0.00 0.00 175.26 177.56 1m90 s VAL 136 N -2.32 0.00 1.10 2.63 0.11 -1.26 -4.73 120.40 115.93 1m90 s VAL 136 Ca 0.49 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.41 1m90 s VAL 136 Cb -0.10 -1.00 0.24 0.00 -1.53 0.00 0.00 36.38 33.99 1m90 s VAL 136 CO 0.32 0.00 1.06 -2.16 -3.33 0.00 0.00 175.10 170.99 1m90 s PRO 137 N 0.01 -0.37 -0.35 1.54 0.04 -1.21 -4.33 135.00 130.33 1m90 s PRO 137 Ca 0.06 0.55 -0.20 0.00 0.04 0.00 0.00 61.00 61.45 1m90 s PRO 137 Cb -0.05 -1.64 -0.00 0.00 0.04 0.00 0.00 34.50 32.85 1m90 s PRO 137 CO -0.12 -3.28 0.63 0.08 0.04 0.00 0.00 177.00 174.35 1m90 s VAL 138 N -2.77 4.90 -0.02 -0.36 1.01 -0.99 -4.95 120.40 117.22 1m90 s VAL 138 Ca 0.67 0.63 -0.07 0.00 0.00 0.00 0.00 61.98 63.21 1m90 s VAL 138 Cb -0.20 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1m90 s VAL 138 CO 0.60 -0.28 0.24 -0.69 0.00 0.00 0.00 175.10 174.98 1m90 s VAL 139 N 2.68 5.34 0.06 2.92 1.01 -1.26 -0.91 120.40 130.24 1m90 s VAL 139 Ca 0.24 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1m90 s VAL 139 Cb -0.15 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1m90 s VAL 139 CO 0.14 0.43 -0.05 -0.69 0.00 0.00 0.00 175.10 174.94 1m90 s VAL 140 N -1.23 0.40 0.53 2.92 1.01 -1.03 -2.48 120.40 120.53 1m90 s VAL 140 Ca 0.24 -1.73 -0.21 0.00 0.00 0.00 0.00 61.98 60.28 1m90 s VAL 140 Cb -0.13 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 1m90 s VAL 140 CO 0.14 -0.87 1.26 -0.94 0.00 0.00 0.00 175.10 174.69 1m90 s SER 141 N -2.75 5.51 0.00 3.32 1.04 0.05 0.26 113.70 121.13 1m90 s SER 141 Ca 0.06 2.54 0.00 0.00 0.48 0.00 0.00 55.95 59.02 1m90 s SER 141 Cb 0.04 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1m90 s SER 141 CO -0.07 -1.38 0.82 0.47 0.98 0.00 0.00 173.24 174.06 1m90 n ASP 142 N -1.00 0.00 0.22 7.02 8.00 -1.26 -1.24 116.55 128.29 1m90 n ASP 142 Ca 0.10 0.34 0.15 0.00 0.71 0.00 0.00 54.79 56.09 1m90 n ASP 142 Cb 0.47 -0.34 0.63 0.00 -0.02 0.00 0.00 41.12 41.87 1m90 n ASP 142 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1m90 h ASP 143 N 0.00 0.00 -0.88 -2.24 3.32 -1.96 -2.63 116.42 112.03 1m90 h ASP 143 Ca 0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.14 1m90 h ASP 143 Cb 0.11 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.60 1m90 h ASP 143 CO 0.00 0.00 0.57 0.15 -1.72 0.00 0.00 179.24 178.24 1m90 h PHE 144 N 0.00 0.95 0.00 4.55 3.57 -1.53 -0.00 116.94 124.48 1m90 h PHE 144 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1m90 h PHE 144 Cb 0.43 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.86 1m90 h PHE 144 CO 0.00 0.45 0.00 0.39 -2.23 0.00 0.00 178.31 176.92 1m90 n GLU 145 N -4.52 0.04 0.00 1.11 1.02 -0.99 -1.60 120.64 115.70 1m90 n GLU 145 Ca 0.15 0.27 0.09 0.00 -0.02 0.00 0.00 57.16 57.65 1m90 n GLU 145 Cb 0.29 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.15 1m90 n GLU 145 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1m90 n ASP 146 N -1.30 1.35 -4.71 1.62 8.00 -0.01 -4.97 116.55 116.52 1m90 n ASP 146 Ca 0.01 -1.17 -0.33 0.00 0.71 0.00 0.00 54.79 54.01 1m90 n ASP 146 Cb 0.02 0.73 0.12 0.00 -0.02 0.00 0.00 41.12 41.98 1m90 n ASP 146 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1m90 s LEU 147 N -2.54 3.14 0.00 0.64 1.43 -0.63 -4.94 118.68 115.78 1m90 s LEU 147 Ca 0.11 2.30 0.00 0.00 -1.03 0.00 0.00 54.13 55.51 1m90 s LEU 147 Cb 0.15 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.78 1m90 s LEU 147 CO 0.61 -2.57 0.00 0.52 0.23 0.00 0.00 176.35 175.15 1m90 n VAL 148 N -3.27 0.00 -3.48 -1.59 0.31 -1.26 -4.58 118.33 104.46 1m90 n VAL 148 Ca 0.13 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.08 1m90 n VAL 148 Cb 0.51 -0.38 -0.06 0.00 -0.91 0.00 0.00 33.84 32.99 1m90 n VAL 148 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1m90 s LYS 149 N -1.46 3.94 0.09 5.55 -0.14 -1.26 -4.43 119.74 122.03 1m90 s LYS 149 Ca 0.00 0.44 -0.21 0.00 -1.36 0.00 0.00 55.97 54.84 1m90 s LYS 149 Cb 0.00 -3.22 -0.11 0.00 -1.68 0.00 0.00 37.83 32.83 1m90 s LYS 149 CO 0.00 0.68 1.67 1.15 -0.76 0.00 0.00 175.35 178.10 1m90 h THR 150 N 3.66 1.10 -1.02 2.17 2.02 -1.92 -2.58 112.91 116.35 1m90 h THR 150 Ca -0.51 -0.29 0.25 0.00 0.77 0.00 0.00 66.41 66.62 1m90 h THR 150 Cb 1.22 1.07 -0.10 0.00 -1.74 0.00 0.00 68.15 68.60 1m90 h THR 150 CO 0.62 0.09 0.65 1.56 0.37 0.00 0.00 175.52 178.81 1m90 h GLN 151 N 0.10 0.45 -0.32 6.66 1.08 -1.94 0.23 115.11 121.37 1m90 h GLN 151 Ca 0.04 -0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.13 1m90 h GLN 151 Cb 0.09 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1m90 h GLN 151 CO -0.01 0.30 -0.17 0.93 -0.95 0.00 0.00 178.83 178.93 1m90 h GLU 152 N 0.47 0.57 0.00 1.46 5.08 -1.84 -1.62 114.58 118.70 1m90 h GLU 152 Ca 0.59 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.73 1m90 h GLU 152 Cb 1.37 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 1m90 h GLU 152 CO -0.33 0.72 -0.14 0.28 -1.00 0.00 0.00 179.01 178.54 1m90 h VAL 153 N 0.52 0.35 0.09 3.13 2.07 -0.54 -2.58 116.25 119.28 1m90 h VAL 153 Ca 0.09 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1m90 h VAL 153 Cb 0.59 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1m90 h VAL 153 CO 0.04 0.14 -0.04 0.58 0.02 0.00 0.00 177.57 178.30 1m90 h VAL 154 N 0.00 1.15 -0.12 2.57 2.07 -0.43 -1.84 116.25 119.64 1m90 h VAL 154 Ca -0.00 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.55 1m90 h VAL 154 Cb 0.67 1.78 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 1m90 h VAL 154 CO 0.02 0.24 -0.16 0.28 0.02 0.00 0.00 177.57 177.97 1m90 h SER 155 N -0.60 -0.49 -0.68 0.57 0.02 -1.25 0.89 113.55 112.02 1m90 h SER 155 Ca -0.01 0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 1m90 h SER 155 Cb 0.49 0.23 -0.07 0.00 0.14 0.00 0.00 62.40 63.18 1m90 h SER 155 CO 0.02 -0.20 0.30 0.25 -1.14 0.00 0.00 176.83 176.06 1m90 h LEU 156 N -0.20 0.36 -0.91 5.07 5.85 -1.51 0.17 115.31 124.15 1m90 h LEU 156 Ca 0.09 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 1m90 h LEU 156 Cb 0.33 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1m90 h LEU 156 CO -0.24 0.20 0.08 -0.07 -0.34 0.00 0.00 178.44 178.07 1m90 h LEU 157 N 0.52 0.84 -0.76 2.25 3.38 -0.47 0.37 115.31 121.43 1m90 h LEU 157 Ca 0.34 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 1m90 h LEU 157 Cb 0.40 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1m90 h LEU 157 CO -0.29 0.86 -0.48 -0.33 0.09 0.00 0.00 178.44 178.28 1m90 h GLU 158 N 0.83 0.34 -0.01 1.13 5.08 0.15 -0.97 114.58 121.13 1m90 h GLU 158 Ca 0.17 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1m90 h GLU 158 Cb 0.39 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1m90 h GLU 158 CO 0.01 0.75 -0.51 0.00 -1.00 0.00 0.00 179.01 178.25 1m90 h ALA 159 N 1.23 1.14 -0.27 3.43 0.00 -0.16 -2.47 119.26 122.16 1m90 h ALA 159 Ca 0.02 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1m90 h ALA 159 Cb 0.94 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1m90 h ALA 159 CO 0.08 0.64 0.00 1.28 0.00 0.00 0.00 179.25 181.25 1m90 n LEU 160 N -3.93 1.89 -3.76 0.00 4.77 0.07 -4.90 117.00 111.14 1m90 n LEU 160 Ca -0.01 -0.86 -0.27 0.00 -0.03 0.00 0.00 56.01 54.83 1m90 n LEU 160 Cb 0.53 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1m90 n LEU 160 CO 0.41 0.43 0.18 0.47 -1.33 0.00 0.00 177.39 177.55 1m90 n ASP 161 N 0.49 -5.63 0.00 -1.43 8.00 -0.90 -4.84 116.55 112.24 1m90 n ASP 161 Ca 0.15 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.99 1m90 n ASP 161 Cb 0.33 -4.47 0.00 0.00 -0.02 0.00 0.00 41.12 36.96 1m90 n ASP 161 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1m90 n VAL 162 N -4.86 0.00 0.23 2.53 0.31 -0.42 -1.78 118.33 114.34 1m90 n VAL 162 Ca 0.03 -0.23 0.18 0.00 -0.01 0.00 0.00 64.34 64.31 1m90 n VAL 162 Cb 0.54 0.76 0.86 0.00 -0.91 0.00 0.00 33.84 35.09 1m90 n VAL 162 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1m90 h HIS 163 N 0.00 0.00 -0.36 3.52 6.17 -1.79 -2.18 115.15 120.51 1m90 h HIS 163 Ca 0.00 0.00 0.09 0.00 0.71 0.00 0.00 60.37 61.17 1m90 h HIS 163 Cb 0.00 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 29.91 1m90 h HIS 163 CO 0.00 0.00 0.25 0.00 0.71 0.00 0.00 177.93 178.89 1m90 h ALA 164 N 1.65 2.23 -0.43 5.26 0.00 -1.86 -0.95 119.26 125.16 1m90 h ALA 164 Ca 0.08 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1m90 h ALA 164 Cb 0.58 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1m90 h ALA 164 CO -0.00 -0.32 -0.09 0.22 0.00 0.00 0.00 179.25 179.06 1m90 h ASP 165 N 0.08 0.75 0.66 0.00 3.58 -0.60 -1.47 116.42 119.42 1m90 h ASP 165 Ca 0.17 -0.21 -0.09 0.00 0.42 0.00 0.00 57.03 57.32 1m90 h ASP 165 Cb 0.56 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1m90 h ASP 165 CO -0.02 0.87 -0.43 0.40 -2.88 0.00 0.00 179.24 177.19 1m90 h ILE 166 N 0.69 1.09 -0.10 2.25 2.04 -1.36 -1.03 117.51 121.10 1m90 h ILE 166 Ca 0.12 -1.58 -0.08 0.00 1.00 0.00 0.00 64.86 64.32 1m90 h ILE 166 Cb 0.56 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 1m90 h ILE 166 CO 0.03 0.42 -0.32 0.44 0.00 0.00 0.00 178.15 178.72 1m90 h ASP 167 N 0.00 0.19 0.10 1.72 3.45 -0.85 -1.49 116.42 119.54 1m90 h ASP 167 Ca -0.00 -0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.39 1m90 h ASP 167 Cb 0.87 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.59 1m90 h ASP 167 CO 0.06 0.51 -0.05 -0.09 -1.57 0.00 0.00 179.24 178.10 1m90 h ARG 168 N 0.17 -0.13 0.00 3.56 2.43 -0.32 -2.97 114.38 117.12 1m90 h ARG 168 Ca 0.02 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1m90 h ARG 168 Cb 0.66 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1m90 h ARG 168 CO 0.05 0.26 0.00 0.00 -1.51 0.00 0.00 179.97 178.77 1m90 n ALA 169 N -2.37 1.98 -1.12 2.80 0.00 -0.56 -3.85 120.51 117.39 1m90 n ALA 169 Ca -0.09 -0.09 -0.17 0.00 0.00 0.00 0.00 53.44 53.10 1m90 n ALA 169 Cb 0.23 -1.27 -0.09 0.00 0.00 0.00 0.00 19.45 18.31 1m90 n ALA 169 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1m90 n ASP 170 N -1.20 5.82 -3.56 0.00 4.64 -0.58 -4.39 116.55 117.28 1m90 n ASP 170 Ca 0.09 -2.80 -0.07 0.00 -1.38 0.00 0.00 54.79 50.64 1m90 n ASP 170 Cb 0.11 -1.29 -0.08 0.00 -1.04 0.00 0.00 41.12 38.82 1m90 n ASP 170 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1m90 s GLU 171 N -0.35 0.36 0.28 -0.67 2.02 -1.25 -5.04 118.70 114.04 1m90 s GLU 171 Ca 0.54 0.96 -0.07 0.00 0.02 0.00 0.00 54.97 56.43 1m90 s GLU 171 Cb 0.31 0.21 -0.06 0.00 0.10 0.00 0.00 34.13 34.69 1m90 s GLU 171 CO -0.08 -0.36 0.57 0.95 0.02 0.00 0.00 175.26 176.36 1m90 s THR 172 N 2.64 4.98 -0.10 3.63 -4.23 -1.26 -4.37 115.64 116.92 1m90 s THR 172 Ca 0.02 0.24 0.02 0.00 -1.18 0.00 0.00 61.69 60.80 1m90 s THR 172 Cb -0.13 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.00 1m90 s THR 172 CO -0.14 -0.25 -0.15 -0.75 -0.54 0.00 0.00 174.62 172.78 1m90 s LYS 173 N -3.31 3.03 -0.51 3.99 2.20 0.12 -4.95 119.74 120.31 1m90 s LYS 173 Ca 0.46 -0.72 -0.19 0.00 -0.36 0.00 0.00 55.97 55.15 1m90 s LYS 173 Cb -0.11 -2.49 0.06 0.00 -1.51 0.00 0.00 37.83 33.78 1m90 s LYS 173 CO 0.27 0.35 0.64 0.42 -0.36 0.00 0.00 175.35 176.67 1m90 s ILE 174 N -0.01 4.85 0.78 5.43 1.01 -1.26 -1.91 121.20 130.09 1m90 s ILE 174 Ca -0.04 -0.42 -0.14 0.00 0.00 0.00 0.00 60.65 60.04 1m90 s ILE 174 Cb -0.14 -4.31 0.04 0.00 0.01 0.00 0.00 42.46 38.06 1m90 s ILE 174 CO 0.04 -0.81 1.00 0.29 0.00 0.00 0.00 174.94 175.46 1m90 n LYS 175 N 6.24 0.27 -3.48 2.79 5.02 -0.65 -5.03 118.16 123.33 1m90 n LYS 175 Ca -0.06 0.16 -0.34 0.00 -2.02 0.00 0.00 58.31 56.05 1m90 n LYS 175 Cb 0.46 -2.27 -0.05 0.00 -0.02 0.00 0.00 35.03 33.15 1m90 n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m90 s ALA 176 N -2.01 3.65 0.00 7.82 0.00 -1.26 -4.90 121.76 125.05 1m90 s ALA 176 Ca 0.71 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.38 1m90 s ALA 176 Cb -0.31 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.44 1m90 s ALA 176 CO 0.52 0.53 0.00 0.41 0.00 0.00 0.00 175.76 177.22 1m90 n GLY 177 N 0.60 1.68 0.00 0.00 0.00 -1.26 -4.71 105.19 101.50 1m90 n GLY 177 Ca -0.05 -1.97 0.06 0.00 0.00 0.00 0.00 46.02 44.06 1m90 n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1m90 n GLN 178 N 1.86 0.44 -0.35 1.61 6.02 -1.26 -3.43 117.38 122.27 1m90 n GLN 178 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.13 1m90 n GLN 178 Cb 0.00 -1.41 0.34 0.00 1.02 0.00 0.00 30.24 30.19 1m90 n GLN 178 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1m90 h GLY 179 N 2.29 1.74 -0.65 1.08 0.00 -1.84 0.18 103.07 105.86 1m90 h GLY 179 Ca 0.00 -0.35 0.31 0.00 0.00 0.00 0.00 47.33 47.29 1m90 h GLY 179 CO 0.00 -0.07 0.39 0.23 0.00 0.00 0.00 176.54 177.09 1m90 h SER 180 N 0.72 0.19 0.86 0.19 0.87 -1.63 0.53 113.55 115.28 1m90 h SER 180 Ca 0.58 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 61.36 1m90 h SER 180 Cb 0.95 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1m90 h SER 180 CO -0.37 -0.23 0.00 0.00 -0.53 0.00 0.00 176.83 175.69 1m90 h ALA 181 N 1.88 1.00 -0.40 6.23 0.00 -0.93 -2.75 119.26 124.29 1m90 h ALA 181 Ca 0.68 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.59 1m90 h ALA 181 Cb 1.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1m90 h ALA 181 CO -0.70 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.09 1m90 n ARG 182 N -2.68 3.27 -0.53 0.00 1.74 0.18 -4.95 116.66 113.69 1m90 n ARG 182 Ca 0.01 -2.66 0.00 0.00 -0.77 0.00 0.00 57.85 54.43 1m90 n ARG 182 Cb 0.26 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1m90 n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1m90 n GLY 183 N 0.26 0.73 2.69 -0.13 0.00 -1.04 -4.97 105.19 102.74 1m90 n GLY 183 Ca 0.20 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1m90 n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m90 n ARG 184 N -2.53 3.34 -0.07 1.61 1.74 -0.89 -4.77 116.66 115.09 1m90 n ARG 184 Ca 0.00 -4.23 -0.13 0.00 -0.77 0.00 0.00 57.85 52.73 1m90 n ARG 184 Cb 0.00 -2.27 -0.06 0.00 -1.02 0.00 0.00 32.46 29.11 1m90 n ARG 184 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1m90 h LYS 185 N 2.89 0.43 -6.40 5.56 3.64 -1.78 -3.30 116.57 117.62 1m90 h LYS 185 Ca 0.39 -0.20 -0.44 0.00 -1.27 0.00 0.00 60.65 59.13 1m90 h LYS 185 Cb 0.52 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1m90 h LYS 185 CO 1.07 0.75 -0.27 0.71 -2.27 0.00 0.00 179.45 179.44 1m90 s TYR 186 N -4.49 2.63 -0.13 1.91 1.51 -1.26 -1.64 117.35 115.87 1m90 s TYR 186 Ca -0.14 -0.46 -0.30 0.00 -1.01 0.00 0.00 57.07 55.16 1m90 s TYR 186 Cb 0.06 -2.31 0.12 0.00 -0.11 0.00 0.00 41.96 39.72 1m90 s TYR 186 CO 0.76 -0.44 0.99 -0.98 -1.11 0.00 0.00 175.55 174.77 1m90 s ARG 187 N -4.34 0.62 0.07 -0.62 1.04 -0.80 -4.88 118.95 110.04 1m90 s ARG 187 Ca 0.54 0.05 -0.17 0.00 -1.04 0.00 0.00 55.73 55.11 1m90 s ARG 187 Cb -0.08 0.29 0.03 0.00 -2.04 0.00 0.00 34.95 33.15 1m90 s ARG 187 CO 0.32 -0.21 0.40 -0.98 -0.04 0.00 0.00 175.30 174.79 1m90 s ARG 188 N -1.56 0.97 0.69 3.89 1.70 -1.26 0.14 118.95 123.52 1m90 s ARG 188 Ca 0.00 -0.50 -0.17 0.00 -0.47 0.00 0.00 55.73 54.59 1m90 s ARG 188 Cb -0.01 0.43 -0.01 0.00 -0.57 0.00 0.00 34.95 34.80 1m90 s ARG 188 CO -0.01 -0.35 1.01 -2.30 -1.08 0.00 0.00 175.30 172.57 1m90 n PRO 189 N 0.22 0.66 -3.37 3.89 -0.02 -1.26 -4.97 135.00 130.15 1m90 n PRO 189 Ca -0.17 0.28 -0.38 0.00 -2.02 0.00 0.00 63.50 61.21 1m90 n PRO 189 Cb 0.61 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.78 1m90 n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1m90 s ALA 190 N -1.70 3.53 0.00 3.55 0.00 -1.26 -4.41 121.76 121.47 1m90 s ALA 190 Ca 0.75 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1m90 s ALA 190 Cb -0.36 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1m90 s ALA 190 CO 0.48 0.09 0.00 -1.13 0.00 0.00 0.00 175.76 175.20 1m90 n SER 191 N 3.34 0.00 -4.74 0.00 3.41 0.70 -4.91 113.62 111.42 1m90 n SER 191 Ca -0.09 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.12 1m90 n SER 191 Cb 0.52 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 1m90 n SER 191 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1m90 s ILE 192 N 3.68 4.04 -0.20 -1.33 1.01 -1.26 -4.57 121.20 122.58 1m90 s ILE 192 Ca 0.00 1.91 -0.10 0.00 0.00 0.00 0.00 60.65 62.46 1m90 s ILE 192 Cb 0.00 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1m90 s ILE 192 CO 0.00 0.39 0.12 -0.22 0.00 0.00 0.00 174.94 175.24 1m90 s LEU 193 N -0.80 4.14 -0.30 2.97 2.96 -1.01 -1.84 118.68 124.80 1m90 s LEU 193 Ca 0.44 0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 54.50 1m90 s LEU 193 Cb -0.27 -2.07 0.03 0.00 0.50 0.00 0.00 46.19 44.37 1m90 s LEU 193 CO 0.33 0.17 0.06 -0.36 -1.32 0.00 0.00 176.35 175.23 1m90 s PHE 194 N 0.42 3.18 -0.33 5.38 0.40 0.10 -1.73 117.98 125.40 1m90 s PHE 194 Ca 0.07 -1.30 -0.11 0.00 -0.60 0.00 0.00 56.93 54.99 1m90 s PHE 194 Cb -0.11 -2.22 -0.01 0.00 0.51 0.00 0.00 43.02 41.19 1m90 s PHE 194 CO -0.01 -0.67 0.20 0.08 0.70 0.00 0.00 175.22 175.51 1m90 s VAL 195 N 1.42 4.90 0.00 -0.44 1.01 -0.64 -0.97 120.40 125.68 1m90 s VAL 195 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1m90 s VAL 195 Cb -0.18 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1m90 s VAL 195 CO 0.01 0.01 0.00 0.35 0.00 0.00 0.00 175.10 175.47 1m90 n THR 196 N 5.04 0.00 0.00 3.92 -2.24 -0.84 -2.07 114.28 118.08 1m90 n THR 196 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1m90 n THR 196 Cb 0.49 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1m90 n THR 196 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1m90 n SER 197 N -0.47 2.03 0.02 3.42 2.88 -1.26 -1.85 113.62 118.39 1m90 n SER 197 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 1m90 n SER 197 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 1m90 n SER 197 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1m90 h ASP 198 N 0.00 0.46 -4.65 -3.46 3.32 -1.99 -3.44 116.42 106.66 1m90 h ASP 198 Ca 0.00 -0.94 -0.06 0.00 0.02 0.00 0.00 57.03 56.05 1m90 h ASP 198 Cb 0.85 -0.15 -0.20 0.00 0.22 0.00 0.00 39.33 40.05 1m90 h ASP 198 CO 0.00 1.83 0.13 -1.61 -1.72 0.00 0.00 179.24 177.87 1m90 s GLU 199 N -2.56 0.95 0.56 3.56 2.02 -1.26 -5.13 118.70 116.84 1m90 s GLU 199 Ca -0.21 0.47 -0.19 0.00 0.02 0.00 0.00 54.97 55.07 1m90 s GLU 199 Cb 0.06 0.45 -0.08 0.00 0.10 0.00 0.00 34.13 34.67 1m90 s GLU 199 CO 0.79 -0.24 0.71 -2.30 0.02 0.00 0.00 175.26 174.23 1m90 n PRO 200 N 1.54 0.70 -2.12 0.39 -0.02 -1.26 -4.77 135.00 129.45 1m90 n PRO 200 Ca -0.17 0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 61.16 1m90 n PRO 200 Cb 0.56 -1.87 -0.03 0.00 -0.02 0.00 0.00 33.50 32.15 1m90 n PRO 200 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1m90 s SER 201 N -1.16 5.77 0.38 2.55 0.15 -1.26 -4.82 113.70 115.31 1m90 s SER 201 Ca 0.70 0.74 0.11 0.00 0.70 0.00 0.00 55.95 58.20 1m90 s SER 201 Cb -0.45 -2.53 0.74 0.00 -1.71 0.00 0.00 66.02 62.07 1m90 s SER 201 CO 0.52 -1.90 1.86 0.74 1.20 0.00 0.00 173.24 175.65 1m90 h THR 202 N 6.72 1.23 0.00 6.45 2.02 -1.90 -1.73 112.91 125.70 1m90 h THR 202 Ca -0.29 -1.09 -0.05 0.00 0.77 0.00 0.00 66.41 65.75 1m90 h THR 202 Cb 1.15 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1m90 h THR 202 CO 1.13 0.32 -0.25 0.00 0.37 0.00 0.00 175.52 177.09 1m90 h ALA 203 N 1.63 0.97 0.00 6.16 0.00 -1.81 -3.31 119.26 122.90 1m90 h ALA 203 Ca 0.01 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1m90 h ALA 203 Cb 0.56 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1m90 h ALA 203 CO 0.04 0.31 -1.95 0.00 0.00 0.00 0.00 179.25 177.65 1m90 n ALA 204 N -2.22 2.13 -0.28 0.00 0.00 -1.06 -3.51 120.51 115.58 1m90 n ALA 204 Ca 0.01 -0.74 0.08 0.00 0.00 0.00 0.00 53.44 52.78 1m90 n ALA 204 Cb 0.48 -0.35 0.20 0.00 0.00 0.00 0.00 19.45 19.77 1m90 n ALA 204 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1m90 h ARG 205 N 0.00 0.12 0.00 0.00 0.11 -1.41 -0.31 114.38 112.89 1m90 h ARG 205 Ca -0.22 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.86 1m90 h ARG 205 Cb 1.39 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.44 1m90 h ARG 205 CO 0.01 0.08 0.00 -1.71 0.10 0.00 0.00 179.97 178.45 1m90 n ASN 206 N -5.33 0.00 -4.74 0.08 5.15 -1.26 -4.60 115.26 104.56 1m90 n ASN 206 Ca 0.16 -0.26 -0.42 0.00 -0.60 0.00 0.00 54.58 53.47 1m90 n ASN 206 Cb 0.54 -0.14 -0.02 0.00 -0.53 0.00 0.00 39.78 39.63 1m90 n ASN 206 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1m90 s LEU 207 N -2.28 4.38 -0.49 1.20 1.43 -0.13 -4.84 118.68 117.96 1m90 s LEU 207 Ca 0.21 2.67 -0.45 0.00 -1.03 0.00 0.00 54.13 55.54 1m90 s LEU 207 Cb 0.12 -3.61 -0.19 0.00 0.03 0.00 0.00 46.19 42.53 1m90 s LEU 207 CO 0.23 -0.76 1.90 0.00 0.23 0.00 0.00 176.35 177.94 1m90 n ALA 208 N 2.87 -0.44 -0.89 4.21 0.00 -1.26 0.58 120.51 125.58 1m90 n ALA 208 Ca 0.09 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1m90 n ALA 208 Cb 0.39 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1m90 n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m90 n GLY 209 N 5.84 0.61 3.81 0.00 0.00 -1.26 -4.55 105.19 109.64 1m90 n GLY 209 Ca 0.43 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 1m90 n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m90 s ALA 210 N -2.74 3.04 -0.01 4.61 0.00 0.20 -0.22 121.76 126.64 1m90 s ALA 210 Ca 0.00 0.48 0.03 0.00 0.00 0.00 0.00 51.96 52.47 1m90 s ALA 210 Cb 0.00 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.93 1m90 s ALA 210 CO 0.00 0.03 -0.09 -0.51 0.00 0.00 0.00 175.76 175.19 1m90 s ASP 211 N -2.01 1.05 -0.09 0.00 1.01 -0.77 -4.84 116.67 111.03 1m90 s ASP 211 Ca 0.61 -0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.71 1m90 s ASP 211 Cb -0.13 -0.17 -0.02 0.00 1.01 0.00 0.00 42.92 43.61 1m90 s ASP 211 CO 0.17 0.09 -0.10 0.68 0.21 0.00 0.00 175.17 176.22 1m90 s VAL 212 N -0.08 3.37 0.32 -1.27 -7.23 -1.26 -0.72 120.40 113.53 1m90 s VAL 212 Ca 0.01 -0.58 0.05 0.00 -1.81 0.00 0.00 61.98 59.65 1m90 s VAL 212 Cb -0.05 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.48 1m90 s VAL 212 CO -0.00 0.56 0.21 0.00 -0.31 0.00 0.00 175.10 175.57 1m90 s ALA 213 N -0.34 1.96 0.04 1.32 0.00 -0.14 -4.92 121.76 119.68 1m90 s ALA 213 Ca 0.04 -1.84 0.06 0.00 0.00 0.00 0.00 51.96 50.22 1m90 s ALA 213 Cb -0.13 1.29 -0.02 0.00 0.00 0.00 0.00 23.12 24.27 1m90 s ALA 213 CO 0.02 -0.57 -0.17 0.99 0.00 0.00 0.00 175.76 176.03 1m90 s THR 214 N -3.53 1.37 0.35 0.00 2.01 -1.26 -2.00 115.64 112.58 1m90 s THR 214 Ca 0.37 -1.05 0.07 0.00 0.31 0.00 0.00 61.69 61.39 1m90 s THR 214 Cb 0.03 -1.21 0.31 0.00 0.01 0.00 0.00 72.50 71.65 1m90 s THR 214 CO 0.22 0.13 1.88 0.00 -0.69 0.00 0.00 174.62 176.16 1m90 h ALA 215 N 4.99 1.77 0.00 7.40 0.00 -1.65 0.14 119.26 131.91 1m90 h ALA 215 Ca -0.40 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1m90 h ALA 215 Cb 1.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1m90 h ALA 215 CO 0.44 0.02 -0.39 0.66 0.00 0.00 0.00 179.25 179.98 1m90 h SER 216 N 0.75 0.00 0.00 0.00 4.64 -1.89 -3.34 113.55 113.72 1m90 h SER 216 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1m90 h SER 216 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1m90 h SER 216 CO -0.19 0.39 -0.14 -1.84 -0.87 0.00 0.00 176.83 174.18 1m90 n GLU 217 N -3.59 1.08 -2.02 4.77 0.28 -1.01 -5.05 120.64 115.11 1m90 n GLU 217 Ca -0.00 -1.58 -0.41 0.00 -0.16 0.00 0.00 57.16 55.00 1m90 n GLU 217 Cb 0.51 -0.96 -0.02 0.00 1.43 0.00 0.00 31.44 32.40 1m90 n GLU 217 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1m90 s VAL 218 N -1.22 2.68 0.30 3.84 0.11 0.46 -4.87 120.40 121.70 1m90 s VAL 218 Ca 0.11 0.57 0.01 0.00 -2.93 0.00 0.00 61.98 59.74 1m90 s VAL 218 Cb 0.10 -3.36 0.01 0.00 -1.53 0.00 0.00 36.38 31.60 1m90 s VAL 218 CO 0.01 0.09 0.10 -0.46 -3.33 0.00 0.00 175.10 171.51 1m90 n ASN 219 N 2.43 2.44 -0.37 3.54 0.23 -1.26 -5.02 115.26 117.26 1m90 n ASN 219 Ca 0.07 -2.17 -0.02 0.00 -0.53 0.00 0.00 54.58 51.92 1m90 n ASN 219 Cb 0.40 0.10 0.10 0.00 -2.08 0.00 0.00 39.78 38.31 1m90 n ASN 219 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1m90 h THR 220 N 0.91 1.25 0.13 5.53 2.02 -1.92 -2.04 112.91 118.79 1m90 h THR 220 Ca -0.22 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 1m90 h THR 220 Cb 0.72 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1m90 h THR 220 CO 0.36 0.25 -0.06 -0.33 0.37 0.00 0.00 175.52 176.10 1m90 h GLU 221 N 1.33 -0.17 -0.15 6.66 5.08 -1.92 0.70 114.58 126.11 1m90 h GLU 221 Ca 0.36 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.64 1m90 h GLU 221 Cb -0.14 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1m90 h GLU 221 CO -0.08 -0.01 -0.29 0.38 -1.00 0.00 0.00 179.01 178.01 1m90 h ASP 222 N -0.29 0.28 0.15 1.42 3.04 -1.96 0.14 116.42 119.21 1m90 h ASP 222 Ca -0.02 -0.09 -0.18 0.00 -3.24 0.00 0.00 57.03 53.50 1m90 h ASP 222 Cb 0.23 -0.08 -0.00 0.00 -1.04 0.00 0.00 39.33 38.44 1m90 h ASP 222 CO 0.03 0.57 -0.66 -0.07 -2.04 0.00 0.00 179.24 177.08 1m90 h LEU 223 N 0.25 0.55 -6.09 0.15 4.07 -1.15 -3.38 115.31 109.71 1m90 h LEU 223 Ca 0.04 -0.33 -0.57 0.00 0.08 0.00 0.00 57.88 57.10 1m90 h LEU 223 Cb 0.65 -0.16 -0.39 0.00 1.08 0.00 0.00 40.66 41.84 1m90 h LEU 223 CO 0.05 1.06 -1.07 0.00 -1.08 0.00 0.00 178.44 177.40 1m90 n ALA 224 N -2.52 2.56 -1.61 1.53 0.00 0.24 -3.49 120.51 117.22 1m90 n ALA 224 Ca -0.04 -3.37 -0.49 0.00 0.00 0.00 0.00 53.44 49.54 1m90 n ALA 224 Cb 0.66 -0.80 -0.05 0.00 0.00 0.00 0.00 19.45 19.27 1m90 n ALA 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1m90 n PRO 225 N 1.71 1.48 -1.17 0.00 -0.04 0.48 -0.68 135.00 136.78 1m90 n PRO 225 Ca 0.23 0.53 -0.06 0.00 -0.04 0.00 0.00 63.50 64.17 1m90 n PRO 225 Cb 0.52 -2.17 -0.02 0.00 -0.04 0.00 0.00 33.50 31.79 1m90 n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1m90 n GLY 226 N 2.53 0.76 2.67 0.55 0.00 -1.26 -2.64 105.19 107.80 1m90 n GLY 226 Ca 0.16 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1m90 n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m90 n GLY 227 N -1.26 0.88 3.63 -0.02 0.00 0.15 -5.01 105.19 103.55 1m90 n GLY 227 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1m90 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m90 s ALA 228 N -3.52 3.61 0.64 4.61 0.00 -1.08 -4.22 121.76 121.80 1m90 s ALA 228 Ca 0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 51.96 51.43 1m90 s ALA 228 Cb 0.00 -3.09 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 1m90 s ALA 228 CO 0.00 -0.87 1.05 -2.14 0.00 0.00 0.00 175.76 173.80 1m90 s PRO 229 N 2.59 3.23 0.00 0.00 0.02 -1.26 -4.06 135.00 135.52 1m90 s PRO 229 Ca 0.28 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.29 1m90 s PRO 229 Cb -0.15 -2.03 0.00 0.00 0.02 0.00 0.00 34.50 32.34 1m90 s PRO 229 CO 0.09 -0.87 0.00 0.41 -0.33 0.00 0.00 177.00 176.30 1m90 n GLY 230 N -1.78 0.62 3.76 0.52 0.00 -1.26 -4.66 105.19 102.38 1m90 n GLY 230 Ca 0.08 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 1m90 n GLY 230 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m90 s ARG 231 N -1.59 4.36 -0.43 1.61 3.52 -1.23 -4.01 118.95 121.18 1m90 s ARG 231 Ca 0.00 0.82 -0.27 0.00 -0.13 0.00 0.00 55.73 56.15 1m90 s ARG 231 Cb 0.00 -3.34 -0.05 0.00 -1.56 0.00 0.00 34.95 29.99 1m90 s ARG 231 CO 0.00 0.36 2.24 -1.17 -0.81 0.00 0.00 175.30 175.92 1m90 s LEU 232 N -0.20 3.41 0.32 -0.88 2.96 -1.26 -4.80 118.68 118.23 1m90 s LEU 232 Ca 0.33 1.19 0.08 0.00 -0.22 0.00 0.00 54.13 55.50 1m90 s LEU 232 Cb -0.19 -2.83 -0.03 0.00 0.50 0.00 0.00 46.19 43.63 1m90 s LEU 232 CO 0.19 -2.50 0.23 -0.89 -1.32 0.00 0.00 176.35 172.05 1m90 s THR 233 N 10.42 3.52 -0.24 3.68 2.01 -1.26 -2.40 115.64 131.36 1m90 s THR 233 Ca 0.93 -1.48 -0.04 0.00 0.31 0.00 0.00 61.69 61.41 1m90 s THR 233 Cb -0.21 -3.14 0.09 0.00 0.01 0.00 0.00 72.50 69.25 1m90 s THR 233 CO 0.28 -0.21 0.17 0.54 -0.69 0.00 0.00 174.62 174.71 1m90 s VAL 234 N -2.31 -0.19 0.85 3.82 0.11 -0.70 -2.36 120.40 119.61 1m90 s VAL 234 Ca 0.39 -0.41 -0.08 0.00 -2.93 0.00 0.00 61.98 58.95 1m90 s VAL 234 Cb -0.05 -0.80 0.17 0.00 -1.53 0.00 0.00 36.38 34.17 1m90 s VAL 234 CO 0.25 -0.44 1.16 -0.36 -3.33 0.00 0.00 175.10 172.38 1m90 s PHE 235 N 2.21 1.40 0.02 1.54 0.40 -0.09 -1.62 117.98 121.83 1m90 s PHE 235 Ca 0.07 -0.07 0.07 0.00 -0.60 0.00 0.00 56.93 56.40 1m90 s PHE 235 Cb -0.16 -3.54 -0.03 0.00 0.51 0.00 0.00 43.02 39.81 1m90 s PHE 235 CO -0.23 -2.24 -0.22 -0.08 0.70 0.00 0.00 175.22 173.15 1m90 s THR 236 N -3.52 2.48 0.15 0.64 -1.32 -0.88 -2.46 115.64 110.73 1m90 s THR 236 Ca 0.71 -1.17 -0.15 0.00 -1.21 0.00 0.00 61.69 59.87 1m90 s THR 236 Cb -0.04 -1.98 0.11 0.00 -1.51 0.00 0.00 72.50 69.09 1m90 s THR 236 CO 0.49 0.43 1.08 1.21 -2.21 0.00 0.00 174.62 175.62 1m90 n GLU 237 N 1.90 -0.20 0.05 7.08 4.07 0.14 0.12 120.64 133.79 1m90 n GLU 237 Ca -0.16 1.07 -0.11 0.00 -0.06 0.00 0.00 57.16 57.90 1m90 n GLU 237 Cb 0.52 -1.59 0.01 0.00 -0.06 0.00 0.00 31.44 30.32 1m90 n GLU 237 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1m90 h SER 238 N 0.00 0.51 0.45 4.31 0.02 -1.96 -2.96 113.55 113.92 1m90 h SER 238 Ca 0.21 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1m90 h SER 238 Cb 0.38 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 1m90 h SER 238 CO -0.69 1.09 -0.39 0.00 -1.14 0.00 0.00 176.83 175.71 1m90 h ALA 239 N 0.89 -0.88 -1.09 3.77 0.00 0.59 -0.62 119.26 121.93 1m90 h ALA 239 Ca -0.04 -0.15 0.31 0.00 0.00 0.00 0.00 54.91 55.03 1m90 h ALA 239 Cb 1.34 0.53 -0.11 0.00 0.00 0.00 0.00 17.79 19.55 1m90 h ALA 239 CO 0.13 -1.03 0.68 1.25 0.00 0.00 0.00 179.25 180.29 1m90 h LEU 240 N -0.84 0.45 -0.27 0.00 6.46 0.91 0.20 115.31 122.21 1m90 h LEU 240 Ca -0.04 0.12 -0.21 0.00 -0.12 0.00 0.00 57.88 57.63 1m90 h LEU 240 Cb 0.73 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.72 1m90 h LEU 240 CO -0.02 -0.00 -0.77 0.00 -0.62 0.00 0.00 178.44 177.02 1m90 h ALA 241 N 1.67 0.44 -0.11 1.25 0.00 -1.16 -3.24 119.26 118.11 1m90 h ALA 241 Ca 0.67 -0.61 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1m90 h ALA 241 Cb 1.72 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 1m90 h ALA 241 CO -0.40 0.73 -0.05 0.93 0.00 0.00 0.00 179.25 180.46 1m90 h GLU 242 N 0.39 0.23 -1.11 0.00 5.08 0.84 -3.05 114.58 116.97 1m90 h GLU 242 Ca -0.05 -0.10 0.31 0.00 -1.00 0.00 0.00 59.36 58.52 1m90 h GLU 242 Cb 1.38 -0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.52 1m90 h GLU 242 CO 0.15 0.58 0.71 0.28 -1.00 0.00 0.00 179.01 179.72 1m90 h VAL 243 N -0.12 0.42 -0.95 3.13 2.07 -1.28 -2.22 116.25 117.32 1m90 h VAL 243 Ca 0.03 -0.11 0.27 0.00 0.82 0.00 0.00 66.70 67.71 1m90 h VAL 243 Cb 0.50 0.08 -0.14 0.00 -1.52 0.00 0.00 31.29 30.22 1m90 h VAL 243 CO 0.02 0.06 0.43 0.00 0.02 0.00 0.00 177.57 178.10 1m90 h ALA 244 N 1.62 1.63 -0.40 1.67 0.00 -1.55 -0.67 119.26 121.56 1m90 h ALA 244 Ca 0.65 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.75 1m90 h ALA 244 Cb 1.78 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1m90 h ALA 244 CO -0.33 -0.47 0.00 0.39 0.00 0.00 0.00 179.25 178.84 1m90 n GLU 245 N -5.09 2.58 0.00 0.00 1.02 -0.83 -4.72 120.64 113.60 1m90 n GLU 245 Ca 0.26 -1.72 0.14 0.00 -0.02 0.00 0.00 57.16 55.83 1m90 n GLU 245 Cb 0.81 -1.61 0.60 0.00 -0.02 0.00 0.00 31.44 31.22 1m90 n GLU 245 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85