#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h33 h PRO 2 N 0.00 0.00 -0.53 1.61 0.13 -1.90 -2.78 132.00 128.54 1h33 h PRO 2 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1h33 h PRO 2 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1h33 h PRO 2 CO 0.00 0.17 0.00 -0.25 -0.23 0.00 0.00 178.00 177.69 1h33 n ASP 3 N -4.33 3.88 -4.85 1.44 8.00 -1.26 -4.80 116.55 114.62 1h33 n ASP 3 Ca -0.02 -2.26 -0.32 0.00 0.71 0.00 0.00 54.79 52.90 1h33 n ASP 3 Cb 0.24 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.86 1h33 n ASP 3 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1h33 s ASP 4 N -1.08 6.60 0.26 -2.24 1.01 -1.05 -5.04 116.67 115.13 1h33 s ASP 4 Ca 0.41 1.47 -0.29 0.00 0.71 0.00 0.00 52.55 54.84 1h33 s ASP 4 Cb 0.25 -2.47 -0.09 0.00 1.01 0.00 0.00 42.92 41.62 1h33 s ASP 4 CO 0.22 -0.55 0.97 -2.16 0.21 0.00 0.00 175.17 173.87 1h33 s PRO 5 N -4.02 4.78 -0.29 8.23 0.04 -1.26 -4.96 135.00 137.52 1h33 s PRO 5 Ca 0.57 1.53 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 1h33 s PRO 5 Cb -0.10 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1h33 s PRO 5 CO 0.31 0.43 0.18 -1.17 0.04 0.00 0.00 177.00 176.79 1h33 s LEU 6 N -1.35 4.03 -0.04 -3.56 2.96 -1.26 -5.08 118.68 114.38 1h33 s LEU 6 Ca 0.43 -0.11 0.05 0.00 -0.22 0.00 0.00 54.13 54.28 1h33 s LEU 6 Cb -0.26 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 1h33 s LEU 6 CO 0.33 -0.08 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.40 1h33 s VAL 7 N 1.73 1.57 -0.15 1.68 1.01 -1.26 -1.87 120.40 123.11 1h33 s VAL 7 Ca 0.07 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 1h33 s VAL 7 Cb -0.16 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1h33 s VAL 7 CO 0.10 0.45 -0.02 -0.63 0.00 0.00 0.00 175.10 174.99 1h33 s ILE 8 N -0.06 4.02 -1.94 2.22 1.01 0.12 -4.51 121.20 122.07 1h33 s ILE 8 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.31 1h33 s ILE 8 Cb -0.11 -2.76 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1h33 s ILE 8 CO 0.02 0.51 0.00 0.59 0.00 0.00 0.00 174.94 176.06 1h33 n ASN 9 N 3.33 -5.39 -0.12 3.58 3.02 0.53 -1.00 115.26 119.22 1h33 n ASN 9 Ca -0.17 0.45 -0.02 0.00 -0.03 0.00 0.00 54.58 54.81 1h33 n ASN 9 Cb 0.53 -4.60 -0.01 0.00 -0.61 0.00 0.00 39.78 35.09 1h33 n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h33 n GLY 10 N -0.24 0.41 0.00 7.41 0.00 -1.26 -4.81 105.19 106.69 1h33 n GLY 10 Ca -0.18 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1h33 n GLY 10 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h33 n GLU 11 N -1.43 1.20 -3.94 1.61 1.02 -0.17 -5.05 120.64 113.89 1h33 n GLU 11 Ca -0.02 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.78 1h33 n GLU 11 Cb 0.24 -0.67 -0.14 0.00 -0.02 0.00 0.00 31.44 30.85 1h33 n GLU 11 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1h33 s ILE 12 N -1.34 3.00 -0.05 -3.67 1.01 -0.45 -4.94 121.20 114.76 1h33 s ILE 12 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 1h33 s ILE 12 Cb 0.00 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.93 1h33 s ILE 12 CO 0.00 0.21 1.10 -1.61 0.00 0.00 0.00 174.94 174.64 1h33 s GLU 13 N 1.35 4.41 -0.19 2.79 8.01 -1.26 -0.70 118.70 133.11 1h33 s GLU 13 Ca 0.01 1.55 -0.03 0.00 0.01 0.00 0.00 54.97 56.51 1h33 s GLU 13 Cb -0.16 -3.51 -0.01 0.00 -4.31 0.00 0.00 34.13 26.13 1h33 s GLU 13 CO -0.04 -0.33 -0.07 0.42 0.01 0.00 0.00 175.26 175.26 1h33 s ILE 14 N 1.85 3.26 -0.39 -1.63 -1.09 -0.78 -4.40 121.20 118.01 1h33 s ILE 14 Ca 0.53 -0.55 -0.29 0.00 -2.23 0.00 0.00 60.65 58.12 1h33 s ILE 14 Cb -0.22 -2.45 0.01 0.00 -1.58 0.00 0.00 42.46 38.21 1h33 s ILE 14 CO 0.22 0.46 1.37 -0.69 -1.23 0.00 0.00 174.94 175.07 1h33 s VAL 15 N 1.16 3.97 -1.10 2.92 1.01 -1.26 -4.42 120.40 122.68 1h33 s VAL 15 Ca 0.02 1.02 0.16 0.00 0.00 0.00 0.00 61.98 63.18 1h33 s VAL 15 Cb -0.14 -4.21 -0.09 0.00 0.00 0.00 0.00 36.38 31.93 1h33 s VAL 15 CO -0.02 -0.70 0.76 0.35 0.00 0.00 0.00 175.10 175.50 1h33 n THR 16 N 6.84 0.00 -3.80 3.92 -2.24 -1.26 -2.16 114.28 115.58 1h33 n THR 16 Ca 0.16 -0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.58 1h33 n THR 16 Cb 0.48 1.09 -0.15 0.00 -2.10 0.00 0.00 70.33 69.65 1h33 n THR 16 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1h33 s ARG 17 N -2.24 0.01 0.09 -0.78 0.52 -1.26 -0.40 118.95 114.88 1h33 s ARG 17 Ca 0.10 0.15 -0.10 0.00 -0.52 0.00 0.00 55.73 55.36 1h33 s ARG 17 Cb 0.13 -0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.47 1h33 s ARG 17 CO 0.54 -0.10 0.22 0.00 0.02 0.00 0.00 175.30 175.98 1h33 s ALA 18 N 0.67 -0.35 0.55 2.13 0.00 -0.24 -4.99 121.76 119.53 1h33 s ALA 18 Ca -0.05 -0.49 -0.21 0.00 0.00 0.00 0.00 51.96 51.21 1h33 s ALA 18 Cb -0.08 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.48 1h33 s ALA 18 CO -0.02 -0.51 1.29 -2.14 0.00 0.00 0.00 175.76 174.38 1h33 s PRO 19 N -3.67 3.16 0.20 0.00 0.02 -1.26 -0.79 135.00 132.66 1h33 s PRO 19 Ca 0.03 2.06 -0.30 0.00 0.02 0.00 0.00 61.00 62.81 1h33 s PRO 19 Cb 0.04 -2.19 -0.09 0.00 0.02 0.00 0.00 34.50 32.28 1h33 s PRO 19 CO -0.10 -1.12 1.33 0.99 -0.33 0.00 0.00 177.00 177.77 1h33 s THR 20 N -1.40 3.15 0.41 0.99 2.01 -1.26 -4.54 115.64 114.99 1h33 s THR 20 Ca 0.72 0.94 -0.24 0.00 0.31 0.00 0.00 61.69 63.42 1h33 s THR 20 Cb -0.36 -3.60 -0.11 0.00 0.01 0.00 0.00 72.50 68.44 1h33 s THR 20 CO 0.42 0.14 1.00 -2.65 -0.69 0.00 0.00 174.62 172.84 1h33 n PRO 21 N 2.65 1.34 -0.36 4.92 -0.02 -1.26 -4.69 135.00 137.58 1h33 n PRO 21 Ca 0.06 0.48 0.10 0.00 -2.02 0.00 0.00 63.50 62.12 1h33 n PRO 21 Cb 0.42 -2.02 0.27 0.00 -0.02 0.00 0.00 33.50 32.16 1h33 n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h33 h ALA 22 N 1.56 1.57 0.00 3.55 0.00 -1.96 0.16 119.26 124.14 1h33 h ALA 22 Ca -0.44 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1h33 h ALA 22 Cb 1.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1h33 h ALA 22 CO 0.57 0.09 0.00 1.12 0.00 0.00 0.00 179.25 181.03 1h33 h HIS 23 N 0.88 0.00 -0.08 0.00 2.07 -1.97 -2.93 115.15 113.12 1h33 h HIS 23 Ca 0.53 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.05 1h33 h HIS 23 Cb 0.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 1h33 h HIS 23 CO -0.01 0.00 0.00 -0.11 -3.07 0.00 0.00 177.93 174.74 1h33 n LEU 24 N -2.42 1.90 0.25 6.12 7.94 -0.01 -4.77 117.00 126.00 1h33 n LEU 24 Ca 0.01 -1.37 0.11 0.00 -1.11 0.00 0.00 56.01 53.65 1h33 n LEU 24 Cb 0.18 -0.05 0.72 0.00 0.53 0.00 0.00 43.42 44.80 1h33 n LEU 24 CO 0.18 0.43 1.10 0.00 -1.11 0.00 0.00 177.39 177.99 1h33 h ALA 25 N 1.22 1.91 0.00 1.96 0.00 -1.22 0.03 119.26 123.16 1h33 h ALA 25 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1h33 h ALA 25 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1h33 h ALA 25 CO 0.00 -0.06 0.00 -0.44 0.00 0.00 0.00 179.25 178.75 1h33 h ASP 26 N 0.00 0.00 0.00 0.00 3.32 -1.86 -3.33 116.42 114.55 1h33 h ASP 26 Ca 0.02 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.92 1h33 h ASP 26 Cb 0.10 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1h33 h ASP 26 CO -0.00 0.00 -1.73 0.54 -1.72 0.00 0.00 179.24 176.33 1h33 n ARG 27 N -2.63 1.61 -4.09 3.56 5.12 -0.00 -5.00 116.66 115.23 1h33 n ARG 27 Ca -0.01 -0.04 -0.14 0.00 -1.93 0.00 0.00 57.85 55.73 1h33 n ARG 27 Cb 0.12 -1.30 -0.13 0.00 -1.16 0.00 0.00 32.46 30.00 1h33 n ARG 27 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1h33 s PHE 28 N -2.45 0.48 0.05 -1.55 0.08 -1.23 -5.03 117.98 108.33 1h33 s PHE 28 Ca -0.05 -0.25 0.16 0.00 0.12 0.00 0.00 56.93 56.91 1h33 s PHE 28 Cb 0.05 -0.30 0.36 0.00 -0.57 0.00 0.00 43.02 42.56 1h33 s PHE 28 CO 0.48 -0.04 1.58 -0.44 -0.10 0.00 0.00 175.22 176.70 1h33 h ASP 29 N 5.43 0.00 -4.99 1.36 3.32 -1.94 -3.44 116.42 116.16 1h33 h ASP 29 Ca -0.30 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.77 1h33 h ASP 29 Cb 1.20 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.65 1h33 h ASP 29 CO 0.46 0.49 0.25 -1.83 -1.72 0.00 0.00 179.24 176.89 1h33 s GLU 30 N -3.28 1.41 0.11 3.56 -1.05 -1.26 -4.46 118.70 113.72 1h33 s GLU 30 Ca 0.02 -0.63 0.03 0.00 -0.15 0.00 0.00 54.97 54.23 1h33 s GLU 30 Cb 0.10 0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 34.32 1h33 s GLU 30 CO 0.72 -0.63 0.12 0.96 0.95 0.00 0.00 175.26 177.38 1h33 s ILE 31 N -3.74 4.65 -0.00 1.83 -4.36 0.03 -4.84 121.20 114.77 1h33 s ILE 31 Ca 0.05 -0.81 0.00 0.00 -0.26 0.00 0.00 60.65 59.63 1h33 s ILE 31 Cb -0.03 -3.29 -0.00 0.00 1.25 0.00 0.00 42.46 40.39 1h33 s ILE 31 CO -0.06 0.05 -0.01 -0.13 0.24 0.00 0.00 174.94 175.03 1h33 s ARG 32 N -2.65 0.07 0.64 0.37 0.52 -1.26 -1.08 118.95 115.56 1h33 s ARG 32 Ca 0.31 -0.05 -0.18 0.00 -0.52 0.00 0.00 55.73 55.29 1h33 s ARG 32 Cb -0.12 -0.06 -0.01 0.00 0.52 0.00 0.00 34.95 35.28 1h33 s ARG 32 CO 0.23 0.02 1.25 0.45 0.02 0.00 0.00 175.30 177.27 1h33 s SER 33 N -0.06 4.75 0.61 0.23 0.15 0.46 -4.71 113.70 115.13 1h33 s SER 33 Ca -0.00 2.51 0.31 0.00 0.70 0.00 0.00 55.95 59.47 1h33 s SER 33 Cb -0.01 -2.61 1.77 0.00 -1.71 0.00 0.00 66.02 63.47 1h33 s SER 33 CO -0.00 -1.90 2.14 1.23 1.20 0.00 0.00 173.24 175.91 1h33 h GLY 34 N 0.56 0.00 1.87 9.45 0.00 -1.92 -1.18 103.07 111.86 1h33 h GLY 34 Ca -0.50 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 1h33 h GLY 34 CO 0.53 0.00 0.07 -0.25 0.00 0.00 0.00 176.54 176.90 1h33 h TRP 35 N 0.00 0.16 0.00 5.60 7.01 -1.91 -2.02 115.95 124.80 1h33 h TRP 35 Ca 0.06 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.06 1h33 h TRP 35 Cb 0.38 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.39 1h33 h TRP 35 CO 0.00 0.11 0.00 0.25 -2.79 0.00 0.00 178.44 176.01 1h33 n THR 36 N -4.51 0.31 0.42 2.65 -2.24 -0.45 -2.36 114.28 108.11 1h33 n THR 36 Ca -0.01 0.08 0.09 0.00 -2.27 0.00 0.00 64.05 61.93 1h33 n THR 36 Cb 0.09 -0.71 0.12 0.00 -2.10 0.00 0.00 70.33 67.73 1h33 n THR 36 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1h33 n PHE 37 N -1.30 0.22 -3.49 4.78 3.01 -0.76 -3.92 117.46 116.01 1h33 n PHE 37 Ca 0.10 -0.15 -0.26 0.00 1.01 0.00 0.00 57.45 58.14 1h33 n PHE 37 Cb 0.18 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.62 1h33 n PHE 37 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1h33 s ARG 38 N -1.31 3.54 0.91 -1.08 1.81 -0.99 -4.83 118.95 116.99 1h33 s ARG 38 Ca 0.25 -0.25 -0.11 0.00 -1.72 0.00 0.00 55.73 53.90 1h33 s ARG 38 Cb 0.16 -2.72 0.14 0.00 -0.45 0.00 0.00 34.95 32.08 1h33 s ARG 38 CO 0.23 0.26 1.09 0.95 -0.68 0.00 0.00 175.30 177.15 1h33 s THR 39 N -2.09 2.59 0.29 0.02 -4.23 -1.26 -4.72 115.64 106.25 1h33 s THR 39 Ca 0.40 0.19 -0.01 0.00 -1.18 0.00 0.00 61.69 61.10 1h33 s THR 39 Cb -0.10 -2.54 0.27 0.00 1.34 0.00 0.00 72.50 71.47 1h33 s THR 39 CO 0.32 -0.25 1.93 0.44 -0.54 0.00 0.00 174.62 176.52 1h33 h ASP 40 N -1.67 0.95 -0.51 3.99 5.19 -1.97 0.67 116.42 123.08 1h33 h ASP 40 Ca -0.49 -0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 55.79 1h33 h ASP 40 Cb 1.28 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.56 1h33 h ASP 40 CO 0.51 0.65 -0.18 -2.24 -3.12 0.00 0.00 179.24 174.86 1h33 h ASP 41 N 1.10 1.03 -0.08 6.45 2.03 -2.00 -1.28 116.42 123.67 1h33 h ASP 41 Ca 0.36 -0.38 -0.23 0.00 -0.73 0.00 0.00 57.03 56.05 1h33 h ASP 41 Cb 0.04 -0.28 0.01 0.00 -0.83 0.00 0.00 39.33 38.27 1h33 h ASP 41 CO -0.11 1.18 -0.83 0.74 -1.03 0.00 0.00 179.24 179.19 1h33 h THR 42 N 0.88 1.29 -0.82 1.15 2.02 -1.81 -2.98 112.91 112.63 1h33 h THR 42 Ca 0.12 -2.05 0.10 0.00 0.77 0.00 0.00 66.41 65.36 1h33 h THR 42 Cb 0.75 2.07 -0.06 0.00 -1.74 0.00 0.00 68.15 69.18 1h33 h THR 42 CO 0.06 0.64 0.53 1.56 0.37 0.00 0.00 175.52 178.69 1h33 h GLN 43 N 0.49 0.72 0.00 6.66 4.20 -0.52 -1.94 115.11 124.72 1h33 h GLN 43 Ca -0.07 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 1h33 h GLN 43 Cb 1.46 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 29.07 1h33 h GLN 43 CO 0.17 0.47 -0.22 0.00 -0.67 0.00 0.00 178.83 178.58 1h33 h ALA 44 N 1.59 1.29 0.00 3.87 0.00 -1.08 -2.78 119.26 122.16 1h33 h ALA 44 Ca 0.38 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1h33 h ALA 44 Cb 0.49 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1h33 h ALA 44 CO -0.15 0.27 -0.21 -0.07 0.00 0.00 0.00 179.25 179.09 1h33 h LEU 45 N 0.00 0.00 0.00 0.00 3.38 -1.38 -2.14 115.31 115.17 1h33 h LEU 45 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h33 h LEU 45 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1h33 h LEU 45 CO 0.03 0.21 -0.33 1.21 0.09 0.00 0.00 178.44 179.65 1h33 n GLU 46 N -3.64 0.11 0.13 1.13 2.13 -1.05 -3.22 120.64 116.23 1h33 n GLU 46 Ca -0.01 0.05 0.13 0.00 0.66 0.00 0.00 57.16 57.99 1h33 n GLU 46 Cb 0.34 -1.59 0.45 0.00 0.27 0.00 0.00 31.44 30.91 1h33 n GLU 46 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 1h33 h MET 47 N 0.00 0.00 -3.10 5.31 2.86 -1.47 -3.44 114.93 115.08 1h33 h MET 47 Ca 0.00 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 1h33 h MET 47 Cb 0.60 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 31.94 1h33 h MET 47 CO 0.00 0.00 -0.55 0.34 1.06 0.00 0.00 176.91 177.76 1h33 s ASP 48 N -4.50 -0.03 0.56 1.22 3.68 -1.26 -0.35 116.67 116.00 1h33 s ASP 48 Ca 0.07 0.42 0.27 0.00 2.13 0.00 0.00 52.55 55.44 1h33 s ASP 48 Cb 0.11 0.34 1.62 0.00 -1.45 0.00 0.00 42.92 43.53 1h33 s ASP 48 CO 0.50 -0.18 2.18 0.44 0.13 0.00 0.00 175.17 178.24 1h33 h ASP 49 N 7.46 0.00 0.53 -0.34 3.32 -1.87 0.95 116.42 126.47 1h33 h ASP 49 Ca -0.36 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 1h33 h ASP 49 Cb 1.14 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1h33 h ASP 49 CO 0.34 0.05 -0.10 -0.26 -1.72 0.00 0.00 179.24 177.55 1h33 h PHE 50 N 0.00 0.00 -0.01 4.55 0.05 -1.95 -2.93 116.94 116.65 1h33 h PHE 50 Ca -0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1h33 h PHE 50 Cb 0.12 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.07 1h33 h PHE 50 CO 0.00 0.10 -0.50 0.39 -0.18 0.00 0.00 178.31 178.12 1h33 n GLU 51 N -3.44 1.40 -3.21 1.51 1.02 0.30 -4.87 120.64 113.35 1h33 n GLU 51 Ca -0.01 -0.68 -0.45 0.00 -0.02 0.00 0.00 57.16 56.00 1h33 n GLU 51 Cb 0.26 -1.36 -0.05 0.00 -0.02 0.00 0.00 31.44 30.27 1h33 n GLU 51 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1h33 s ASN 52 N -2.27 6.19 0.64 1.62 3.04 -1.03 -4.85 114.94 118.27 1h33 s ASN 52 Ca 0.13 -1.43 0.42 0.00 0.04 0.00 0.00 52.86 52.03 1h33 s ASN 52 Cb 0.15 -2.26 2.24 0.00 -1.54 0.00 0.00 41.25 39.84 1h33 s ASN 52 CO 0.54 -0.95 2.31 0.28 -3.04 0.00 0.00 177.10 176.24 1h33 h SER 53 N 9.02 0.00 -0.40 -4.21 0.02 -1.89 -0.79 113.55 115.31 1h33 h SER 53 Ca -0.29 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 60.73 1h33 h SER 53 Cb 1.09 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1h33 h SER 53 CO 1.03 0.00 0.27 1.23 -1.14 0.00 0.00 176.83 178.23 1h33 h GLY 54 N 0.29 0.26 2.00 -3.77 0.00 -1.91 -2.27 103.07 97.67 1h33 h GLY 54 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1h33 h GLY 54 CO 0.00 0.06 0.00 1.03 0.00 0.00 0.00 176.54 177.63 1h33 n MET 55 N -4.47 0.16 -0.20 4.80 2.81 -0.30 -2.59 117.12 117.33 1h33 n MET 55 Ca 0.06 0.21 -0.09 0.00 -1.81 0.00 0.00 57.70 56.07 1h33 n MET 55 Cb 0.32 -1.72 0.02 0.00 -0.71 0.00 0.00 33.22 31.14 1h33 n MET 55 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1h33 h VAL 56 N 0.00 1.26 -0.50 2.03 2.07 -1.55 -0.62 116.25 118.94 1h33 h VAL 56 Ca 0.00 -1.02 -0.10 0.00 0.82 0.00 0.00 66.70 66.40 1h33 h VAL 56 Cb 0.55 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1h33 h VAL 56 CO 0.00 0.37 -0.10 -0.26 0.02 0.00 0.00 177.57 177.60 1h33 h PHE 57 N 0.87 1.01 -0.75 1.57 -1.00 -1.64 -1.72 116.94 115.29 1h33 h PHE 57 Ca 0.17 -0.20 0.02 0.00 2.81 0.00 0.00 57.97 60.78 1h33 h PHE 57 Cb 0.45 -0.26 -0.04 0.00 3.61 0.00 0.00 35.95 39.71 1h33 h PHE 57 CO 0.03 0.96 0.49 0.28 -1.61 0.00 0.00 178.31 178.46 1h33 h VAL 58 N 0.82 1.14 -0.58 -0.55 2.07 -1.34 -0.16 116.25 117.66 1h33 h VAL 58 Ca 0.13 -0.33 -0.11 0.00 0.82 0.00 0.00 66.70 67.22 1h33 h VAL 58 Cb 0.63 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1h33 h VAL 58 CO 0.04 0.18 -0.07 -0.08 0.02 0.00 0.00 177.57 177.66 1h33 h GLU 59 N 0.96 1.06 -0.65 1.57 4.57 -0.79 -0.68 114.58 120.61 1h33 h GLU 59 Ca 0.29 -0.37 0.09 0.00 -1.18 0.00 0.00 59.36 58.19 1h33 h GLU 59 Cb -0.03 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.41 1h33 h GLU 59 CO -0.09 1.07 0.30 0.93 -1.18 0.00 0.00 179.01 180.04 1h33 h GLU 60 N 0.95 0.50 0.00 1.92 5.08 -0.96 -2.31 114.58 119.77 1h33 h GLU 60 Ca 0.15 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1h33 h GLU 60 Cb 0.64 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1h33 h GLU 60 CO 0.04 0.33 -0.25 0.00 -1.00 0.00 0.00 179.01 178.14 1h33 h ALA 61 N 1.41 1.22 -0.73 3.43 0.00 -0.30 -2.20 119.26 122.09 1h33 h ALA 61 Ca 0.32 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1h33 h ALA 61 Cb 0.35 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1h33 h ALA 61 CO -0.27 0.31 0.32 -0.09 0.00 0.00 0.00 179.25 179.52 1h33 h ARG 62 N 0.00 1.06 -0.42 0.00 2.43 -0.58 0.18 114.38 117.06 1h33 h ARG 62 Ca -0.00 -0.16 -0.15 0.00 -0.81 0.00 0.00 59.98 58.86 1h33 h ARG 62 Cb 0.59 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1h33 h ARG 62 CO 0.03 0.84 -0.31 0.00 -1.51 0.00 0.00 179.97 179.03 1h33 h ALA 63 N 1.30 0.60 -0.71 2.80 0.00 -1.26 -3.05 119.26 118.94 1h33 h ALA 63 Ca 0.25 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1h33 h ALA 63 Cb 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1h33 h ALA 63 CO -0.03 0.65 0.47 0.28 0.00 0.00 0.00 179.25 180.63 1h33 h VAL 64 N 0.78 1.10 -0.53 0.00 2.07 -0.87 -2.43 116.25 116.37 1h33 h VAL 64 Ca 0.08 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1h33 h VAL 64 Cb 0.90 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1h33 h VAL 64 CO 0.08 0.16 0.35 -0.25 0.02 0.00 0.00 177.57 177.93 1h33 h TRP 65 N 0.86 0.58 -0.05 1.57 2.91 -0.54 -1.04 115.95 120.24 1h33 h TRP 65 Ca 0.29 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.32 1h33 h TRP 65 Cb 0.07 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 28.52 1h33 h TRP 65 CO -0.00 0.34 0.00 -0.25 -1.03 0.00 0.00 178.44 177.50 1h33 n ASP 66 N -4.47 2.22 -4.61 2.65 8.00 -0.94 -1.87 116.55 117.53 1h33 n ASP 66 Ca 0.06 -1.74 -0.39 0.00 0.71 0.00 0.00 54.79 53.43 1h33 n ASP 66 Cb 0.15 -0.02 -0.09 0.00 -0.02 0.00 0.00 41.12 41.14 1h33 n ASP 66 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1h33 s ARG 67 N -1.96 4.03 0.32 -1.24 3.52 -0.40 -4.84 118.95 118.39 1h33 s ARG 67 Ca 0.34 0.12 -0.29 0.00 -0.13 0.00 0.00 55.73 55.77 1h33 s ARG 67 Cb 0.20 -3.65 -0.11 0.00 -1.56 0.00 0.00 34.95 29.84 1h33 s ARG 67 CO 0.32 -0.29 1.43 -2.14 -0.81 0.00 0.00 175.30 173.81 1h33 s PRO 68 N 2.11 4.23 -0.14 5.12 0.02 -1.26 -4.36 135.00 140.71 1h33 s PRO 68 Ca 0.17 2.40 -0.10 0.00 0.02 0.00 0.00 61.00 63.48 1h33 s PRO 68 Cb -0.16 -3.04 0.04 0.00 0.02 0.00 0.00 34.50 31.37 1h33 s PRO 68 CO 0.10 -0.41 0.36 -1.21 -0.33 0.00 0.00 177.00 175.51 1h33 s GLU 69 N -1.40 0.38 0.00 5.54 2.02 -0.80 -4.91 118.70 119.54 1h33 s GLU 69 Ca 0.54 0.60 0.00 0.00 0.02 0.00 0.00 54.97 56.13 1h33 s GLU 69 Cb -0.43 0.08 0.00 0.00 0.10 0.00 0.00 34.13 33.88 1h33 s GLU 69 CO 0.53 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 176.12 1h33 n GLY 70 N 3.52 1.79 0.25 -1.39 0.00 -1.26 -4.34 105.19 103.75 1h33 n GLY 70 Ca -0.18 -2.06 0.13 0.00 0.00 0.00 0.00 46.02 43.90 1h33 n GLY 70 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1h33 h THR 71 N 0.00 0.43 -0.00 2.61 1.35 -0.86 -2.58 112.91 113.85 1h33 h THR 71 Ca 0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1h33 h THR 71 Cb 0.00 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1h33 h THR 71 CO 0.00 0.14 -0.03 -0.62 -0.25 0.00 0.00 175.52 174.76 1h33 n GLU 72 N -3.38 0.44 -2.19 4.72 -0.58 -0.90 -4.91 120.64 113.84 1h33 n GLU 72 Ca -0.00 -0.04 -0.20 0.00 -0.42 0.00 0.00 57.16 56.49 1h33 n GLU 72 Cb 0.34 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.68 1h33 n GLU 72 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h33 n GLY 73 N 1.30 0.13 3.74 0.62 0.00 -0.97 -5.01 105.19 105.00 1h33 n GLY 73 Ca 0.14 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 1h33 n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h33 s LYS 74 N -4.69 2.71 0.28 1.61 1.02 -1.26 -4.76 119.74 114.64 1h33 s LYS 74 Ca 0.00 -0.86 0.08 0.00 0.02 0.00 0.00 55.97 55.21 1h33 s LYS 74 Cb 0.00 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 1h33 s LYS 74 CO 0.00 0.51 0.10 0.00 -0.92 0.00 0.00 175.35 175.04 1h33 s ALA 75 N -1.55 3.39 0.27 5.17 0.00 -1.26 -1.90 121.76 125.88 1h33 s ALA 75 Ca 0.29 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1h33 s ALA 75 Cb -0.11 -0.94 0.59 0.00 0.00 0.00 0.00 23.12 22.66 1h33 s ALA 75 CO 0.21 0.20 1.74 0.00 0.00 0.00 0.00 175.76 177.91 1h33 h ALA 77 N 1.61 1.35 0.00 0.00 0.00 -1.58 -1.05 119.26 119.59 1h33 h ALA 77 Ca 0.49 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.32 1h33 h ALA 77 Cb 0.79 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1h33 h ALA 77 CO -0.42 0.01 -0.36 -0.44 0.00 0.00 0.00 179.25 178.04 1h33 h ASP 78 N 0.00 0.00 0.00 0.00 3.32 -1.48 -0.86 116.42 117.40 1h33 h ASP 78 Ca -0.00 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 1h33 h ASP 78 Cb 0.03 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.52 1h33 h ASP 78 CO 0.00 0.36 -2.23 0.00 -1.72 0.00 0.00 179.24 175.65 1h33 n HIS 80 N -2.84 0.00 -4.59 0.00 8.25 -0.47 -5.09 115.22 110.48 1h33 n HIS 80 Ca -0.33 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 1h33 n HIS 80 Cb 1.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.13 1h33 n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h33 n GLY 81 N 1.16 0.11 3.74 -1.41 0.00 -0.33 -3.81 105.19 104.64 1h33 n GLY 81 Ca 0.08 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1h33 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h33 s ALA 82 N -1.59 3.50 0.47 4.61 0.00 -1.26 -4.40 121.76 123.10 1h33 s ALA 82 Ca 0.00 1.07 0.14 0.00 0.00 0.00 0.00 51.96 53.17 1h33 s ALA 82 Cb 0.00 -3.47 1.12 0.00 0.00 0.00 0.00 23.12 20.78 1h33 s ALA 82 CO 0.00 -0.50 2.08 -0.24 0.00 0.00 0.00 175.76 177.10 1h33 h VAL 83 N 3.74 0.98 0.00 0.00 3.04 -1.97 0.12 116.25 122.17 1h33 h VAL 83 Ca -0.45 -0.08 -0.03 0.00 -1.01 0.00 0.00 66.70 65.13 1h33 h VAL 83 Cb 1.21 0.73 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 1h33 h VAL 83 CO 0.76 0.04 -0.16 0.44 -1.01 0.00 0.00 177.57 177.64 1h33 h ASP 84 N 0.23 0.00 0.00 3.17 3.32 -1.95 -1.25 116.42 119.94 1h33 h ASP 84 Ca 0.12 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.83 1h33 h ASP 84 Cb 0.19 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 1h33 h ASP 84 CO -0.02 0.16 -1.84 0.47 -1.72 0.00 0.00 179.24 176.29 1h33 n ASP 85 N -3.94 1.91 0.24 6.45 8.00 -0.46 -4.12 116.55 124.64 1h33 n ASP 85 Ca -0.02 0.37 0.11 0.00 0.71 0.00 0.00 54.79 55.96 1h33 n ASP 85 Cb 0.25 -0.89 0.60 0.00 -0.02 0.00 0.00 41.12 41.07 1h33 n ASP 85 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1h33 h GLY 86 N -0.85 0.00 -0.99 0.44 0.00 -0.75 -2.78 103.07 98.14 1h33 h GLY 86 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1h33 h GLY 86 CO -0.29 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.28 1h33 n MET 87 N -3.52 1.99 -1.69 4.80 2.81 -0.48 -4.99 117.12 116.04 1h33 n MET 87 Ca -0.01 -1.66 -0.44 0.00 -1.81 0.00 0.00 57.70 53.78 1h33 n MET 87 Cb 0.33 -1.22 -0.04 0.00 -0.71 0.00 0.00 33.22 31.59 1h33 n MET 87 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1h33 n TYR 88 N 0.44 2.48 0.00 2.03 9.36 -1.05 -2.04 117.16 128.38 1h33 n TYR 88 Ca 0.08 0.08 0.00 0.00 3.32 0.00 0.00 57.90 61.38 1h33 n TYR 88 Cb 0.34 -2.64 0.00 0.00 -0.63 0.00 0.00 39.34 36.42 1h33 n TYR 88 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1h33 n GLY 89 N 3.87 2.82 0.19 2.98 0.00 -1.26 -4.92 105.19 108.87 1h33 n GLY 89 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1h33 n GLY 89 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1h33 h LEU 90 N 0.00 0.54 -1.66 0.99 5.85 -1.76 -2.89 115.31 116.38 1h33 h LEU 90 Ca 0.00 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.51 1h33 h LEU 90 Cb 0.00 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1h33 h LEU 90 CO 0.00 0.61 0.24 -0.09 -0.34 0.00 0.00 178.44 178.86 1h33 h ARG 91 N 0.44 0.46 0.00 1.25 9.65 -1.82 -1.58 114.38 122.77 1h33 h ARG 91 Ca 0.12 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.97 1h33 h ARG 91 Cb 0.27 -0.10 -0.00 0.00 -1.39 0.00 0.00 29.97 28.75 1h33 h ARG 91 CO -0.00 0.30 -0.00 0.00 2.80 0.00 0.00 179.97 183.07 1h33 h ALA 92 N 1.78 1.00 -0.00 2.80 0.00 -1.83 -3.25 119.26 119.76 1h33 h ALA 92 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1h33 h ALA 92 Cb -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1h33 h ALA 92 CO -0.03 0.00 -0.00 1.33 0.00 0.00 0.00 179.25 180.55 1h33 n VAL 93 N -3.09 0.00 -3.66 0.00 0.24 -0.61 -0.83 118.33 110.38 1h33 n VAL 93 Ca -0.02 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.49 1h33 n VAL 93 Cb 0.15 1.01 -0.04 0.00 -1.47 0.00 0.00 33.84 33.50 1h33 n VAL 93 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1h33 s TYR 94 N -0.22 3.48 0.53 6.34 1.51 -1.13 -4.08 117.35 123.78 1h33 s TYR 94 Ca 0.01 0.45 -0.20 0.00 -1.01 0.00 0.00 57.07 56.31 1h33 s TYR 94 Cb 0.01 -1.93 -0.06 0.00 -0.11 0.00 0.00 41.96 39.87 1h33 s TYR 94 CO 0.01 0.39 1.16 -2.14 -1.11 0.00 0.00 175.55 173.86 1h33 s PRO 95 N -3.07 3.38 0.13 -1.71 0.02 -1.26 -4.93 135.00 127.56 1h33 s PRO 95 Ca 0.40 1.72 -0.16 0.00 0.02 0.00 0.00 61.00 62.97 1h33 s PRO 95 Cb -0.11 -2.10 0.03 0.00 0.02 0.00 0.00 34.50 32.34 1h33 s PRO 95 CO 0.27 -0.85 0.40 -1.59 -0.33 0.00 0.00 177.00 174.91 1h33 s LYS 96 N -3.13 1.08 0.16 5.54 -2.85 -0.99 -4.74 119.74 114.82 1h33 s LYS 96 Ca 0.71 -0.72 -0.31 0.00 -1.00 0.00 0.00 55.97 54.65 1h33 s LYS 96 Cb -0.27 0.47 -0.09 0.00 -2.06 0.00 0.00 37.83 35.88 1h33 s LYS 96 CO 0.31 -0.43 1.50 -0.47 0.10 0.00 0.00 175.35 176.36 1h33 s TYR 97 N -3.81 3.12 -0.24 1.78 5.04 -1.26 -1.38 117.35 120.60 1h33 s TYR 97 Ca 0.03 0.76 -0.03 0.00 -2.44 0.00 0.00 57.07 55.40 1h33 s TYR 97 Cb 0.02 -3.84 0.01 0.00 0.35 0.00 0.00 41.96 38.50 1h33 s TYR 97 CO -0.11 -3.02 -0.06 0.08 -1.34 0.00 0.00 175.55 171.10 1h33 s VAL 98 N 1.04 3.05 0.20 3.14 1.01 0.16 -4.92 120.40 124.07 1h33 s VAL 98 Ca 0.67 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 61.61 1h33 s VAL 98 Cb -0.41 -2.48 0.13 0.00 0.00 0.00 0.00 36.38 33.62 1h33 s VAL 98 CO 0.32 0.29 1.50 1.21 0.00 0.00 0.00 175.10 178.41 1h33 n GLU 99 N 4.72 -0.30 0.23 2.72 4.07 -1.26 -1.15 120.64 129.67 1h33 n GLU 99 Ca -0.17 1.48 0.16 0.00 -0.06 0.00 0.00 57.16 58.57 1h33 n GLU 99 Cb 0.48 -2.19 0.66 0.00 -0.06 0.00 0.00 31.44 30.33 1h33 n GLU 99 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1h33 h SER 100 N 0.00 0.00 0.00 4.31 4.64 -1.95 -2.83 113.55 117.72 1h33 h SER 100 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1h33 h SER 100 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1h33 h SER 100 CO -0.94 0.00 -1.29 0.00 -0.87 0.00 0.00 176.83 173.73 1h33 n ALA 101 N -1.97 3.47 -2.23 5.18 0.00 -0.30 -4.99 120.51 119.67 1h33 n ALA 101 Ca 0.01 -0.45 -0.18 0.00 0.00 0.00 0.00 53.44 52.82 1h33 n ALA 101 Cb 0.25 -0.61 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 1h33 n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h33 n GLY 102 N 1.45 -0.04 3.35 0.00 0.00 -0.51 -4.95 105.19 104.48 1h33 n GLY 102 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1h33 n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h33 s LYS 103 N -4.73 1.12 0.16 1.61 1.02 -1.25 -4.99 119.74 112.68 1h33 s LYS 103 Ca 0.00 -0.79 -0.31 0.00 0.02 0.00 0.00 55.97 54.89 1h33 s LYS 103 Cb 0.00 0.46 -0.08 0.00 -0.52 0.00 0.00 37.83 37.69 1h33 s LYS 103 CO 0.00 -0.44 1.34 0.08 -0.92 0.00 0.00 175.35 175.42 1h33 s VAL 104 N -3.83 3.24 0.17 3.17 1.01 -1.26 -0.66 120.40 122.23 1h33 s VAL 104 Ca 0.05 0.96 0.08 0.00 0.00 0.00 0.00 61.98 63.08 1h33 s VAL 104 Cb 0.02 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1h33 s VAL 104 CO -0.09 0.12 -0.16 -0.13 0.00 0.00 0.00 175.10 174.83 1h33 s ARG 105 N 0.38 1.24 0.34 2.72 1.81 -0.48 -4.92 118.95 120.04 1h33 s ARG 105 Ca 0.60 -1.43 0.07 0.00 -1.72 0.00 0.00 55.73 53.25 1h33 s ARG 105 Cb -0.37 -1.18 -0.01 0.00 -0.45 0.00 0.00 34.95 32.94 1h33 s ARG 105 CO 0.35 0.22 0.42 0.95 -0.68 0.00 0.00 175.30 176.56 1h33 s THR 106 N -2.35 3.81 0.23 0.02 -4.23 -1.26 -2.34 115.64 109.51 1h33 s THR 106 Ca 0.16 -1.12 -0.07 0.00 -1.18 0.00 0.00 61.69 59.49 1h33 s THR 106 Cb -0.04 -3.31 0.19 0.00 1.34 0.00 0.00 72.50 70.68 1h33 s THR 106 CO 0.06 -0.15 1.83 0.58 -0.54 0.00 0.00 174.62 176.40 1h33 h VAL 107 N 0.99 0.99 -0.89 2.29 2.07 -1.99 -2.40 116.25 117.32 1h33 h VAL 107 Ca -0.45 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 66.79 1h33 h VAL 107 Cb 1.26 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1h33 h VAL 107 CO 0.54 0.15 0.58 -0.33 0.02 0.00 0.00 177.57 178.53 1h33 h GLU 108 N 0.84 1.18 -0.81 1.57 3.07 -1.96 -1.44 114.58 117.03 1h33 h GLU 108 Ca 0.35 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 59.11 1h33 h GLU 108 Cb 0.21 -0.26 -0.04 0.00 -0.84 0.00 0.00 28.75 27.82 1h33 h GLU 108 CO -0.19 0.79 0.42 1.96 -1.40 0.00 0.00 179.01 180.59 1h33 h GLN 109 N 1.21 1.14 -0.28 2.33 4.20 -1.85 -1.66 115.11 120.19 1h33 h GLN 109 Ca 0.32 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1h33 h GLN 109 Cb -0.12 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.43 1h33 h GLN 109 CO -0.07 0.85 0.08 0.52 -0.67 0.00 0.00 178.83 179.54 1h33 h MET 110 N 1.14 0.44 -0.22 1.46 2.86 -0.94 -1.11 114.93 118.56 1h33 h MET 110 Ca 0.28 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.85 1h33 h MET 110 Cb 0.06 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1h33 h MET 110 CO -0.04 0.52 0.04 0.82 1.06 0.00 0.00 176.91 179.30 1h33 h ILE 111 N 0.29 0.89 0.00 -1.22 2.04 -1.02 -1.75 117.51 116.74 1h33 h ILE 111 Ca 0.09 -0.04 -0.10 0.00 1.00 0.00 0.00 64.86 65.81 1h33 h ILE 111 Cb 0.26 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1h33 h ILE 111 CO -0.00 0.02 -0.49 0.78 0.00 0.00 0.00 178.15 178.46 1h33 h ASN 112 N 0.12 0.00 -0.65 1.72 2.35 -1.20 -1.25 115.58 116.67 1h33 h ASN 112 Ca 0.10 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1h33 h ASN 112 Cb 0.10 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.42 1h33 h ASN 112 CO -0.14 0.49 0.35 0.00 -1.65 0.00 0.00 177.43 176.48 1h33 h ALA 113 N 1.51 0.86 -0.26 -0.83 0.00 -0.75 -2.27 119.26 117.52 1h33 h ALA 113 Ca -0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1h33 h ALA 113 Cb 0.88 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1h33 h ALA 113 CO 0.06 0.03 -0.06 0.00 0.00 0.00 0.00 179.25 179.28 1h33 h ARG 115 N 0.25 0.45 0.08 0.00 3.08 -1.16 0.49 114.38 117.56 1h33 h ARG 115 Ca 0.07 -0.03 -0.26 0.00 0.07 0.00 0.00 59.98 59.83 1h33 h ARG 115 Cb 0.53 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1h33 h ARG 115 CO 0.03 0.30 -1.34 1.79 -1.07 0.00 0.00 179.97 179.67 1h33 h THR 116 N 0.46 1.01 0.00 2.04 1.35 -1.42 0.17 112.91 116.53 1h33 h THR 116 Ca 0.36 -2.34 0.00 0.00 -0.55 0.00 0.00 66.41 63.88 1h33 h THR 116 Cb 0.48 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 1h33 h THR 116 CO -0.34 0.63 -0.81 0.77 -0.25 0.00 0.00 175.52 175.52 1h33 h SER 117 N -0.48 0.00 0.00 5.36 4.64 -1.23 -3.22 113.55 118.62 1h33 h SER 117 Ca -0.31 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 60.99 1h33 h SER 117 Cb 1.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.72 1h33 h SER 117 CO -0.01 0.01 -1.23 0.54 -0.87 0.00 0.00 176.83 175.27 1h33 n ARG 118 N -2.70 0.46 -0.00 4.77 1.74 0.03 -4.71 116.66 116.24 1h33 n ARG 118 Ca 0.01 -0.04 0.08 0.00 -0.77 0.00 0.00 57.85 57.12 1h33 n ARG 118 Cb 0.54 -1.12 -0.11 0.00 -1.02 0.00 0.00 32.46 30.75 1h33 n ARG 118 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1h33 n MET 119 N -1.72 1.02 -3.39 5.56 2.81 -0.41 -4.84 117.12 116.15 1h33 n MET 119 Ca -0.02 -0.09 -0.24 0.00 -1.81 0.00 0.00 57.70 55.54 1h33 n MET 119 Cb 0.18 -1.32 0.05 0.00 -0.71 0.00 0.00 33.22 31.42 1h33 n MET 119 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h33 n GLY 120 N 1.52 -0.53 3.63 3.03 0.00 -0.94 -2.12 105.19 109.78 1h33 n GLY 120 Ca -0.01 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1h33 n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h33 s ALA 121 N -3.22 3.17 0.34 4.61 0.00 0.56 -1.79 121.76 125.42 1h33 s ALA 121 Ca 0.47 -1.85 -0.29 0.00 0.00 0.00 0.00 51.96 50.29 1h33 s ALA 121 Cb -0.22 -0.51 -0.10 0.00 0.00 0.00 0.00 23.12 22.29 1h33 s ALA 121 CO 0.58 0.15 1.33 -2.14 0.00 0.00 0.00 175.76 175.67 1h33 s PRO 122 N -3.69 4.33 0.56 0.00 0.02 -1.26 -4.03 135.00 130.93 1h33 s PRO 122 Ca 0.33 2.26 -0.21 0.00 0.02 0.00 0.00 61.00 63.40 1h33 s PRO 122 Cb -0.03 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.38 1h33 s PRO 122 CO 0.19 -0.23 1.30 0.39 -0.33 0.00 0.00 177.00 178.33 1h33 n GLU 123 N 0.77 1.55 -3.04 5.54 1.02 -1.26 -4.87 120.64 120.35 1h33 n GLU 123 Ca 0.00 0.57 -0.39 0.00 -0.02 0.00 0.00 57.16 57.32 1h33 n GLU 123 Cb 0.41 -2.51 -0.05 0.00 -0.02 0.00 0.00 31.44 29.27 1h33 n GLU 123 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1h33 s TRP 124 N -1.32 3.78 0.11 -0.32 0.51 -1.26 -5.02 118.94 115.42 1h33 s TRP 124 Ca 0.73 1.46 -0.36 0.00 -2.12 0.00 0.00 56.10 55.81 1h33 s TRP 124 Cb -0.42 -2.75 -0.16 0.00 -0.81 0.00 0.00 33.47 29.33 1h33 s TRP 124 CO 0.48 0.38 1.36 -0.25 -0.51 0.00 0.00 176.95 178.42 1h33 n ASP 125 N 2.37 1.87 -0.10 2.95 8.00 -1.26 -4.85 116.55 125.53 1h33 n ASP 125 Ca -0.05 1.12 -0.06 0.00 0.71 0.00 0.00 54.79 56.51 1h33 n ASP 125 Cb 0.50 -1.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.37 1h33 n ASP 125 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1h33 h TYR 126 N 4.66 -0.24 -0.50 1.24 3.20 -1.98 -0.71 116.97 122.65 1h33 h TYR 126 Ca -0.47 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.43 1h33 h TYR 126 Cb 1.32 0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.75 1h33 h TYR 126 CO 0.60 -0.18 0.00 0.44 -1.64 0.00 0.00 178.16 177.38 1h33 n ILE 127 N -5.30 2.15 -1.36 1.81 -5.35 -1.26 -4.69 119.36 105.36 1h33 n ILE 127 Ca 0.01 -1.42 -0.29 0.00 -0.27 0.00 0.00 62.75 60.77 1h33 n ILE 127 Cb 0.21 -0.05 0.19 0.00 -1.74 0.00 0.00 39.64 38.25 1h33 n ILE 127 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1h33 s GLY 128 N -1.16 1.61 0.34 3.28 0.00 -0.27 -4.77 107.32 106.34 1h33 s GLY 128 Ca 0.47 -0.76 0.08 0.00 0.00 0.00 0.00 44.72 44.51 1h33 s GLY 128 CO 0.17 -0.04 1.80 -0.56 0.00 0.00 0.00 173.10 174.47 1h33 h PRO 129 N -2.00 0.23 -0.16 2.90 0.13 -1.95 -1.37 132.00 129.78 1h33 h PRO 129 Ca -0.48 -0.08 -0.03 0.00 -0.87 0.00 0.00 66.00 64.53 1h33 h PRO 129 Cb 1.30 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1h33 h PRO 129 CO 0.47 0.50 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.28 1h33 h ASP 130 N 0.21 0.30 -0.42 1.44 3.32 -1.93 -1.59 116.42 117.74 1h33 h ASP 130 Ca 0.03 -0.35 -0.11 0.00 0.02 0.00 0.00 57.03 56.62 1h33 h ASP 130 Cb 0.62 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1h33 h ASP 130 CO 0.04 0.58 -0.15 -0.03 -1.72 0.00 0.00 179.24 177.96 1h33 h MET 131 N 0.01 0.85 0.00 3.56 4.05 -1.75 -2.60 114.93 119.04 1h33 h MET 131 Ca 0.04 -0.35 -0.12 0.00 -0.28 0.00 0.00 59.70 58.99 1h33 h MET 131 Cb 0.44 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.19 1h33 h MET 131 CO 0.01 0.99 -0.57 1.15 0.23 0.00 0.00 176.91 178.72 1h33 h THR 132 N 0.67 1.31 -0.34 -0.77 2.02 -1.15 -0.55 112.91 114.10 1h33 h THR 132 Ca 0.10 -2.03 -0.17 0.00 0.77 0.00 0.00 66.41 65.08 1h33 h THR 132 Cb 0.70 2.13 -0.00 0.00 -1.74 0.00 0.00 68.15 69.24 1h33 h THR 132 CO 0.05 0.56 -0.46 0.00 0.37 0.00 0.00 175.52 176.05 1h33 h ALA 133 N 1.43 0.55 -0.51 6.16 0.00 -1.18 -0.66 119.26 125.04 1h33 h ALA 133 Ca -0.01 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.32 1h33 h ALA 133 Cb 1.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1h33 h ALA 133 CO 0.07 0.68 -0.09 1.98 0.00 0.00 0.00 179.25 181.90 1h33 h MET 134 N 0.71 0.95 -0.23 0.00 -1.53 -1.06 -0.33 114.93 113.44 1h33 h MET 134 Ca 0.04 -0.35 -0.06 0.00 -3.44 0.00 0.00 59.70 55.89 1h33 h MET 134 Cb 1.06 -0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 32.03 1h33 h MET 134 CO 0.11 1.01 -0.13 0.28 0.14 0.00 0.00 176.91 178.32 1h33 h VAL 135 N 0.81 1.21 -0.49 -5.77 2.07 -0.99 -1.29 116.25 111.80 1h33 h VAL 135 Ca 0.13 -0.93 -0.12 0.00 0.82 0.00 0.00 66.70 66.60 1h33 h VAL 135 Cb 0.64 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1h33 h VAL 135 CO 0.04 0.30 -0.18 0.00 0.02 0.00 0.00 177.57 177.75 1h33 h ALA 136 N 1.52 0.68 -0.22 1.67 0.00 -0.73 0.48 119.26 122.66 1h33 h ALA 136 Ca 0.07 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1h33 h ALA 136 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1h33 h ALA 136 CO 0.03 0.64 0.14 1.25 0.00 0.00 0.00 179.25 181.31 1h33 h LEU 137 N 0.84 0.25 -0.64 0.00 5.85 -0.67 0.44 115.31 121.38 1h33 h LEU 137 Ca 0.11 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.89 1h33 h LEU 137 Cb 0.76 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.66 1h33 h LEU 137 CO 0.06 0.20 0.32 0.40 -0.34 0.00 0.00 178.44 179.08 1h33 h ILE 138 N 0.28 0.89 -0.92 4.05 2.04 -1.14 -1.88 117.51 120.83 1h33 h ILE 138 Ca 0.08 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.75 1h33 h ILE 138 Cb -0.01 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.29 1h33 h ILE 138 CO -0.02 0.10 0.60 0.00 0.00 0.00 0.00 178.15 178.83 1h33 h ALA 139 N 1.37 1.16 0.00 1.87 0.00 -0.56 -3.16 119.26 119.94 1h33 h ALA 139 Ca 0.30 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1h33 h ALA 139 Cb 0.27 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1h33 h ALA 139 CO -0.23 0.57 -0.38 0.66 0.00 0.00 0.00 179.25 179.87 1h33 h SER 140 N 1.25 0.00 0.16 0.00 4.64 -0.10 -1.91 113.55 117.59 1h33 h SER 140 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1h33 h SER 140 Cb -0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1h33 h SER 140 CO -0.07 0.38 -0.06 1.33 -0.87 0.00 0.00 176.83 177.54 1h33 n VAL 141 N -3.87 0.00 -0.50 0.95 0.24 -1.03 -3.16 118.33 110.97 1h33 n VAL 141 Ca -0.01 -0.10 0.06 0.00 -2.04 0.00 0.00 64.34 62.24 1h33 n VAL 141 Cb 0.44 0.01 0.17 0.00 -1.47 0.00 0.00 33.84 32.99 1h33 n VAL 141 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1h33 n SER 142 N -0.62 3.13 -4.73 -1.34 7.64 -0.72 -4.68 113.62 112.29 1h33 n SER 142 Ca 0.18 -2.42 -0.42 0.00 1.01 0.00 0.00 58.87 57.21 1h33 n SER 142 Cb 0.26 -0.33 -0.01 0.00 -1.01 0.00 0.00 64.21 63.12 1h33 n SER 142 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1h33 n ARG 143 N -0.07 2.52 0.00 1.43 1.74 -1.17 -1.96 116.66 119.14 1h33 n ARG 143 Ca 0.14 0.89 0.00 0.00 -0.77 0.00 0.00 57.85 58.11 1h33 n ARG 143 Cb 0.59 -2.61 0.00 0.00 -1.02 0.00 0.00 32.46 29.41 1h33 n ARG 143 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h33 n GLY 144 N 1.55 2.99 3.75 -0.13 0.00 -0.48 -4.93 105.19 107.95 1h33 n GLY 144 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1h33 n GLY 144 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1h33 s MET 145 N -0.82 4.79 0.27 1.61 -1.94 -0.83 -4.72 119.30 117.65 1h33 s MET 145 Ca 0.00 1.58 -0.29 0.00 -1.71 0.00 0.00 55.69 55.26 1h33 s MET 145 Cb 0.00 -3.24 -0.09 0.00 2.01 0.00 0.00 34.83 33.51 1h33 s MET 145 CO 0.00 0.42 1.26 -1.25 -0.01 0.00 0.00 175.02 175.45 1h33 s PRO 146 N -1.28 4.43 0.24 2.03 0.04 -1.26 -0.14 135.00 139.06 1h33 s PRO 146 Ca 0.42 2.06 -0.30 0.00 0.04 0.00 0.00 61.00 63.22 1h33 s PRO 146 Cb -0.27 -3.15 -0.10 0.00 0.04 0.00 0.00 34.50 31.02 1h33 s PRO 146 CO 0.34 -0.13 1.46 0.08 0.04 0.00 0.00 177.00 178.80 1h33 s VAL 147 N -0.62 2.63 -0.42 -0.36 1.01 0.29 -4.81 120.40 118.11 1h33 s VAL 147 Ca 0.51 0.51 0.08 0.00 0.00 0.00 0.00 61.98 63.08 1h33 s VAL 147 Cb -0.37 -3.33 0.26 0.00 0.00 0.00 0.00 36.38 32.94 1h33 s VAL 147 CO 0.44 0.08 0.66 -1.20 0.00 0.00 0.00 175.10 175.08 1h33 n SER 148 N 2.54 -0.73 -4.78 3.32 7.64 -0.01 -1.30 113.62 120.29 1h33 n SER 148 Ca 0.08 -2.93 -0.38 0.00 1.01 0.00 0.00 58.87 56.64 1h33 n SER 148 Cb 0.40 0.15 -0.06 0.00 -1.01 0.00 0.00 64.21 63.69 1h33 n SER 148 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1h33 s VAL 149 N -0.70 4.99 0.29 0.44 -7.23 -1.25 -4.53 120.40 112.40 1h33 s VAL 149 Ca 0.34 1.06 -0.29 0.00 -1.81 0.00 0.00 61.98 61.27 1h33 s VAL 149 Cb 0.21 -3.84 -0.10 0.00 0.56 0.00 0.00 36.38 33.21 1h33 s VAL 149 CO -0.14 0.45 1.14 0.00 -0.31 0.00 0.00 175.10 176.24 1h33 s ALA 150 N -0.33 3.43 0.00 1.32 0.00 -1.26 -4.89 121.76 120.03 1h33 s ALA 150 Ca 0.27 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1h33 s ALA 150 Cb -0.17 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1h33 s ALA 150 CO 0.15 -0.26 0.31 0.44 0.00 0.00 0.00 175.76 176.39 1h33 n ILE 151 N 1.17 0.00 -3.31 0.00 -5.35 -1.26 -4.90 119.36 105.71 1h33 n ILE 151 Ca -0.01 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 1h33 n ILE 151 Cb 0.44 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1h33 n ILE 151 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1h33 n ASP 152 N -0.38 1.99 0.00 7.28 3.85 -1.26 -3.86 116.55 124.16 1h33 n ASP 152 Ca 0.00 -0.31 0.00 0.00 -0.71 0.00 0.00 54.79 53.77 1h33 n ASP 152 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 1h33 n ASP 152 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1h33 n GLY 153 N 5.00 2.86 0.00 6.12 0.00 -1.26 -2.31 105.19 115.60 1h33 n GLY 153 Ca 0.00 -0.38 0.06 0.00 0.00 0.00 0.00 46.02 45.70 1h33 n GLY 153 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h33 n PRO 154 N 13.85 0.04 0.00 1.61 -0.04 -1.26 -1.85 135.00 147.34 1h33 n PRO 154 Ca 0.00 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1h33 n PRO 154 Cb 0.00 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.18 1h33 n PRO 154 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h33 n ALA 155 N -1.46 3.61 -0.07 0.55 0.00 -0.98 -4.60 120.51 117.57 1h33 n ALA 155 Ca 0.04 -0.40 -0.08 0.00 0.00 0.00 0.00 53.44 53.00 1h33 n ALA 155 Cb 0.14 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 1h33 n ALA 155 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1h33 h GLN 156 N 0.29 0.15 -0.29 0.00 4.15 -1.38 -0.49 115.11 117.54 1h33 h GLN 156 Ca 0.00 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 1h33 h GLN 156 Cb 0.51 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 1h33 h GLN 156 CO 0.00 0.10 -0.09 0.66 -1.93 0.00 0.00 178.83 177.57 1h33 h SER 157 N 0.15 0.45 -0.13 -0.69 4.64 -1.82 -0.06 113.55 116.10 1h33 h SER 157 Ca 0.12 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 1h33 h SER 157 Cb 0.12 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1h33 h SER 157 CO -0.16 0.59 -0.05 0.74 -0.87 0.00 0.00 176.83 177.08 1h33 h THR 158 N 0.45 1.30 -0.63 2.95 2.02 -1.75 -1.80 112.91 115.45 1h33 h THR 158 Ca 0.09 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.26 1h33 h THR 158 Cb 0.43 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 68.51 1h33 h THR 158 CO 0.02 0.30 0.38 -0.25 0.37 0.00 0.00 175.52 176.34 1h33 h TRP 159 N -0.06 0.70 -0.98 3.16 7.01 -0.75 -1.22 115.95 123.82 1h33 h TRP 159 Ca 0.03 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.06 1h33 h TRP 159 Cb 0.49 -0.23 -0.05 0.00 -2.10 0.00 0.00 29.16 27.28 1h33 h TRP 159 CO 0.06 0.39 0.63 0.93 -2.79 0.00 0.00 178.44 177.66 1h33 h GLU 160 N 0.74 1.30 -0.52 2.65 5.08 -0.94 0.91 114.58 123.79 1h33 h GLU 160 Ca 0.26 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1h33 h GLU 160 Cb 0.05 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 1h33 h GLU 160 CO -0.12 0.87 0.13 -0.22 -1.00 0.00 0.00 179.01 178.68 1h33 h LYS 161 N 1.33 0.82 -0.56 2.33 3.64 -1.04 -1.01 116.57 122.09 1h33 h LYS 161 Ca 0.36 -0.19 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1h33 h LYS 161 Cb -0.13 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.54 1h33 h LYS 161 CO -0.07 0.78 0.30 0.78 -2.27 0.00 0.00 179.45 178.97 1h33 h GLY 162 N 0.72 0.79 1.01 5.01 0.00 -0.65 -1.78 103.07 108.17 1h33 h GLY 162 Ca 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1h33 h GLY 162 CO 0.00 0.15 0.47 -0.09 0.00 0.00 0.00 176.54 177.07 1h33 h ARG 163 N 0.58 1.04 -0.56 4.80 2.43 -0.47 -1.11 114.38 121.10 1h33 h ARG 163 Ca 0.24 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1h33 h ARG 163 Cb 0.12 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 1h33 h ARG 163 CO -0.15 0.73 0.34 0.93 -1.51 0.00 0.00 179.97 180.32 1h33 h GLU 164 N 1.06 0.75 -0.81 0.20 5.08 -0.88 -2.56 114.58 117.42 1h33 h GLU 164 Ca 0.28 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1h33 h GLU 164 Cb -0.05 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.00 1h33 h GLU 164 CO -0.05 0.53 0.40 0.82 -1.00 0.00 0.00 179.01 179.71 1h33 h ILE 165 N 0.75 1.25 -0.10 3.13 2.04 -0.71 -2.69 117.51 121.18 1h33 h ILE 165 Ca 0.20 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 1h33 h ILE 165 Cb -0.03 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 1h33 h ILE 165 CO -0.04 0.29 -0.05 0.22 0.00 0.00 0.00 178.15 178.57 1h33 h TYR 166 N 1.13 0.15 -0.48 1.37 3.20 -0.82 -1.84 116.97 119.67 1h33 h TYR 166 Ca 0.28 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.14 1h33 h TYR 166 Cb 0.10 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.32 1h33 h TYR 166 CO 0.01 0.21 0.00 0.66 -1.64 0.00 0.00 178.16 177.40 1h33 n TYR 167 N -4.39 1.04 -3.41 -3.82 4.02 -1.07 -2.56 117.16 106.96 1h33 n TYR 167 Ca -0.01 -0.63 -0.37 0.00 -0.01 0.00 0.00 57.90 56.88 1h33 n TYR 167 Cb 0.18 -0.18 -0.07 0.00 -0.02 0.00 0.00 39.34 39.25 1h33 n TYR 167 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1h33 s THR 168 N -1.74 5.23 0.13 -0.72 2.01 -0.69 -4.90 115.64 114.96 1h33 s THR 168 Ca 0.41 0.73 -0.31 0.00 0.31 0.00 0.00 61.69 62.83 1h33 s THR 168 Cb 0.26 -3.72 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 1h33 s THR 168 CO 0.19 0.32 1.31 -0.13 -0.69 0.00 0.00 174.62 175.62 1h33 s ARG 169 N 0.85 4.38 0.30 4.92 0.52 -1.26 -4.01 118.95 124.65 1h33 s ARG 169 Ca 0.20 1.98 0.09 0.00 -0.52 0.00 0.00 55.73 57.48 1h33 s ARG 169 Cb -0.14 -3.26 -0.06 0.00 0.52 0.00 0.00 34.95 32.01 1h33 s ARG 169 CO 0.07 -0.32 -0.11 0.71 0.02 0.00 0.00 175.30 175.67 1h33 s TYR 170 N 0.75 2.18 0.05 -0.53 1.51 0.04 -4.74 117.35 116.62 1h33 s TYR 170 Ca 0.60 -0.53 0.00 0.00 -1.01 0.00 0.00 57.07 56.14 1h33 s TYR 170 Cb -0.35 -1.16 0.00 0.00 -0.11 0.00 0.00 41.96 40.34 1h33 s TYR 170 CO 0.32 0.50 0.00 0.41 -1.11 0.00 0.00 175.55 175.68 1h33 n GLY 171 N -0.66 -1.84 0.27 0.71 0.00 -1.26 -1.66 105.19 100.75 1h33 n GLY 171 Ca -0.05 -1.46 0.17 0.00 0.00 0.00 0.00 46.02 44.67 1h33 n GLY 171 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1h33 h GLN 172 N -0.16 0.00 0.00 1.61 4.15 -1.07 -1.85 115.11 117.78 1h33 h GLN 172 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1h33 h GLN 172 Cb 0.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.85 1h33 h GLN 172 CO 0.00 0.02 0.00 -0.07 -1.93 0.00 0.00 178.83 176.86 1h33 h LEU 173 N 0.00 0.00 -2.46 -2.39 3.38 -1.51 -3.49 115.31 108.84 1h33 h LEU 173 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 1h33 h LEU 173 Cb 0.54 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.44 1h33 h LEU 173 CO 0.00 0.00 -0.68 -0.67 0.09 0.00 0.00 178.44 177.18 1h33 n ASP 174 N -2.79 -5.29 -4.11 -0.43 2.03 -0.70 -5.02 116.55 100.24 1h33 n ASP 174 Ca 0.04 -0.56 -0.19 0.00 0.52 0.00 0.00 54.79 54.60 1h33 n ASP 174 Cb 0.45 -4.26 -0.13 0.00 -0.72 0.00 0.00 41.12 36.45 1h33 n ASP 174 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h33 s LEU 175 N -4.98 2.16 0.31 -2.67 1.43 -0.67 -4.68 118.68 109.58 1h33 s LEU 175 Ca 0.32 -0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1h33 s LEU 175 Cb -0.04 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 1h33 s LEU 175 CO 0.59 0.01 0.32 -0.94 0.23 0.00 0.00 176.35 176.56 1h33 s SER 176 N -1.03 5.62 0.28 2.29 1.04 -1.26 -0.78 113.70 119.86 1h33 s SER 176 Ca 0.00 -0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.14 1h33 s SER 176 Cb -0.07 -1.23 0.63 0.00 0.10 0.00 0.00 66.02 65.45 1h33 s SER 176 CO 0.01 -0.27 1.74 0.00 0.98 0.00 0.00 173.24 175.69 1h33 h ALA 178 N 1.63 1.36 -0.71 0.00 0.00 -1.91 -1.28 119.26 118.34 1h33 h ALA 178 Ca 0.51 -0.28 0.12 0.00 0.00 0.00 0.00 54.91 55.27 1h33 h ALA 178 Cb 0.84 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 1h33 h ALA 178 CO -0.43 0.38 0.30 0.77 0.00 0.00 0.00 179.25 180.27 1h33 h SER 179 N 0.00 0.31 0.00 0.00 0.02 -1.53 -1.20 113.55 111.15 1h33 h SER 179 Ca -0.00 0.09 -0.20 0.00 -0.84 0.00 0.00 61.79 60.84 1h33 h SER 179 Cb 0.59 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1h33 h SER 179 CO 0.04 0.15 -1.27 0.00 -1.14 0.00 0.00 176.83 174.61 1h33 h HIS 181 N -1.00 0.00 0.00 0.00 3.86 -1.27 -2.20 115.15 114.55 1h33 h HIS 181 Ca -0.31 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.55 1h33 h HIS 181 Cb 1.15 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.57 1h33 h HIS 181 CO -0.03 0.00 -2.18 -1.91 0.86 0.00 0.00 177.93 174.67 1h33 n GLU 182 N -2.83 0.53 0.02 2.45 2.13 -0.54 -3.98 120.64 118.43 1h33 n GLU 182 Ca 0.03 0.23 -0.10 0.00 0.66 0.00 0.00 57.16 57.99 1h33 n GLU 182 Cb 0.51 -1.40 0.05 0.00 0.27 0.00 0.00 31.44 30.87 1h33 n GLU 182 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1h33 h GLN 183 N -0.92 0.51 -0.00 5.31 4.20 -1.48 -3.36 115.11 119.37 1h33 h GLN 183 Ca -0.54 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 57.82 1h33 h GLN 183 Cb 1.46 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 29.29 1h33 h GLN 183 CO -0.33 0.96 -0.01 0.66 -0.67 0.00 0.00 178.83 179.45 1h33 n TYR 184 N -3.92 0.01 -1.41 2.96 4.02 -0.86 -5.03 117.16 112.93 1h33 n TYR 184 Ca -0.04 -1.01 -0.36 0.00 -0.01 0.00 0.00 57.90 56.49 1h33 n TYR 184 Cb 0.64 -0.15 0.09 0.00 -0.02 0.00 0.00 39.34 39.89 1h33 n TYR 184 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 176.86 177.82 1h33 n PHE 185 N -1.42 0.98 -0.77 -0.72 -1.74 -1.00 -1.64 117.46 111.15 1h33 n PHE 185 Ca 0.16 0.40 0.00 0.00 -0.56 0.00 0.00 57.45 57.45 1h33 n PHE 185 Cb 0.64 -2.12 0.00 0.00 1.52 0.00 0.00 39.48 39.52 1h33 n PHE 185 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 1h33 n ASP 186 N -1.87 0.00 -4.83 5.98 10.43 0.14 -5.00 116.55 121.40 1h33 n ASP 186 Ca 0.14 0.00 -0.22 0.00 2.57 0.00 0.00 54.79 57.28 1h33 n ASP 186 Cb 0.49 -1.02 0.08 0.00 1.84 0.00 0.00 41.12 42.51 1h33 n ASP 186 CO 0.00 0.00 0.00 -1.00 -1.07 0.00 0.00 177.20 175.13 1h33 s HIS 187 N -2.74 1.98 -0.07 1.24 3.76 -0.65 -4.83 115.29 113.98 1h33 s HIS 187 Ca 0.00 -0.27 0.00 0.00 -0.15 0.00 0.00 55.06 54.64 1h33 s HIS 187 Cb 0.00 -2.78 -0.03 0.00 1.11 0.00 0.00 32.58 30.88 1h33 s HIS 187 CO 0.00 -1.34 -0.05 0.71 -0.85 0.00 0.00 174.74 173.21 1h33 s TYR 188 N -2.93 2.99 -0.30 1.40 1.51 -1.26 -0.42 117.35 118.33 1h33 s TYR 188 Ca 0.63 0.06 -0.05 0.00 -1.01 0.00 0.00 57.07 56.70 1h33 s TYR 188 Cb -0.07 -1.72 0.03 0.00 -0.11 0.00 0.00 41.96 40.09 1h33 s TYR 188 CO 0.41 0.37 0.05 0.42 -1.11 0.00 0.00 175.55 175.69 1h33 s ILE 189 N -0.85 3.51 0.00 2.71 1.01 -0.43 -4.95 121.20 122.20 1h33 s ILE 189 Ca 0.13 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1h33 s ILE 189 Cb -0.11 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.46 1h33 s ILE 189 CO 0.02 -0.02 0.00 -1.14 0.00 0.00 0.00 174.94 173.80 1h33 n ARG 190 N 4.76 0.00 -0.05 2.79 3.00 -1.26 -1.22 116.66 124.68 1h33 n ARG 190 Ca -0.14 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 57.83 1h33 n ARG 190 Cb 0.46 0.00 0.44 0.00 0.00 0.00 0.00 32.46 33.36 1h33 n ARG 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1h33 n ALA 191 N 10.11 2.55 -2.71 5.13 0.00 -1.26 -4.88 120.51 129.45 1h33 n ALA 191 Ca 0.00 -0.46 -0.38 0.00 0.00 0.00 0.00 53.44 52.60 1h33 n ALA 191 Cb 0.00 -1.14 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 1h33 n ALA 191 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h33 s ASP 192 N -1.69 6.58 -0.35 0.00 1.01 -0.35 -5.04 116.67 116.83 1h33 s ASP 192 Ca 0.34 0.69 -0.24 0.00 0.71 0.00 0.00 52.55 54.05 1h33 s ASP 192 Cb 0.18 -2.26 0.01 0.00 1.01 0.00 0.00 42.92 41.86 1h33 s ASP 192 CO 0.28 -0.01 0.83 -2.28 0.21 0.00 0.00 175.17 174.20 1h33 s HIS 193 N 0.82 3.13 -0.01 4.23 2.46 -1.26 -1.32 115.29 123.33 1h33 s HIS 193 Ca 0.23 0.70 -0.30 0.00 0.47 0.00 0.00 55.06 56.16 1h33 s HIS 193 Cb -0.15 -3.43 -0.06 0.00 -0.13 0.00 0.00 32.58 28.81 1h33 s HIS 193 CO 0.09 -0.72 1.57 -0.51 -2.47 0.00 0.00 174.74 172.70 1h33 s LEU 194 N 3.18 4.33 0.00 8.88 1.43 0.44 -4.93 118.68 132.00 1h33 s LEU 194 Ca 0.34 2.25 -0.00 0.00 -1.03 0.00 0.00 54.13 55.68 1h33 s LEU 194 Cb -0.13 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.58 1h33 s LEU 194 CO 0.16 -0.86 0.26 -1.54 0.23 0.00 0.00 176.35 174.61 1h33 n SER 195 N 6.26 0.32 -0.15 2.29 3.41 -1.26 0.27 113.62 124.77 1h33 n SER 195 Ca 0.16 -1.28 0.08 0.00 -0.26 0.00 0.00 58.87 57.56 1h33 n SER 195 Cb 0.42 -0.17 0.39 0.00 -0.26 0.00 0.00 64.21 64.60 1h33 n SER 195 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h33 n GLN 196 N -1.49 1.19 -2.90 4.33 6.02 -1.26 -4.55 117.38 118.71 1h33 n GLN 196 Ca 0.04 -0.29 -0.14 0.00 -0.01 0.00 0.00 57.00 56.61 1h33 n GLN 196 Cb 0.15 -1.26 0.03 0.00 1.02 0.00 0.00 30.24 30.19 1h33 n GLN 196 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h33 n GLY 197 N 0.82 0.02 3.86 1.08 0.00 -1.26 -4.85 105.19 104.86 1h33 n GLY 197 Ca 0.12 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 1h33 n GLY 197 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h33 s GLN 198 N -5.47 3.83 -0.11 1.61 -1.52 -1.26 -5.01 119.66 111.73 1h33 s GLN 198 Ca 0.25 0.71 0.15 0.00 -1.95 0.00 0.00 55.36 54.52 1h33 s GLN 198 Cb -0.11 -2.25 0.26 0.00 -0.22 0.00 0.00 33.01 30.70 1h33 s GLN 198 CO 0.31 -0.20 1.16 0.44 -0.25 0.00 0.00 175.29 176.75 1h33 n ILE 199 N -1.59 1.74 0.32 1.08 -5.35 -1.26 -4.68 119.36 109.62 1h33 n ILE 199 Ca 0.05 -1.95 0.15 0.00 -0.27 0.00 0.00 62.75 60.73 1h33 n ILE 199 Cb 0.54 -0.08 0.64 0.00 -1.74 0.00 0.00 39.64 39.00 1h33 n ILE 199 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1h33 h ASN 200 N 0.27 0.00 -0.66 7.28 7.08 -1.93 -2.15 115.58 125.47 1h33 h ASN 200 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1h33 h ASN 200 Cb 0.95 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.19 1h33 h ASN 200 CO 0.03 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.99 1h33 n GLY 201 N -0.09 2.08 3.90 9.14 0.00 -1.26 -1.27 105.19 117.67 1h33 n GLY 201 Ca 0.01 -0.71 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1h33 n GLY 201 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h33 s PHE 202 N -1.13 3.51 0.36 1.61 0.40 -0.81 -1.84 117.98 120.09 1h33 s PHE 202 Ca 0.44 0.83 -0.28 0.00 -0.60 0.00 0.00 56.93 57.33 1h33 s PHE 202 Cb 0.23 -2.29 -0.10 0.00 0.51 0.00 0.00 43.02 41.37 1h33 s PHE 202 CO 0.30 -0.11 1.30 -2.14 0.70 0.00 0.00 175.22 175.27 1h33 s PRO 203 N -4.17 4.20 -0.04 0.24 0.02 -1.26 -4.30 135.00 129.69 1h33 s PRO 203 Ca 0.48 2.17 -0.08 0.00 0.02 0.00 0.00 61.00 63.59 1h33 s PRO 203 Cb -0.10 -2.93 -0.05 0.00 0.02 0.00 0.00 34.50 31.44 1h33 s PRO 203 CO 0.37 -0.31 0.25 -1.54 -0.33 0.00 0.00 177.00 175.44 1h33 s SER 204 N -0.61 6.52 -0.36 2.53 1.04 -0.79 -3.34 113.70 118.68 1h33 s SER 204 Ca 0.52 0.61 -0.22 0.00 0.48 0.00 0.00 55.95 57.34 1h33 s SER 204 Cb -0.39 -2.11 0.01 0.00 0.10 0.00 0.00 66.02 63.63 1h33 s SER 204 CO 0.51 0.32 0.70 -0.47 0.98 0.00 0.00 173.24 175.27 1h33 s TYR 205 N -1.17 3.13 -0.18 5.02 6.14 0.60 -0.27 117.35 130.62 1h33 s TYR 205 Ca 0.23 0.41 -0.12 0.00 0.64 0.00 0.00 57.07 58.22 1h33 s TYR 205 Cb -0.13 -3.26 -0.05 0.00 0.42 0.00 0.00 41.96 38.94 1h33 s TYR 205 CO 0.12 -0.68 0.23 1.03 0.64 0.00 0.00 175.55 176.88 1h33 s ARG 206 N 2.87 4.22 0.40 4.97 0.52 -1.03 -1.64 118.95 129.26 1h33 s ARG 206 Ca 0.27 -0.03 0.19 0.00 -0.52 0.00 0.00 55.73 55.63 1h33 s ARG 206 Cb -0.14 -3.43 0.83 0.00 0.52 0.00 0.00 34.95 32.72 1h33 s ARG 206 CO 0.16 0.24 1.82 -0.07 0.02 0.00 0.00 175.30 177.46 1h33 h LEU 207 N 6.76 0.00 -0.04 2.53 3.38 -1.40 0.16 115.31 126.71 1h33 h LEU 207 Ca -0.41 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.57 1h33 h LEU 207 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1h33 h LEU 207 CO 0.75 0.33 -0.00 0.50 0.09 0.00 0.00 178.44 180.11 1h33 h LYS 208 N 0.00 0.01 -0.14 1.13 3.64 -1.80 -3.31 116.57 116.09 1h33 h LYS 208 Ca -0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1h33 h LYS 208 Cb 0.74 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1h33 h LYS 208 CO 0.04 0.01 0.00 0.27 -2.27 0.00 0.00 179.45 177.50 1h33 n ASN 209 N -5.10 2.33 -3.69 4.20 2.04 -1.02 -5.00 115.26 109.01 1h33 n ASN 209 Ca -0.06 -1.67 -0.28 0.00 -0.44 0.00 0.00 54.58 52.12 1h33 n ASN 209 Cb 0.04 -0.09 0.02 0.00 -2.53 0.00 0.00 39.78 37.22 1h33 n ASN 209 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1h33 n ALA 210 N 0.61 -1.19 -2.68 -2.53 0.00 0.53 -4.97 120.51 110.28 1h33 n ALA 210 Ca 0.09 0.17 -0.11 0.00 0.00 0.00 0.00 53.44 53.60 1h33 n ALA 210 Cb 0.34 -3.99 -0.08 0.00 0.00 0.00 0.00 19.45 15.73 1h33 n ALA 210 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1h33 s ARG 211 N -6.39 1.37 0.36 0.00 1.70 -1.25 -4.98 118.95 109.76 1h33 s ARG 211 Ca 0.57 -1.44 -0.25 0.00 -0.47 0.00 0.00 55.73 54.13 1h33 s ARG 211 Cb -0.29 0.37 -0.09 0.00 -0.57 0.00 0.00 34.95 34.37 1h33 s ARG 211 CO 0.70 -0.51 1.01 -0.51 -1.08 0.00 0.00 175.30 174.91 1h33 s LEU 212 N -3.09 4.24 -0.13 -1.89 1.43 -1.26 -2.47 118.68 115.52 1h33 s LEU 212 Ca 0.31 1.98 0.02 0.00 -1.03 0.00 0.00 54.13 55.40 1h33 s LEU 212 Cb 0.03 -4.08 0.01 0.00 0.03 0.00 0.00 46.19 42.18 1h33 s LEU 212 CO 0.10 -0.30 -0.17 0.20 0.23 0.00 0.00 176.35 176.41 1h33 s ASN 213 N -1.54 2.70 0.45 2.29 0.01 0.63 -4.93 114.94 114.56 1h33 s ASN 213 Ca 0.54 -0.50 -0.22 0.00 -0.71 0.00 0.00 52.86 51.98 1h33 s ASN 213 Cb -0.21 -1.22 -0.09 0.00 0.41 0.00 0.00 41.25 40.14 1h33 s ASN 213 CO 0.27 0.02 1.04 0.00 -1.51 0.00 0.00 177.10 176.92 1h33 s ALA 214 N 1.04 2.95 0.17 0.60 0.00 -1.26 -1.89 121.76 123.38 1h33 s ALA 214 Ca -0.04 0.63 -0.17 0.00 0.00 0.00 0.00 51.96 52.38 1h33 s ALA 214 Cb -0.15 -3.26 0.12 0.00 0.00 0.00 0.00 23.12 19.84 1h33 s ALA 214 CO -0.04 -0.26 1.65 0.28 0.00 0.00 0.00 175.76 177.39 1h33 h VAL 215 N 1.79 0.51 0.00 0.00 2.07 -1.98 -0.99 116.25 117.66 1h33 h VAL 215 Ca -0.49 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 1h33 h VAL 215 Cb 1.22 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1h33 h VAL 215 CO 0.60 0.00 -0.17 0.45 0.02 0.00 0.00 177.57 178.47 1h33 h HIS 216 N -0.04 0.00 -0.17 1.57 3.86 -1.95 0.05 115.15 118.48 1h33 h HIS 216 Ca 0.21 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.33 1h33 h HIS 216 Cb 0.36 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1h33 h HIS 216 CO -0.40 0.17 -0.24 0.22 0.86 0.00 0.00 177.93 178.54 1h33 h ASP 217 N 0.00 0.49 -0.49 2.45 3.58 -1.70 -1.34 116.42 119.42 1h33 h ASP 217 Ca -0.00 -0.52 0.03 0.00 0.42 0.00 0.00 57.03 56.96 1h33 h ASP 217 Cb 0.48 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.35 1h33 h ASP 217 CO 0.02 0.91 0.27 -0.09 -2.88 0.00 0.00 179.24 177.47 1h33 h ARG 218 N 0.09 0.51 -0.77 0.28 9.65 -0.62 -1.47 114.38 122.05 1h33 h ARG 218 Ca 0.02 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.86 1h33 h ARG 218 Cb 0.80 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 29.23 1h33 h ARG 218 CO 0.05 0.34 0.45 0.74 2.80 0.00 0.00 179.97 184.36 1h33 h PHE 219 N 0.53 1.03 -0.71 2.20 0.05 -0.92 -2.52 116.94 116.60 1h33 h PHE 219 Ca 0.21 -0.01 -0.04 0.00 3.82 0.00 0.00 57.97 61.94 1h33 h PHE 219 Cb 0.07 -0.33 -0.03 0.00 2.00 0.00 0.00 35.95 37.66 1h33 h PHE 219 CO -0.09 0.70 0.28 -0.09 -0.18 0.00 0.00 178.31 178.94 1h33 h ARG 220 N 1.06 1.06 -1.35 1.51 2.43 -1.04 -2.11 114.38 115.94 1h33 h ARG 220 Ca 0.27 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1h33 h ARG 220 Cb -0.01 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1h33 h ARG 220 CO -0.05 0.88 0.00 0.41 -1.51 0.00 0.00 179.97 179.70 1h33 n GLY 221 N -0.85 0.68 0.00 2.80 0.00 -0.57 -1.43 105.19 105.82 1h33 n GLY 221 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1h33 n GLY 221 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1h33 n ILE 223 N 0.71 0.00 -0.26 -0.61 5.41 -0.79 -1.32 119.36 122.49 1h33 n ILE 223 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.78 1h33 n ILE 223 Cb 0.16 0.00 0.16 0.00 -0.71 0.00 0.00 39.64 39.25 1h33 n ILE 223 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1h33 h ARG 224 N 0.00 0.60 0.00 0.38 2.43 -1.38 -1.82 114.38 114.59 1h33 h ARG 224 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1h33 h ARG 224 Cb 0.00 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1h33 h ARG 224 CO 0.00 0.40 0.00 -0.25 -1.51 0.00 0.00 179.97 178.61 1h33 n ASP 225 N -4.86 0.00 -0.40 -3.80 8.00 -0.43 -1.10 116.55 113.96 1h33 n ASP 225 Ca 0.13 -0.56 0.03 0.00 0.71 0.00 0.00 54.79 55.09 1h33 n ASP 225 Cb 0.32 -0.10 0.08 0.00 -0.02 0.00 0.00 41.12 41.40 1h33 n ASP 225 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1h33 n THR 226 N -1.10 0.29 -3.58 -3.53 -2.24 -0.70 -4.89 114.28 98.53 1h33 n THR 226 Ca 0.17 -0.24 -0.27 0.00 -2.27 0.00 0.00 64.05 61.44 1h33 n THR 226 Cb 0.13 0.02 0.05 0.00 -2.10 0.00 0.00 70.33 68.43 1h33 n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1h33 n ARG 227 N 0.02 -1.65 -4.24 -0.78 1.74 -0.26 -1.58 116.66 109.92 1h33 n ARG 227 Ca 0.06 0.56 -0.13 0.00 -0.77 0.00 0.00 57.85 57.57 1h33 n ARG 227 Cb 0.20 -4.59 -0.10 0.00 -1.02 0.00 0.00 32.46 26.94 1h33 n ARG 227 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1h33 s GLY 228 N -3.49 1.53 -0.38 -0.13 0.00 -1.10 -1.76 107.32 102.00 1h33 s GLY 228 Ca 0.45 -1.75 -0.14 0.00 0.00 0.00 0.00 44.72 43.28 1h33 s GLY 228 CO 0.83 -1.46 0.27 0.14 0.00 0.00 0.00 173.10 172.88 1h33 s VAL 229 N -4.04 5.22 0.85 1.40 1.01 -1.26 -4.06 120.40 119.53 1h33 s VAL 229 Ca 0.39 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.76 1h33 s VAL 229 Cb 0.07 -3.81 0.10 0.00 0.00 0.00 0.00 36.38 32.74 1h33 s VAL 229 CO 0.13 -0.18 1.09 -2.16 0.00 0.00 0.00 175.10 173.98 1h33 s PRO 230 N 1.69 1.61 0.77 2.72 0.04 -1.26 -4.92 135.00 135.65 1h33 s PRO 230 Ca 0.05 0.84 -0.12 0.00 0.04 0.00 0.00 61.00 61.82 1h33 s PRO 230 Cb -0.18 -1.85 0.05 0.00 0.04 0.00 0.00 34.50 32.56 1h33 s PRO 230 CO 0.10 -2.00 1.12 -0.06 0.04 0.00 0.00 177.00 176.19 1h33 s PHE 231 N -2.98 3.04 0.46 0.56 0.40 -1.26 -5.02 117.98 113.17 1h33 s PHE 231 Ca 0.62 1.00 -0.22 0.00 -0.60 0.00 0.00 56.93 57.73 1h33 s PHE 231 Cb -0.17 -3.20 -0.08 0.00 0.51 0.00 0.00 43.02 40.08 1h33 s PHE 231 CO 0.56 -1.58 1.09 0.00 0.70 0.00 0.00 175.22 176.00 1h33 s ALA 232 N -3.34 2.95 0.54 5.36 0.00 -1.26 -4.89 121.76 121.12 1h33 s ALA 232 Ca 0.60 0.77 -0.20 0.00 0.00 0.00 0.00 51.96 53.13 1h33 s ALA 232 Cb -0.12 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1h33 s ALA 232 CO 0.52 -0.45 1.18 0.14 0.00 0.00 0.00 175.76 177.15 1h33 s VAL 233 N -1.71 2.90 0.00 0.00 -7.23 -1.26 -1.69 120.40 111.40 1h33 s VAL 233 Ca 0.64 0.59 0.00 0.00 -1.81 0.00 0.00 61.98 61.40 1h33 s VAL 233 Cb -0.23 -3.26 0.00 0.00 0.56 0.00 0.00 36.38 33.45 1h33 s VAL 233 CO 0.28 -0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 1h33 n GLY 234 N 0.38 0.57 3.80 2.32 0.00 -1.26 -5.01 105.19 106.00 1h33 n GLY 234 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1h33 n GLY 234 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h33 s SER 235 N -2.49 4.89 0.46 1.61 1.04 -0.68 -4.80 113.70 113.72 1h33 s SER 235 Ca 0.00 1.53 0.11 0.00 0.48 0.00 0.00 55.95 58.07 1h33 s SER 235 Cb 0.00 -2.33 1.06 0.00 0.10 0.00 0.00 66.02 64.85 1h33 s SER 235 CO 0.00 -1.75 2.10 -0.65 0.98 0.00 0.00 173.24 173.93 1h33 h PRO 236 N -0.93 0.28 -0.28 4.02 0.11 -1.95 0.50 132.00 133.74 1h33 h PRO 236 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 1h33 h PRO 236 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1h33 h PRO 236 CO 0.57 0.18 -0.09 0.93 -0.21 0.00 0.00 178.00 179.39 1h33 h GLU 237 N 0.29 0.56 0.00 1.05 3.07 -1.92 -0.60 114.58 117.03 1h33 h GLU 237 Ca 0.08 -0.22 -0.11 0.00 -0.50 0.00 0.00 59.36 58.60 1h33 h GLU 237 Cb -0.03 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 1h33 h GLU 237 CO -0.02 0.77 -0.52 0.74 -1.40 0.00 0.00 179.01 178.58 1h33 h PHE 238 N 0.31 0.00 -0.34 4.33 0.05 -1.68 -0.19 116.94 119.43 1h33 h PHE 238 Ca 0.07 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.84 1h33 h PHE 238 Cb 0.58 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.51 1h33 h PHE 238 CO 0.05 0.52 0.13 0.28 -0.18 0.00 0.00 178.31 179.12 1h33 h VAL 239 N 0.00 1.19 -0.40 -0.55 2.07 -0.79 0.83 116.25 118.59 1h33 h VAL 239 Ca -0.01 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1h33 h VAL 239 Cb 1.17 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1h33 h VAL 239 CO 0.07 0.20 0.24 0.00 0.02 0.00 0.00 177.57 178.10 1h33 h ALA 240 N 0.98 0.51 -0.59 1.67 0.00 -1.03 -1.59 119.26 119.21 1h33 h ALA 240 Ca 0.11 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1h33 h ALA 240 Cb 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1h33 h ALA 240 CO -0.01 0.00 0.14 1.25 0.00 0.00 0.00 179.25 180.64 1h33 h LEU 241 N 0.53 0.86 -0.50 0.00 5.85 -0.94 -1.98 115.31 119.13 1h33 h LEU 241 Ca 0.14 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1h33 h LEU 241 Cb 0.00 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1h33 h LEU 241 CO -0.03 0.84 0.25 -0.08 -0.34 0.00 0.00 178.44 179.08 1h33 h GLU 242 N 0.88 0.71 -0.48 1.25 4.81 -0.51 0.17 114.58 121.41 1h33 h GLU 242 Ca 0.19 -0.10 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1h33 h GLU 242 Cb 0.32 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.52 1h33 h GLU 242 CO -0.00 0.58 0.22 1.25 -0.73 0.00 0.00 179.01 180.33 1h33 h LEU 243 N 0.66 0.29 -0.14 1.64 5.85 -1.04 0.17 115.31 122.74 1h33 h LEU 243 Ca 0.17 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1h33 h LEU 243 Cb 0.10 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1h33 h LEU 243 CO -0.02 0.21 -0.18 0.22 -0.34 0.00 0.00 178.44 178.33 1h33 h TYR 244 N 0.43 0.44 -0.62 1.25 3.20 -1.14 -1.71 116.97 118.82 1h33 h TYR 244 Ca 0.21 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 61.87 1h33 h TYR 244 Cb 0.16 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1h33 h TYR 244 CO -0.12 0.79 0.11 0.28 -1.64 0.00 0.00 178.16 177.57 1h33 h VAL 245 N -0.03 1.25 -0.89 1.81 2.07 -0.53 -1.57 116.25 118.37 1h33 h VAL 245 Ca 0.02 -0.98 0.12 0.00 0.82 0.00 0.00 66.70 66.68 1h33 h VAL 245 Cb 0.73 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 31.09 1h33 h VAL 245 CO 0.04 0.36 0.57 0.00 0.02 0.00 0.00 177.57 178.57 1h33 h ALA 246 N 1.16 1.72 0.00 1.67 0.00 -0.56 -1.43 119.26 121.82 1h33 h ALA 246 Ca 0.19 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1h33 h ALA 246 Cb 0.40 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1h33 h ALA 246 CO 0.01 0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.98 1h33 h SER 247 N 0.79 0.00 0.80 0.00 4.64 -0.34 -1.90 113.55 117.54 1h33 h SER 247 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1h33 h SER 247 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1h33 h SER 247 CO -0.19 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.31 1h33 n ARG 248 N -3.04 0.16 -0.21 4.77 1.74 -0.54 -2.66 116.66 116.89 1h33 n ARG 248 Ca 0.01 0.35 0.06 0.00 -0.77 0.00 0.00 57.85 57.50 1h33 n ARG 248 Cb 0.34 -1.78 0.16 0.00 -1.02 0.00 0.00 32.46 30.16 1h33 n ARG 248 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h33 n GLY 249 N 0.24 3.24 3.67 -0.13 0.00 -0.72 -4.83 105.19 106.67 1h33 n GLY 249 Ca 0.03 -0.53 -0.46 0.00 0.00 0.00 0.00 46.02 45.05 1h33 n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h33 n ASN 250 N -0.01 3.26 0.00 1.61 3.02 -1.09 -1.38 115.26 120.68 1h33 n ASN 250 Ca 0.13 1.04 0.00 0.00 -0.03 0.00 0.00 54.58 55.72 1h33 n ASN 250 Cb 0.53 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 1h33 n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h33 n GLY 251 N 3.76 3.07 3.80 7.41 0.00 -0.42 -4.66 105.19 118.15 1h33 n GLY 251 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1h33 n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h33 s LEU 252 N 0.00 3.55 0.45 0.99 1.43 -0.48 -4.72 118.68 119.90 1h33 s LEU 252 Ca 0.00 1.87 -0.22 0.00 -1.03 0.00 0.00 54.13 54.75 1h33 s LEU 252 Cb 0.00 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.59 1h33 s LEU 252 CO 0.00 -1.16 1.04 -0.44 0.23 0.00 0.00 176.35 176.01 1h33 s SER 253 N -2.61 6.52 0.19 2.29 0.01 -0.92 -0.55 113.70 118.64 1h33 s SER 253 Ca 0.65 1.95 -0.33 0.00 1.31 0.00 0.00 55.95 59.54 1h33 s SER 253 Cb -0.17 -2.57 -0.14 0.00 0.21 0.00 0.00 66.02 63.35 1h33 s SER 253 CO 0.35 -0.66 1.43 0.52 0.41 0.00 0.00 173.24 175.29 1h33 n VAL 254 N -0.63 0.56 -0.04 3.43 0.31 0.81 -4.75 118.33 118.02 1h33 n VAL 254 Ca 0.08 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1h33 n VAL 254 Cb 0.52 -1.37 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 1h33 n VAL 254 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1h33 n GLU 255 N 2.47 4.05 -2.35 5.55 2.13 -0.40 -1.38 120.64 130.72 1h33 n GLU 255 Ca 0.14 -0.04 -0.36 0.00 0.66 0.00 0.00 57.16 57.56 1h33 n GLU 255 Cb 0.29 -0.39 -0.02 0.00 0.27 0.00 0.00 31.44 31.59 1h33 n GLU 255 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1h33 s GLY 256 N -0.59 2.70 0.01 8.31 0.00 -1.24 -3.65 107.32 112.86 1h33 s GLY 256 Ca 0.00 0.82 -0.27 0.00 0.00 0.00 0.00 44.72 45.27 1h33 s GLY 256 CO 0.00 1.23 0.86 2.56 0.00 0.00 0.00 173.10 177.75 1h33 s PRO 257 N -2.88 4.53 0.60 2.90 0.04 -1.26 -3.02 135.00 135.92 1h33 s PRO 257 Ca 0.65 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1h33 s PRO 257 Cb -0.25 -3.42 0.06 0.00 0.04 0.00 0.00 34.50 30.93 1h33 s PRO 257 CO 0.29 0.09 0.85 -1.54 0.04 0.00 0.00 177.00 176.73 1h33 s SER 258 N 0.57 5.01 -0.14 6.66 1.04 -0.76 -4.84 113.70 121.24 1h33 s SER 258 Ca 0.44 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.80 1h33 s SER 258 Cb -0.20 -0.65 -0.01 0.00 0.10 0.00 0.00 66.02 65.25 1h33 s SER 258 CO 0.25 -1.36 -0.15 -0.69 0.98 0.00 0.00 173.24 172.27 1h33 s VAL 259 N -2.89 2.77 0.11 5.02 1.01 -1.26 -0.29 120.40 124.86 1h33 s VAL 259 Ca 0.60 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1h33 s VAL 259 Cb -0.09 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 1h33 s VAL 259 CO 0.40 0.52 -0.03 -0.13 0.00 0.00 0.00 175.10 175.87 1h33 s ARG 260 N 0.57 0.86 0.00 2.72 1.81 -0.65 -4.91 118.95 119.35 1h33 s ARG 260 Ca -0.09 -1.37 0.00 0.00 -1.72 0.00 0.00 55.73 52.55 1h33 s ARG 260 Cb -0.16 -0.09 0.00 0.00 -0.45 0.00 0.00 34.95 34.25 1h33 s ARG 260 CO 0.04 -0.09 0.17 0.27 -0.68 0.00 0.00 175.30 175.01