#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r17 s VAL 3 N 0.00 3.06 -0.14 1.96 1.01 -1.26 -1.13 120.40 123.90 2r17 s VAL 3 Ca 0.00 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 2r17 s VAL 3 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 2r17 s VAL 3 CO 0.00 0.53 0.31 -0.22 0.00 0.00 0.00 175.10 175.73 2r17 s LEU 4 N 0.19 4.27 -0.11 3.92 2.96 0.22 -4.22 118.68 125.91 2r17 s LEU 4 Ca -0.08 0.57 0.02 0.00 -0.22 0.00 0.00 54.13 54.43 2r17 s LEU 4 Cb -0.15 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.14 2r17 s LEU 4 CO 0.05 0.12 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.33 2r17 s VAL 5 N 0.30 1.66 0.36 1.68 1.01 0.31 0.16 120.40 125.88 2r17 s VAL 5 Ca 0.18 -0.75 -0.17 0.00 0.00 0.00 0.00 61.98 61.24 2r17 s VAL 5 Cb -0.13 -1.48 0.05 0.00 0.00 0.00 0.00 36.38 34.82 2r17 s VAL 5 CO 0.05 0.47 0.81 -1.48 0.00 0.00 0.00 175.10 174.95 2r17 s LEU 6 N 0.81 -0.02 0.00 3.92 0.05 -1.11 -0.94 118.68 121.39 2r17 s LEU 6 Ca -0.10 -1.07 0.00 0.00 0.05 0.00 0.00 54.13 53.02 2r17 s LEU 6 Cb -0.16 2.78 0.00 0.00 -2.05 0.00 0.00 46.19 46.77 2r17 s LEU 6 CO 0.01 -1.61 0.00 0.61 -0.55 0.00 0.00 176.35 174.81 2r17 n GLY 7 N -0.54 -2.22 3.82 -3.48 0.00 -1.26 -0.01 105.19 101.50 2r17 n GLY 7 Ca -0.08 -1.20 -0.24 0.00 0.00 0.00 0.00 46.02 44.50 2r17 n GLY 7 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2r17 n ASP 8 N 1.86 -1.25 -0.05 1.61 8.00 0.12 -2.55 116.55 124.29 2r17 n ASP 8 Ca 0.00 -0.88 -0.14 0.00 0.71 0.00 0.00 54.79 54.48 2r17 n ASP 8 Cb 0.00 -3.68 -0.08 0.00 -0.02 0.00 0.00 41.12 37.35 2r17 n ASP 8 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2r17 h LEU 9 N -1.87 0.41 -1.15 0.64 3.38 -1.61 -3.38 115.31 111.72 2r17 h LEU 9 Ca -0.61 -0.56 -0.33 0.00 0.09 0.00 0.00 57.88 56.47 2r17 h LEU 9 Cb 1.37 -0.12 0.13 0.00 0.09 0.00 0.00 40.66 42.13 2r17 h LEU 9 CO 0.60 0.90 -0.62 1.41 0.09 0.00 0.00 178.44 180.81 2r17 n HIS 10 N -4.47 -2.33 -3.71 1.13 8.25 0.11 -4.54 115.22 109.66 2r17 n HIS 10 Ca -0.07 0.87 -0.36 0.00 -0.26 0.00 0.00 57.72 57.90 2r17 n HIS 10 Cb 0.44 -4.61 -0.09 0.00 1.12 0.00 0.00 29.99 26.85 2r17 n HIS 10 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2r17 s ILE 11 N -3.29 5.31 -0.26 1.59 1.01 -0.89 -0.47 121.20 124.19 2r17 s ILE 11 Ca 0.34 0.16 0.13 0.00 0.00 0.00 0.00 60.65 61.28 2r17 s ILE 11 Cb -0.15 -3.45 0.81 0.00 0.01 0.00 0.00 42.46 39.67 2r17 s ILE 11 CO 0.64 0.38 1.75 -0.81 0.00 0.00 0.00 174.94 176.90 2r17 n PRO 12 N 4.01 4.72 -0.31 2.79 -0.04 -1.26 -3.49 135.00 141.43 2r17 n PRO 12 Ca -0.15 -3.12 -0.04 0.00 -0.04 0.00 0.00 63.50 60.15 2r17 n PRO 12 Cb 0.52 -2.26 0.07 0.00 -0.04 0.00 0.00 33.50 31.79 2r17 n PRO 12 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2r17 h HIS 13 N 3.78 1.12 0.00 0.54 3.86 -1.71 -3.38 115.15 119.37 2r17 h HIS 13 Ca 0.04 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2r17 h HIS 13 Cb 2.03 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 30.14 2r17 h HIS 13 CO 1.12 0.77 0.00 0.54 0.86 0.00 0.00 177.93 181.22 2r17 n ARG 14 N -4.41 1.75 -4.07 2.45 1.74 0.38 -5.09 116.66 109.40 2r17 n ARG 14 Ca 0.08 -0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.09 2r17 n ARG 14 Cb 0.08 -0.13 -0.10 0.00 -1.02 0.00 0.00 32.46 31.29 2r17 n ARG 14 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2r17 n ASN 16 N 0.10 1.74 -3.46 0.00 5.15 -1.26 -4.10 115.26 113.43 2r17 n ASN 16 Ca -0.14 0.04 -0.02 0.00 -0.60 0.00 0.00 54.58 53.86 2r17 n ASN 16 Cb 0.61 -0.40 0.02 0.00 -0.53 0.00 0.00 39.78 39.48 2r17 n ASN 16 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2r17 s SER 17 N -6.56 -0.00 0.62 1.20 1.04 -1.26 -4.94 113.70 103.79 2r17 s SER 17 Ca -0.26 -0.57 -0.14 0.00 0.48 0.00 0.00 55.95 55.46 2r17 s SER 17 Cb 0.08 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 2r17 s SER 17 CO 0.70 -0.84 1.05 -0.76 0.98 0.00 0.00 173.24 174.37 2r17 s LEU 18 N -3.47 3.39 0.58 2.42 1.43 -1.26 -4.85 118.68 116.92 2r17 s LEU 18 Ca 0.23 1.73 -0.20 0.00 -1.03 0.00 0.00 54.13 54.86 2r17 s LEU 18 Cb -0.02 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 2r17 s LEU 18 CO 0.04 -1.20 1.20 -2.65 0.23 0.00 0.00 176.35 173.97 2r17 n PRO 19 N -2.34 1.30 0.06 1.29 -0.02 -1.26 -4.77 135.00 129.26 2r17 n PRO 19 Ca 0.08 0.49 -0.14 0.00 -2.02 0.00 0.00 63.50 61.91 2r17 n PRO 19 Cb 0.53 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.52 2r17 n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r17 h ALA 20 N 0.96 -0.92 -0.92 3.55 0.00 -2.00 -1.75 119.26 118.19 2r17 h ALA 20 Ca -0.50 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 54.51 2r17 h ALA 20 Cb 1.33 0.90 -0.11 0.00 0.00 0.00 0.00 17.79 19.92 2r17 h ALA 20 CO 0.54 -1.06 0.49 0.87 0.00 0.00 0.00 179.25 180.10 2r17 h LYS 21 N -0.62 0.61 0.47 0.00 1.57 -1.96 -2.10 116.57 114.53 2r17 h LYS 21 Ca 0.01 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2r17 h LYS 21 Cb 0.66 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2r17 h LYS 21 CO -0.31 0.40 -0.22 0.74 -0.57 0.00 0.00 179.45 179.49 2r17 h PHE 22 N 0.63 -0.58 -0.21 -1.35 -1.00 -1.75 -1.47 116.94 111.21 2r17 h PHE 22 Ca 0.53 -0.01 0.06 0.00 2.81 0.00 0.00 57.97 61.36 2r17 h PHE 22 Cb 0.83 0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.58 2r17 h PHE 22 CO -0.07 -0.36 0.32 0.87 -1.61 0.00 0.00 178.31 177.47 2r17 h LYS 23 N -0.63 0.00 0.07 1.51 1.57 -0.71 0.18 116.57 118.57 2r17 h LYS 23 Ca -0.06 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.44 2r17 h LYS 23 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.81 2r17 h LYS 23 CO 0.10 0.00 -1.16 -0.22 -0.57 0.00 0.00 179.45 177.61 2r17 h LYS 24 N 0.00 0.60 -0.48 3.15 3.64 -0.75 -3.29 116.57 119.44 2r17 h LYS 24 Ca 0.10 -0.74 -0.10 0.00 -1.27 0.00 0.00 60.65 58.64 2r17 h LYS 24 Cb 0.75 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 2r17 h LYS 24 CO -0.00 1.32 -0.08 -0.07 -2.27 0.00 0.00 179.45 178.35 2r17 h LEU 25 N 0.29 0.90 -8.68 5.20 3.38 0.32 -3.40 115.31 113.34 2r17 h LEU 25 Ca -0.16 -0.35 -0.56 0.00 0.09 0.00 0.00 57.88 56.91 2r17 h LEU 25 Cb 1.82 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 42.27 2r17 h LEU 25 CO 0.22 1.04 1.07 -0.76 0.09 0.00 0.00 178.44 180.09 2r17 s LEU 26 N -9.27 3.50 -0.03 1.67 1.43 -0.63 -4.98 118.68 110.37 2r17 s LEU 26 Ca -0.12 0.50 0.07 0.00 -1.03 0.00 0.00 54.13 53.54 2r17 s LEU 26 Cb 0.12 -3.29 -0.02 0.00 0.03 0.00 0.00 46.19 43.03 2r17 s LEU 26 CO 0.84 -1.55 -0.24 0.68 0.23 0.00 0.00 176.35 176.30 2r17 s VAL 27 N 5.62 1.94 1.01 -1.59 -7.23 -1.26 -4.89 120.40 114.00 2r17 s VAL 27 Ca 0.55 -1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 59.57 2r17 s VAL 27 Cb -0.11 -1.62 0.18 0.00 0.56 0.00 0.00 36.38 35.39 2r17 s VAL 27 CO 0.29 0.55 0.96 -2.65 -0.31 0.00 0.00 175.10 173.94 2r17 n PRO 28 N 2.64 -1.14 0.00 4.82 -0.02 -1.26 -3.92 135.00 136.12 2r17 n PRO 28 Ca -0.16 -0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.03 2r17 n PRO 28 Cb 0.52 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2r17 n PRO 28 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r17 n GLY 29 N 0.73 2.33 0.07 -1.23 0.00 -1.26 -4.80 105.19 101.03 2r17 n GLY 29 Ca 0.08 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 2r17 n GLY 29 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2r17 h LYS 30 N 0.00 0.00 -6.18 1.61 3.64 -1.88 -3.46 116.57 110.30 2r17 h LYS 30 Ca 0.00 -0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.83 2r17 h LYS 30 Cb 0.00 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2r17 h LYS 30 CO 0.00 0.66 0.16 0.42 -2.27 0.00 0.00 179.45 178.42 2r17 s ILE 31 N -2.63 4.93 -0.09 2.00 1.01 -1.26 -4.73 121.20 120.42 2r17 s ILE 31 Ca -0.03 1.62 0.18 0.00 0.00 0.00 0.00 60.65 62.42 2r17 s ILE 31 Cb 0.09 -4.12 -0.27 0.00 0.01 0.00 0.00 42.46 38.17 2r17 s ILE 31 CO 0.82 0.26 0.27 0.00 0.00 0.00 0.00 174.94 176.29 2r17 n GLN 32 N 3.56 0.80 -3.88 2.79 6.02 -0.28 -4.66 117.38 121.73 2r17 n GLN 32 Ca -0.00 -0.10 -0.11 0.00 -0.01 0.00 0.00 57.00 56.77 2r17 n GLN 32 Cb 0.51 -1.46 -0.13 0.00 1.02 0.00 0.00 30.24 30.18 2r17 n GLN 32 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2r17 s HIS 33 N -2.94 0.02 -0.17 1.08 3.76 -0.93 -4.36 115.29 111.74 2r17 s HIS 33 Ca -0.08 -0.03 0.00 0.00 -0.15 0.00 0.00 55.06 54.81 2r17 s HIS 33 Cb 0.09 -0.03 0.04 0.00 1.11 0.00 0.00 32.58 33.79 2r17 s HIS 33 CO 0.77 -0.08 -0.09 0.42 -0.85 0.00 0.00 174.74 174.92 2r17 s ILE 34 N -0.37 1.42 -0.36 0.60 1.01 -0.57 0.70 121.20 123.62 2r17 s ILE 34 Ca -0.04 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 59.75 2r17 s ILE 34 Cb -0.03 -1.50 0.04 0.00 0.01 0.00 0.00 42.46 40.99 2r17 s ILE 34 CO -0.00 0.21 0.15 -0.76 0.00 0.00 0.00 174.94 174.54 2r17 s LEU 35 N 1.51 4.54 -0.21 2.97 1.43 0.12 -0.42 118.68 128.62 2r17 s LEU 35 Ca 0.01 -1.18 -0.10 0.00 -1.03 0.00 0.00 54.13 51.82 2r17 s LEU 35 Cb -0.15 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 2r17 s LEU 35 CO -0.08 -0.37 0.13 0.00 0.23 0.00 0.00 176.35 176.25 2r17 n THR 37 N 3.75 0.70 0.00 0.00 -1.04 0.98 -2.77 114.28 115.90 2r17 n THR 37 Ca -0.16 0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2r17 n THR 37 Cb 0.52 -0.90 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 2r17 n THR 37 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2r17 n GLY 38 N 0.51 1.78 1.72 3.41 0.00 -1.25 -3.97 105.19 107.39 2r17 n GLY 38 Ca 0.04 -1.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.04 2r17 n GLY 38 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2r17 n ASN 39 N 0.00 -2.49 0.05 1.61 3.02 -1.26 0.11 115.26 116.31 2r17 n ASN 39 Ca 0.00 -0.06 -0.14 0.00 -0.03 0.00 0.00 54.58 54.35 2r17 n ASN 39 Cb 0.00 -1.02 -0.04 0.00 -0.61 0.00 0.00 39.78 38.11 2r17 n ASN 39 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2r17 h LEU 40 N -0.31 0.62 0.00 3.41 3.38 -1.94 0.33 115.31 120.81 2r17 h LEU 40 Ca -0.07 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2r17 h LEU 40 Cb 1.04 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2r17 h LEU 40 CO 0.06 1.26 0.00 0.00 0.09 0.00 0.00 178.44 179.85 2r17 s THR 42 N 0.00 3.36 0.58 0.00 2.01 -1.23 -2.81 115.64 117.56 2r17 s THR 42 Ca 0.00 -1.93 0.31 0.00 0.31 0.00 0.00 61.69 60.38 2r17 s THR 42 Cb 0.00 -2.79 0.36 0.00 0.01 0.00 0.00 72.50 70.08 2r17 s THR 42 CO 0.00 -0.35 2.25 0.50 -0.69 0.00 0.00 174.62 176.33 2r17 h LYS 43 N 2.00 0.00 0.14 4.92 3.64 -1.93 -2.47 116.57 122.87 2r17 h LYS 43 Ca -0.44 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.96 2r17 h LYS 43 Cb 1.25 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.03 2r17 h LYS 43 CO 0.60 0.01 -0.28 1.49 -2.27 0.00 0.00 179.45 179.00 2r17 h GLU 44 N 0.00 -0.49 0.00 1.90 4.81 -1.95 -0.24 114.58 118.61 2r17 h GLU 44 Ca -0.00 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2r17 h GLU 44 Cb 0.03 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 2r17 h GLU 44 CO 0.00 -0.33 -0.01 0.77 -0.73 0.00 0.00 179.01 178.72 2r17 h SER 45 N -0.51 0.00 0.18 1.04 0.02 -1.76 -2.55 113.55 109.97 2r17 h SER 45 Ca 0.03 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2r17 h SER 45 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2r17 h SER 45 CO -0.15 0.01 -0.09 0.22 -1.14 0.00 0.00 176.83 175.67 2r17 h TYR 46 N 0.00 -0.23 -0.97 3.45 3.20 -1.06 -2.61 116.97 118.75 2r17 h TYR 46 Ca -0.00 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.03 2r17 h TYR 46 Cb 0.02 0.08 -0.09 0.00 1.54 0.00 0.00 36.73 38.27 2r17 h TYR 46 CO 0.00 0.19 0.61 -0.44 -1.64 0.00 0.00 178.16 176.88 2r17 h ASP 47 N -0.85 0.74 -0.53 -2.11 3.32 -0.90 0.90 116.42 116.99 2r17 h ASP 47 Ca -0.03 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2r17 h ASP 47 Cb 0.52 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 2r17 h ASP 47 CO 0.04 0.32 0.31 0.22 -1.72 0.00 0.00 179.24 178.41 2r17 h TYR 48 N 0.75 0.71 -0.28 4.55 5.03 -1.45 -2.15 116.97 124.12 2r17 h TYR 48 Ca 0.52 -0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.73 2r17 h TYR 48 Cb 0.82 -0.23 -0.01 0.00 1.55 0.00 0.00 36.73 38.85 2r17 h TYR 48 CO -0.00 0.50 -0.21 -0.07 -1.32 0.00 0.00 178.16 177.07 2r17 h LEU 49 N 0.72 0.52 -0.49 2.82 3.38 -0.63 -2.39 115.31 119.24 2r17 h LEU 49 Ca 0.19 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2r17 h LEU 49 Cb 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2r17 h LEU 49 CO -0.03 0.74 0.00 1.17 0.09 0.00 0.00 178.44 180.40 2r17 n LYS 50 N -4.14 0.10 0.03 1.13 3.00 0.12 -1.86 118.16 116.53 2r17 n LYS 50 Ca 0.00 0.41 0.09 0.00 -0.00 0.00 0.00 58.31 58.81 2r17 n LYS 50 Cb 0.38 -1.71 -0.10 0.00 0.00 0.00 0.00 35.03 33.59 2r17 n LYS 50 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2r17 n THR 51 N -1.90 0.40 0.40 3.15 -2.24 -0.91 -4.05 114.28 109.13 2r17 n THR 51 Ca 0.02 -0.56 0.13 0.00 -2.27 0.00 0.00 64.05 61.37 2r17 n THR 51 Cb 0.15 -0.21 0.29 0.00 -2.10 0.00 0.00 70.33 68.46 2r17 n THR 51 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2r17 h LEU 52 N 0.00 0.00 -7.34 3.22 3.38 -1.32 -3.43 115.31 109.82 2r17 h LEU 52 Ca -0.05 0.00 0.27 0.00 0.09 0.00 0.00 57.88 58.19 2r17 h LEU 52 Cb 1.13 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.77 2r17 h LEU 52 CO 0.01 0.00 0.70 0.00 0.09 0.00 0.00 178.44 179.24 2r17 s ALA 53 N -3.18 -2.02 -0.22 1.53 0.00 -1.17 -4.30 121.76 112.40 2r17 s ALA 53 Ca 0.08 0.59 -0.17 0.00 0.00 0.00 0.00 51.96 52.47 2r17 s ALA 53 Cb 0.08 0.42 -0.18 0.00 0.00 0.00 0.00 23.12 23.44 2r17 s ALA 53 CO 0.63 -1.00 0.08 0.41 0.00 0.00 0.00 175.76 175.88 2r17 n GLY 54 N -0.44 -0.69 3.54 0.00 0.00 -1.26 -4.47 105.19 101.86 2r17 n GLY 54 Ca -0.07 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2r17 n GLY 54 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2r17 s ASP 55 N -7.02 6.23 -0.20 1.61 2.15 -1.26 -4.98 116.67 113.20 2r17 s ASP 55 Ca -0.31 -0.42 0.01 0.00 0.43 0.00 0.00 52.55 52.26 2r17 s ASP 55 Cb 0.08 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 40.20 2r17 s ASP 55 CO 0.59 -1.66 -0.16 -0.69 -0.17 0.00 0.00 175.17 173.09 2r17 s VAL 56 N 5.17 2.25 -0.28 1.11 1.01 -1.26 -1.52 120.40 126.89 2r17 s VAL 56 Ca 0.34 -1.05 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 2r17 s VAL 56 Cb -0.10 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.25 2r17 s VAL 56 CO 0.17 0.39 0.04 -1.00 0.00 0.00 0.00 175.10 174.70 2r17 s HIS 57 N 1.27 3.11 -0.02 5.22 3.76 0.44 -5.00 115.29 124.07 2r17 s HIS 57 Ca 0.02 -1.04 0.08 0.00 -0.15 0.00 0.00 55.06 53.97 2r17 s HIS 57 Cb -0.15 -2.20 -0.02 0.00 1.11 0.00 0.00 32.58 31.32 2r17 s HIS 57 CO -0.10 -0.59 -0.25 0.42 -0.85 0.00 0.00 174.74 173.37 2r17 s ILE 58 N 1.47 2.01 0.13 0.60 1.01 -1.26 0.11 121.20 125.28 2r17 s ILE 58 Ca 0.03 -1.11 0.07 0.00 0.00 0.00 0.00 60.65 59.65 2r17 s ILE 58 Cb -0.17 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 2r17 s ILE 58 CO 0.01 0.55 -0.09 0.68 0.00 0.00 0.00 174.94 176.09 2r17 s VAL 59 N -0.61 3.38 -0.03 2.92 -7.23 -1.12 -4.20 120.40 113.51 2r17 s VAL 59 Ca 0.10 -1.36 -0.30 0.00 -1.81 0.00 0.00 61.98 58.61 2r17 s VAL 59 Cb -0.10 -2.61 -0.06 0.00 0.56 0.00 0.00 36.38 34.17 2r17 s VAL 59 CO -0.01 0.05 1.65 -0.60 -0.31 0.00 0.00 175.10 175.88 2r17 s ARG 60 N -2.41 4.19 0.67 4.82 3.52 0.52 -3.82 118.95 126.44 2r17 s ARG 60 Ca 0.23 2.21 -0.08 0.00 -0.13 0.00 0.00 55.73 57.96 2r17 s ARG 60 Cb -0.10 -3.93 0.03 0.00 -1.56 0.00 0.00 34.95 29.39 2r17 s ARG 60 CO 0.15 -0.82 1.00 0.20 -0.81 0.00 0.00 175.30 175.01 2r17 s GLY 61 N 3.21 1.63 0.21 8.12 0.00 -1.26 -4.53 107.32 114.71 2r17 s GLY 61 Ca 0.74 -0.69 0.20 0.00 0.00 0.00 0.00 44.72 44.96 2r17 s GLY 61 CO 0.30 -0.34 1.61 2.09 0.00 0.00 0.00 173.10 176.76 2r17 n ASP 62 N -2.83 0.49 -0.01 1.64 5.75 -1.26 -2.39 116.55 117.95 2r17 n ASP 62 Ca 0.06 0.65 0.01 0.00 -0.01 0.00 0.00 54.79 55.50 2r17 n ASP 62 Cb 0.59 -0.74 0.01 0.00 -1.03 0.00 0.00 41.12 39.94 2r17 n ASP 62 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2r17 n PHE 63 N -2.07 0.00 -2.27 2.11 3.72 -1.26 -5.05 117.46 112.63 2r17 n PHE 63 Ca 0.01 -0.52 -0.41 0.00 -0.05 0.00 0.00 57.45 56.49 2r17 n PHE 63 Cb 0.16 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 2r17 n PHE 63 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2r17 s ASP 64 N -1.10 6.98 -0.05 4.37 1.01 -1.00 -4.75 116.67 122.12 2r17 s ASP 64 Ca 0.02 2.42 -0.24 0.00 0.71 0.00 0.00 52.55 55.46 2r17 s ASP 64 Cb 0.02 -2.62 -0.25 0.00 1.01 0.00 0.00 42.92 41.08 2r17 s ASP 64 CO 0.00 -0.42 0.99 -0.33 0.21 0.00 0.00 175.17 175.63 2r17 h GLU 65 N 4.48 0.20 -5.81 8.23 5.08 -1.88 -3.42 114.58 121.46 2r17 h GLU 65 Ca -0.46 -0.23 -0.45 0.00 -1.00 0.00 0.00 59.36 57.22 2r17 h GLU 65 Cb 1.22 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 2r17 h GLU 65 CO 0.71 0.99 1.32 1.21 -1.00 0.00 0.00 179.01 182.25 2r17 s ASN 66 N -6.44 4.93 0.00 1.42 2.47 -1.26 -4.78 114.94 111.28 2r17 s ASN 66 Ca -0.16 0.46 0.00 0.00 0.42 0.00 0.00 52.86 53.59 2r17 s ASN 66 Cb 0.01 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.28 2r17 s ASN 66 CO 0.76 -2.64 0.63 -0.11 -3.72 0.00 0.00 177.10 172.01 2r17 n LEU 67 N 14.14 0.46 0.02 3.21 7.94 -1.26 -3.19 117.00 138.32 2r17 n LEU 67 Ca 0.28 -0.23 0.11 0.00 -1.11 0.00 0.00 56.01 55.06 2r17 n LEU 67 Cb 0.52 -0.23 -0.09 0.00 0.53 0.00 0.00 43.42 44.15 2r17 n LEU 67 CO 0.69 0.12 -0.34 0.59 -1.11 0.00 0.00 177.39 177.34 2r17 n ASN 68 N -0.19 0.44 -4.77 1.96 3.02 -1.26 -4.91 115.26 109.54 2r17 n ASN 68 Ca 0.00 -0.18 -0.36 0.00 -0.03 0.00 0.00 54.58 54.01 2r17 n ASN 68 Cb 0.12 1.31 0.01 0.00 -0.61 0.00 0.00 39.78 40.60 2r17 n ASN 68 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2r17 s TYR 69 N -3.32 2.61 0.49 3.10 2.02 -1.19 -4.99 117.35 116.06 2r17 s TYR 69 Ca -0.01 1.53 -0.19 0.00 -0.37 0.00 0.00 57.07 58.03 2r17 s TYR 69 Cb 0.14 -3.36 -0.09 0.00 -0.40 0.00 0.00 41.96 38.26 2r17 s TYR 69 CO 0.86 -1.76 1.00 -1.25 -1.57 0.00 0.00 175.55 172.83 2r17 s PRO 70 N -3.23 3.93 0.16 -1.71 0.04 -1.26 -4.29 135.00 128.64 2r17 s PRO 70 Ca 0.73 1.15 -0.16 0.00 0.04 0.00 0.00 61.00 62.76 2r17 s PRO 70 Cb -0.26 -2.13 0.05 0.00 0.04 0.00 0.00 34.50 32.20 2r17 s PRO 70 CO 0.30 -0.30 1.79 1.49 0.04 0.00 0.00 177.00 180.32 2r17 h GLU 71 N 1.36 0.43 -4.81 4.56 4.57 -1.94 0.15 114.58 118.90 2r17 h GLU 71 Ca -0.48 -0.03 -0.39 0.00 -1.18 0.00 0.00 59.36 57.28 2r17 h GLU 71 Cb 1.20 -0.10 -0.14 0.00 -0.16 0.00 0.00 28.75 29.55 2r17 h GLU 71 CO 0.60 0.29 -0.54 1.14 -1.18 0.00 0.00 179.01 179.31 2r17 s GLN 72 N -6.15 1.57 -0.15 1.92 0.00 -1.26 -4.12 119.66 111.47 2r17 s GLN 72 Ca -0.13 -1.89 -0.30 0.00 -0.00 0.00 0.00 55.36 53.04 2r17 s GLN 72 Cb 0.12 0.19 0.12 0.00 0.00 0.00 0.00 33.01 33.44 2r17 s GLN 72 CO 0.72 -0.53 0.97 0.21 0.00 0.00 0.00 175.29 176.66 2r17 s LYS 73 N -3.74 0.64 -0.17 9.60 2.20 -0.04 -4.99 119.74 123.24 2r17 s LYS 73 Ca 0.39 0.13 -0.00 0.00 -0.36 0.00 0.00 55.97 56.13 2r17 s LYS 73 Cb 0.04 0.30 0.04 0.00 -1.51 0.00 0.00 37.83 36.70 2r17 s LYS 73 CO 0.21 -0.20 -0.05 0.14 -0.36 0.00 0.00 175.35 175.08 2r17 s VAL 74 N -1.20 1.11 -0.00 4.02 -7.23 -1.26 0.32 120.40 116.15 2r17 s VAL 74 Ca -0.02 -0.64 0.05 0.00 -1.81 0.00 0.00 61.98 59.57 2r17 s VAL 74 Cb -0.00 -1.29 -0.03 0.00 0.56 0.00 0.00 36.38 35.62 2r17 s VAL 74 CO 0.02 0.12 -0.16 0.54 -0.31 0.00 0.00 175.10 175.31 2r17 s VAL 75 N 1.63 2.91 -0.20 1.32 0.11 -0.52 -4.94 120.40 120.71 2r17 s VAL 75 Ca 0.01 -0.96 -0.06 0.00 -2.93 0.00 0.00 61.98 58.04 2r17 s VAL 75 Cb -0.15 -2.18 -0.03 0.00 -1.53 0.00 0.00 36.38 32.49 2r17 s VAL 75 CO -0.08 0.46 0.03 0.28 -3.33 0.00 0.00 175.10 172.46 2r17 s THR 76 N -0.83 4.26 -0.18 5.04 -1.32 -1.26 -1.22 115.64 120.13 2r17 s THR 76 Ca 0.13 -0.21 -0.02 0.00 -1.21 0.00 0.00 61.69 60.38 2r17 s THR 76 Cb -0.11 -2.93 0.05 0.00 -1.51 0.00 0.00 72.50 68.01 2r17 s THR 76 CO 0.03 0.43 0.00 -0.69 -2.21 0.00 0.00 174.62 172.18 2r17 s VAL 77 N 0.82 0.74 0.00 5.08 1.01 -0.53 -5.01 120.40 122.51 2r17 s VAL 77 Ca 0.02 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2r17 s VAL 77 Cb -0.14 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.13 2r17 s VAL 77 CO 0.02 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.66 2r17 n GLY 78 N 4.98 1.27 0.33 4.51 0.00 -1.26 -2.02 105.19 113.00 2r17 n GLY 78 Ca -0.10 -0.70 0.01 0.00 0.00 0.00 0.00 46.02 45.23 2r17 n GLY 78 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2r17 n GLN 79 N 8.22 1.31 -4.34 1.61 6.02 -1.26 -4.83 117.38 124.10 2r17 n GLN 79 Ca 0.00 -0.36 -0.34 0.00 -0.01 0.00 0.00 57.00 56.29 2r17 n GLN 79 Cb 0.00 -1.24 -0.11 0.00 1.02 0.00 0.00 30.24 29.91 2r17 n GLN 79 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2r17 s PHE 80 N -1.67 3.09 -0.40 1.08 0.08 -0.85 -4.89 117.98 114.41 2r17 s PHE 80 Ca 0.07 -0.11 -0.11 0.00 0.12 0.00 0.00 56.93 56.89 2r17 s PHE 80 Cb 0.04 -1.93 0.04 0.00 -0.57 0.00 0.00 43.02 40.61 2r17 s PHE 80 CO 0.04 0.12 0.25 0.15 -0.10 0.00 0.00 175.22 175.68 2r17 s LYS 81 N 0.04 2.79 -0.16 0.44 1.02 -1.26 -1.46 119.74 121.15 2r17 s LYS 81 Ca 0.02 -1.20 -0.07 0.00 0.02 0.00 0.00 55.97 54.73 2r17 s LYS 81 Cb -0.13 -3.81 -0.04 0.00 -0.52 0.00 0.00 37.83 33.33 2r17 s LYS 81 CO 0.02 -0.81 0.08 0.42 -0.92 0.00 0.00 175.35 174.15 2r17 s ILE 82 N 1.54 4.99 -0.11 2.17 1.01 -0.36 -0.50 121.20 129.94 2r17 s ILE 82 Ca 0.03 0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 2r17 s ILE 82 Cb -0.21 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 2r17 s ILE 82 CO 0.06 0.51 0.28 -0.83 0.00 0.00 0.00 174.94 174.96 2r17 s GLY 83 N -0.11 2.26 -0.09 6.18 0.00 0.80 -1.44 107.32 114.91 2r17 s GLY 83 Ca 0.08 -0.44 0.01 0.00 0.00 0.00 0.00 44.72 44.37 2r17 s GLY 83 CO 0.01 0.15 -0.12 -2.27 0.00 0.00 0.00 173.10 170.87 2r17 s LEU 84 N -0.31 1.53 -0.07 0.66 0.20 0.15 0.54 118.68 121.39 2r17 s LEU 84 Ca 0.18 -0.34 -0.12 0.00 0.69 0.00 0.00 54.13 54.53 2r17 s LEU 84 Cb -0.14 -0.91 0.03 0.00 -0.43 0.00 0.00 46.19 44.74 2r17 s LEU 84 CO 0.06 -0.02 0.30 -0.51 -0.29 0.00 0.00 176.35 175.90 2r17 s ILE 85 N 1.09 0.03 0.13 6.68 1.10 -0.94 -0.86 121.20 128.42 2r17 s ILE 85 Ca -0.06 -0.25 -0.17 0.00 -0.51 0.00 0.00 60.65 59.65 2r17 s ILE 85 Cb -0.14 -0.52 -0.03 0.00 0.15 0.00 0.00 42.46 41.92 2r17 s ILE 85 CO -0.02 -0.14 1.72 -0.74 -2.11 0.00 0.00 174.94 173.66 2r17 h HIS 86 N 4.78 0.46 0.00 3.50 -0.00 -1.72 -3.31 115.15 118.86 2r17 h HIS 86 Ca -0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.08 2r17 h HIS 86 Cb 1.18 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.45 2r17 h HIS 86 CO 0.47 0.37 0.00 0.41 -0.00 0.00 0.00 177.93 179.18 2r17 n GLY 87 N -0.94 1.18 0.00 5.26 0.00 -1.26 -0.15 105.19 109.28 2r17 n GLY 87 Ca -0.01 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.94 2r17 n GLY 87 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2r17 n HIS 88 N 0.00 0.00 0.07 1.61 1.44 -1.26 -1.56 115.22 115.52 2r17 n HIS 88 Ca 0.00 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.74 2r17 n HIS 88 Cb 0.00 -0.38 -0.04 0.00 0.12 0.00 0.00 29.99 29.69 2r17 n HIS 88 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 2r17 h GLN 89 N 0.00 0.00 -6.20 -1.40 7.50 -1.98 -3.45 115.11 109.58 2r17 h GLN 89 Ca 0.00 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 2r17 h GLN 89 Cb 0.12 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.61 2r17 h GLN 89 CO 0.00 0.26 0.72 0.08 -1.50 0.00 0.00 178.83 178.39 2r17 s VAL 90 N -3.03 4.55 -0.09 -0.54 1.01 -0.60 -5.01 120.40 116.68 2r17 s VAL 90 Ca -0.01 1.85 0.02 0.00 0.00 0.00 0.00 61.98 63.84 2r17 s VAL 90 Cb 0.09 -4.19 0.01 0.00 0.00 0.00 0.00 36.38 32.29 2r17 s VAL 90 CO 0.79 -0.07 -0.16 -0.63 0.00 0.00 0.00 175.10 175.03 2r17 s ILE 91 N 2.65 1.47 0.51 2.22 -1.09 -1.26 -2.33 121.20 123.36 2r17 s ILE 91 Ca 0.50 -0.64 -0.20 0.00 -2.23 0.00 0.00 60.65 58.07 2r17 s ILE 91 Cb -0.19 -1.33 -0.07 0.00 -1.58 0.00 0.00 42.46 39.29 2r17 s ILE 91 CO 0.15 0.43 1.09 -2.84 -1.23 0.00 0.00 174.94 172.54 2r17 s PRO 92 N 0.80 3.60 0.12 2.79 0.02 -1.26 -4.85 135.00 136.21 2r17 s PRO 92 Ca -0.11 1.51 -0.34 0.00 0.02 0.00 0.00 61.00 62.08 2r17 s PRO 92 Cb -0.16 -2.09 -0.14 0.00 0.02 0.00 0.00 34.50 32.14 2r17 s PRO 92 CO 0.02 -0.63 1.62 0.91 -0.33 0.00 0.00 177.00 178.59 2r17 n TRP 93 N -1.06 2.26 0.00 6.54 8.01 -0.99 -1.34 117.44 130.86 2r17 n TRP 93 Ca 0.10 0.24 0.00 0.00 -1.31 0.00 0.00 57.50 56.53 2r17 n TRP 93 Cb 0.51 -2.56 0.00 0.00 -2.01 0.00 0.00 31.31 27.26 2r17 n TRP 93 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2r17 n GLY 94 N 3.55 2.74 0.93 6.99 0.00 -1.26 -5.08 105.19 113.05 2r17 n GLY 94 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 2r17 n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2r17 n ASP 95 N 0.58 -1.00 0.00 1.61 -0.08 -0.45 -4.88 116.55 112.34 2r17 n ASP 95 Ca 0.00 -0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.23 2r17 n ASP 95 Cb 0.00 -0.19 0.00 0.00 2.34 0.00 0.00 41.12 43.27 2r17 n ASP 95 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2r17 n ALA 97 N -1.48 0.00 -0.11 -1.67 0.00 -1.26 -1.70 120.51 114.30 2r17 n ALA 97 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 2r17 n ALA 97 Cb 0.03 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.55 2r17 n ALA 97 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2r17 h SER 98 N 0.00 0.86 -0.34 0.00 0.02 -1.90 0.06 113.55 112.25 2r17 h SER 98 Ca 0.00 -0.31 -0.09 0.00 -0.84 0.00 0.00 61.79 60.55 2r17 h SER 98 Cb 0.00 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2r17 h SER 98 CO 0.00 1.05 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.54 2r17 h LEU 99 N 0.73 0.70 -0.15 5.07 3.38 -1.67 -2.29 115.31 121.09 2r17 h LEU 99 Ca 0.10 -0.39 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2r17 h LEU 99 Cb 0.75 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 2r17 h LEU 99 CO 0.06 0.93 -0.21 0.00 0.09 0.00 0.00 178.44 179.31 2r17 h ALA 100 N 0.79 -0.15 -0.79 1.53 0.00 -1.77 0.12 119.26 118.99 2r17 h ALA 100 Ca 0.08 0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.17 2r17 h ALA 100 Cb 0.65 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.77 2r17 h ALA 100 CO 0.04 -0.66 0.38 1.25 0.00 0.00 0.00 179.25 180.26 2r17 h LEU 101 N -0.26 0.44 -1.01 0.00 5.85 -0.86 0.85 115.31 120.32 2r17 h LEU 101 Ca 0.10 0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.82 2r17 h LEU 101 Cb 0.41 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2r17 h LEU 101 CO -0.30 0.20 -0.33 0.25 -0.34 0.00 0.00 178.44 177.92 2r17 h LEU 102 N 0.57 0.29 0.08 2.25 5.85 -0.70 -2.96 115.31 120.68 2r17 h LEU 102 Ca 0.42 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 2r17 h LEU 102 Cb 0.57 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.52 2r17 h LEU 102 CO -0.35 0.62 -0.04 -0.61 -0.34 0.00 0.00 178.44 177.72 2r17 h GLN 103 N 0.25 -0.10 -0.97 1.25 -0.00 0.16 -1.46 115.11 114.23 2r17 h GLN 103 Ca 0.03 0.01 0.18 0.00 -0.00 0.00 0.00 58.65 58.87 2r17 h GLN 103 Cb 0.71 0.02 -0.11 0.00 0.00 0.00 0.00 27.48 28.11 2r17 h GLN 103 CO 0.05 -0.00 0.57 0.00 0.00 0.00 0.00 178.83 179.45 2r17 h ARG 104 N -0.18 0.70 -0.09 1.69 3.08 -1.08 0.27 114.38 118.77 2r17 h ARG 104 Ca -0.01 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 2r17 h ARG 104 Cb 0.15 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 2r17 h ARG 104 CO 0.02 0.46 -0.08 0.37 -1.07 0.00 0.00 179.97 179.67 2r17 h GLN 105 N 0.72 0.21 -0.11 0.04 4.15 -1.34 -3.27 115.11 115.51 2r17 h GLN 105 Ca 0.56 -0.11 -0.11 0.00 0.77 0.00 0.00 58.65 59.75 2r17 h GLN 105 Cb 0.85 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 2r17 h GLN 105 CO -0.39 0.63 -0.44 0.74 -1.93 0.00 0.00 178.83 177.44 2r17 h PHE 106 N -0.19 0.29 -4.58 3.99 -1.00 -0.59 -3.48 116.94 111.38 2r17 h PHE 106 Ca 0.02 -0.09 -0.23 0.00 2.81 0.00 0.00 57.97 60.48 2r17 h PHE 106 Cb 0.58 -0.06 0.12 0.00 3.61 0.00 0.00 35.95 40.20 2r17 h PHE 106 CO 0.09 0.65 -0.55 -3.47 -1.61 0.00 0.00 178.31 173.42 2r17 n ASP 107 N -4.00 -2.05 -4.73 2.17 2.03 0.89 -5.03 116.55 105.84 2r17 n ASP 107 Ca -0.02 -0.44 -0.22 0.00 0.52 0.00 0.00 54.79 54.63 2r17 n ASP 107 Cb 0.50 -3.78 -0.06 0.00 -0.72 0.00 0.00 41.12 37.07 2r17 n ASP 107 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2r17 s VAL 108 N -3.25 3.90 -0.07 5.18 -7.23 -1.25 -4.97 120.40 112.70 2r17 s VAL 108 Ca 0.00 -1.67 -0.17 0.00 -1.81 0.00 0.00 61.98 58.33 2r17 s VAL 108 Cb -0.00 -3.11 -0.30 0.00 0.56 0.00 0.00 36.38 33.54 2r17 s VAL 108 CO 0.52 -0.36 0.70 0.44 -0.31 0.00 0.00 175.10 176.09 2r17 h ASP 109 N 1.69 0.49 -3.85 4.85 3.32 -1.16 -3.46 116.42 118.30 2r17 h ASP 109 Ca -0.46 -0.90 -0.57 0.00 0.02 0.00 0.00 57.03 55.12 2r17 h ASP 109 Cb 1.24 -0.16 -0.31 0.00 0.22 0.00 0.00 39.33 40.32 2r17 h ASP 109 CO 0.61 1.60 -0.84 -0.63 -1.72 0.00 0.00 179.24 178.25 2r17 s ILE 110 N -2.49 1.46 -0.31 0.35 1.01 -1.15 -0.92 121.20 119.15 2r17 s ILE 110 Ca -0.17 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.74 2r17 s ILE 110 Cb 0.04 -1.26 0.06 0.00 0.01 0.00 0.00 42.46 41.30 2r17 s ILE 110 CO 0.81 0.42 0.02 -0.22 0.00 0.00 0.00 174.94 175.98 2r17 s LEU 111 N 0.08 4.09 -0.14 2.97 2.96 0.92 -0.14 118.68 129.42 2r17 s LEU 111 Ca -0.05 -1.41 -0.20 0.00 -0.22 0.00 0.00 54.13 52.25 2r17 s LEU 111 Cb -0.12 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2r17 s LEU 111 CO 0.03 -0.30 0.58 -0.63 -1.32 0.00 0.00 176.35 174.70 2r17 s ILE 112 N 1.22 5.10 0.11 6.68 -1.09 0.19 -1.46 121.20 131.94 2r17 s ILE 112 Ca -0.03 1.14 -0.05 0.00 -2.23 0.00 0.00 60.65 59.47 2r17 s ILE 112 Cb -0.20 -3.91 -0.02 0.00 -1.58 0.00 0.00 42.46 36.75 2r17 s ILE 112 CO -0.02 0.23 0.13 -0.55 -1.23 0.00 0.00 174.94 173.51 2r17 s SER 113 N 0.88 0.23 0.00 3.58 0.15 0.52 -2.22 113.70 116.84 2r17 s SER 113 Ca 0.29 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2r17 s SER 113 Cb -0.16 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.47 2r17 s SER 113 CO 0.12 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.43 2r17 n GLY 114 N -0.06 4.98 4.25 9.45 0.00 0.79 -3.89 105.19 120.70 2r17 n GLY 114 Ca -0.11 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2r17 n GLY 114 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2r17 n HIS 115 N 0.00 0.00 0.19 1.61 -0.00 -1.11 -4.52 115.22 111.39 2r17 n HIS 115 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 57.78 2r17 n HIS 115 Cb 0.00 0.00 0.35 0.00 -0.00 0.00 0.00 29.99 30.34 2r17 n HIS 115 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.34 177.49 2r17 h THR 116 N 0.00 0.84 0.00 3.57 2.02 -1.93 -3.47 112.91 113.94 2r17 h THR 116 Ca 0.00 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.71 2r17 h THR 116 Cb 0.00 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2r17 h THR 116 CO 0.00 0.35 0.00 1.41 0.37 0.00 0.00 175.52 177.65 2r17 n HIS 117 N -3.51 0.00 -4.23 3.16 -0.00 -1.26 -4.90 115.22 104.47 2r17 n HIS 117 Ca -0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.40 2r17 n HIS 117 Cb 0.50 -1.42 -0.16 0.00 -0.00 0.00 0.00 29.99 28.90 2r17 n HIS 117 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 2r17 s LYS 118 N -1.39 2.82 0.33 -0.41 2.20 -1.26 -4.00 119.74 118.02 2r17 s LYS 118 Ca 0.00 -0.77 -0.28 0.00 -0.36 0.00 0.00 55.97 54.56 2r17 s LYS 118 Cb 0.00 -2.41 -0.10 0.00 -1.51 0.00 0.00 37.83 33.81 2r17 s LYS 118 CO 0.00 -0.17 1.22 0.12 -0.36 0.00 0.00 175.35 176.16 2r17 s PHE 119 N 1.22 3.19 -0.08 4.03 2.19 -1.26 -4.46 117.98 122.81 2r17 s PHE 119 Ca 0.02 1.52 -0.14 0.00 0.33 0.00 0.00 56.93 58.66 2r17 s PHE 119 Cb -0.14 -3.51 0.03 0.00 -1.31 0.00 0.00 43.02 38.10 2r17 s PHE 119 CO -0.10 -1.39 0.35 -1.21 1.83 0.00 0.00 175.22 174.70 2r17 s GLU 120 N -1.82 0.54 -0.29 10.12 2.02 -0.14 -4.96 118.70 124.17 2r17 s GLU 120 Ca 0.50 0.21 0.04 0.00 0.02 0.00 0.00 54.97 55.74 2r17 s GLU 120 Cb -0.36 0.25 0.18 0.00 0.10 0.00 0.00 34.13 34.30 2r17 s GLU 120 CO 0.46 -0.11 0.49 0.00 0.02 0.00 0.00 175.26 176.12 2r17 s ALA 121 N -0.46 -1.73 0.23 5.21 0.00 -1.26 0.58 121.76 124.33 2r17 s ALA 121 Ca -0.06 0.58 -0.03 0.00 0.00 0.00 0.00 51.96 52.46 2r17 s ALA 121 Cb -0.04 -2.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 2r17 s ALA 121 CO 0.02 -1.79 0.24 -0.59 0.00 0.00 0.00 175.76 173.64 2r17 s PHE 122 N 2.67 1.04 -0.11 0.00 -0.71 -1.01 -5.00 117.98 114.85 2r17 s PHE 122 Ca 0.10 -1.26 0.00 0.00 -1.04 0.00 0.00 56.93 54.73 2r17 s PHE 122 Cb -0.11 -0.38 -0.02 0.00 -1.21 0.00 0.00 43.02 41.29 2r17 s PHE 122 CO -0.28 -0.77 -0.11 -2.00 -1.34 0.00 0.00 175.22 170.72 2r17 s GLU 123 N -4.00 3.17 -0.03 1.99 2.12 -1.26 -1.65 118.70 119.05 2r17 s GLU 123 Ca 0.35 -0.64 -0.00 0.00 0.36 0.00 0.00 54.97 55.04 2r17 s GLU 123 Cb 0.04 -2.63 0.03 0.00 0.26 0.00 0.00 34.13 31.84 2r17 s GLU 123 CO 0.13 0.37 0.05 -1.58 -0.54 0.00 0.00 175.26 173.69 2r17 s HIS 124 N -0.03 -0.00 -1.64 5.30 2.46 -0.66 -4.87 115.29 115.85 2r17 s HIS 124 Ca -0.02 0.19 -0.09 0.00 0.47 0.00 0.00 55.06 55.61 2r17 s HIS 124 Cb -0.14 -0.22 0.09 0.00 -0.13 0.00 0.00 32.58 32.18 2r17 s HIS 124 CO 0.04 -0.10 0.33 0.39 -2.47 0.00 0.00 174.74 172.93 2r17 n GLU 125 N 4.20 -1.56 -1.18 2.88 1.02 -1.26 -0.96 120.64 123.78 2r17 n GLU 125 Ca -0.28 0.19 -0.06 0.00 -0.02 0.00 0.00 57.16 56.99 2r17 n GLU 125 Cb 0.50 -4.24 -0.03 0.00 -0.02 0.00 0.00 31.44 27.65 2r17 n GLU 125 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2r17 n ASN 126 N -2.76 -4.27 -4.40 1.62 3.02 -1.26 -5.02 115.26 102.19 2r17 n ASN 126 Ca -0.15 0.16 -0.25 0.00 -0.03 0.00 0.00 54.58 54.31 2r17 n ASN 126 Cb 0.60 -2.33 -0.11 0.00 -0.61 0.00 0.00 39.78 37.33 2r17 n ASN 126 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2r17 s LYS 127 N -2.15 1.46 -0.21 3.52 -0.14 -0.13 -4.74 119.74 117.36 2r17 s LYS 127 Ca 0.00 -1.53 -0.06 0.00 -1.36 0.00 0.00 55.97 53.02 2r17 s LYS 127 Cb 0.00 -1.65 -0.03 0.00 -1.68 0.00 0.00 37.83 34.47 2r17 s LYS 127 CO 0.00 0.34 0.02 0.12 -0.76 0.00 0.00 175.35 175.07 2r17 s PHE 128 N -1.97 3.07 -0.04 3.18 5.36 -0.09 -1.66 117.98 125.82 2r17 s PHE 128 Ca 0.21 -0.38 0.01 0.00 -0.96 0.00 0.00 56.93 55.80 2r17 s PHE 128 Cb -0.07 -2.11 -0.03 0.00 -0.34 0.00 0.00 43.02 40.47 2r17 s PHE 128 CO 0.10 -0.21 -0.04 0.71 -1.46 0.00 0.00 175.22 174.32 2r17 s TYR 129 N 1.02 3.01 -0.03 10.12 2.02 -0.66 -0.06 117.35 132.78 2r17 s TYR 129 Ca 0.02 0.06 -0.01 0.00 -0.37 0.00 0.00 57.07 56.77 2r17 s TYR 129 Cb -0.14 -1.70 0.02 0.00 -0.40 0.00 0.00 41.96 39.74 2r17 s TYR 129 CO 0.02 0.40 0.06 0.42 -1.57 0.00 0.00 175.55 174.88 2r17 s ILE 130 N -0.92 -0.03 -0.25 2.71 -1.09 -0.53 -2.42 121.20 118.67 2r17 s ILE 130 Ca 0.15 0.10 -0.02 0.00 -2.23 0.00 0.00 60.65 58.64 2r17 s ILE 130 Cb -0.11 -0.11 0.08 0.00 -1.58 0.00 0.00 42.46 40.74 2r17 s ILE 130 CO 0.05 0.04 0.07 0.21 -1.23 0.00 0.00 174.94 174.08 2r17 s ASN 131 N 0.54 3.39 0.00 3.58 3.84 0.20 -0.35 114.94 126.14 2r17 s ASN 131 Ca -0.04 -1.18 0.14 0.00 0.21 0.00 0.00 52.86 51.99 2r17 s ASN 131 Cb -0.06 -0.64 0.63 0.00 -0.55 0.00 0.00 41.25 40.63 2r17 s ASN 131 CO -0.02 -0.37 1.43 -0.81 -2.79 0.00 0.00 177.10 174.54 2r17 n PRO 132 N 5.02 0.06 0.00 0.43 -0.04 -1.26 -0.97 135.00 138.24 2r17 n PRO 132 Ca -0.06 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 2r17 n PRO 132 Cb 0.45 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2r17 n PRO 132 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r17 n GLY 133 N -0.07 -1.75 3.63 0.55 0.00 -1.26 -3.41 105.19 102.88 2r17 n GLY 133 Ca 0.04 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 2r17 n GLY 133 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r17 s SER 134 N -4.00 6.14 0.00 1.61 0.15 -1.25 -4.14 113.70 112.21 2r17 s SER 134 Ca 0.00 0.14 0.08 0.00 0.70 0.00 0.00 55.95 56.87 2r17 s SER 134 Cb 0.00 -2.14 0.49 0.00 -1.71 0.00 0.00 66.02 62.65 2r17 s SER 134 CO 0.00 -0.04 0.90 0.00 1.20 0.00 0.00 173.24 175.30 2r17 n ALA 135 N 4.78 1.93 -0.45 5.45 0.00 -1.06 -1.13 120.51 130.02 2r17 n ALA 135 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2r17 n ALA 135 Cb 0.52 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.83 2r17 n ALA 135 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2r17 n THR 136 N -0.84 0.27 -2.96 0.00 -2.24 -1.26 -4.29 114.28 102.97 2r17 n THR 136 Ca 0.06 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.21 2r17 n THR 136 Cb 0.03 1.09 0.03 0.00 -2.10 0.00 0.00 70.33 69.38 2r17 n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2r17 n GLY 137 N -0.14 -0.50 3.67 3.38 0.00 -0.52 -4.81 105.19 106.28 2r17 n GLY 137 Ca 0.00 0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2r17 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r17 n ALA 138 N -3.41 0.88 -1.57 4.61 0.00 -1.26 -4.82 120.51 114.95 2r17 n ALA 138 Ca -0.12 0.29 -0.39 0.00 0.00 0.00 0.00 53.44 53.21 2r17 n ALA 138 Cb 0.63 -2.20 0.03 0.00 0.00 0.00 0.00 19.45 17.91 2r17 n ALA 138 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2r17 n TYR 139 N -0.11 0.47 -3.64 0.00 4.19 -1.26 -4.94 117.16 111.87 2r17 n TYR 139 Ca 0.07 0.48 -0.07 0.00 3.31 0.00 0.00 57.90 61.69 2r17 n TYR 139 Cb 0.38 -2.11 -0.09 0.00 0.49 0.00 0.00 39.34 38.01 2r17 n TYR 139 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 2r17 s ASN 140 N -1.05 -0.37 0.64 2.98 3.84 -1.26 -5.04 114.94 114.68 2r17 s ASN 140 Ca 0.69 1.05 0.28 0.00 0.21 0.00 0.00 52.86 55.09 2r17 s ASN 140 Cb -0.48 1.48 1.48 0.00 -0.55 0.00 0.00 41.25 43.19 2r17 s ASN 140 CO 0.53 -0.23 1.86 0.00 -2.79 0.00 0.00 177.10 176.46 2r17 h ALA 141 N 8.15 1.67 0.00 1.71 0.00 -1.99 -2.18 119.26 126.61 2r17 h ALA 141 Ca -0.16 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 2r17 h ALA 141 Cb 1.11 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2r17 h ALA 141 CO 0.12 -0.51 -1.80 1.28 0.00 0.00 0.00 179.25 178.34 2r17 n LEU 142 N -3.15 0.27 -4.11 0.00 4.77 -1.26 -4.85 117.00 108.67 2r17 n LEU 142 Ca 0.02 0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.78 2r17 n LEU 142 Cb 0.52 0.08 -0.15 0.00 -2.33 0.00 0.00 43.42 41.54 2r17 n LEU 142 CO 0.18 0.07 -0.47 -0.70 -1.33 0.00 0.00 177.39 175.13 2r17 s GLU 143 N -3.24 2.59 0.06 3.23 2.56 -0.82 -5.02 118.70 118.06 2r17 s GLU 143 Ca -0.06 -1.12 -0.21 0.00 0.00 0.00 0.00 54.97 53.58 2r17 s GLU 143 Cb 0.11 -2.81 -0.11 0.00 2.00 0.00 0.00 34.13 33.32 2r17 s GLU 143 CO 0.86 -0.43 1.50 0.00 -0.56 0.00 0.00 175.26 176.64 2r17 h THR 144 N 6.39 1.25 -3.28 -1.70 1.03 -1.89 -3.40 112.91 111.31 2r17 h THR 144 Ca -0.30 -0.83 -0.75 0.00 -0.01 0.00 0.00 66.41 64.52 2r17 h THR 144 Cb 1.08 1.47 -0.27 0.00 -1.07 0.00 0.00 68.15 69.37 2r17 h THR 144 CO 0.54 0.25 -0.27 0.21 -0.01 0.00 0.00 175.52 176.24 2r17 s ASN 145 N -5.79 6.00 -0.27 0.00 2.47 -1.26 -5.03 114.94 111.07 2r17 s ASN 145 Ca -0.14 -1.99 -0.12 0.00 0.42 0.00 0.00 52.86 51.04 2r17 s ASN 145 Cb 0.06 -2.11 -0.05 0.00 -1.45 0.00 0.00 41.25 37.70 2r17 s ASN 145 CO 0.72 -0.74 0.22 -0.63 -3.72 0.00 0.00 177.10 172.95 2r17 s ILE 146 N 1.27 5.30 -0.27 -5.21 -1.09 -1.26 -5.07 121.20 114.87 2r17 s ILE 146 Ca 0.06 0.25 -0.13 0.00 -2.23 0.00 0.00 60.65 58.60 2r17 s ILE 146 Cb -0.26 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 2r17 s ILE 146 CO -0.00 0.26 0.29 -0.63 -1.23 0.00 0.00 174.94 173.63 2r17 s ILE 147 N 1.62 5.24 0.36 2.92 1.01 -1.26 -4.83 121.20 126.26 2r17 s ILE 147 Ca 0.09 0.41 -0.28 0.00 0.00 0.00 0.00 60.65 60.86 2r17 s ILE 147 Cb -0.15 -3.62 -0.11 0.00 0.01 0.00 0.00 42.46 38.58 2r17 s ILE 147 CO 0.09 0.21 1.44 -2.65 0.00 0.00 0.00 174.94 174.03 2r17 n PRO 148 N 5.10 2.52 -3.60 2.79 -0.02 -1.26 -4.62 135.00 135.91 2r17 n PRO 148 Ca -0.11 0.88 -0.08 0.00 -2.02 0.00 0.00 63.50 62.17 2r17 n PRO 148 Cb 0.51 -2.58 -0.05 0.00 -0.02 0.00 0.00 33.50 31.37 2r17 n PRO 148 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2r17 s SER 149 N -0.13 -0.28 0.28 2.55 1.04 -0.29 -0.60 113.70 116.28 2r17 s SER 149 Ca 0.55 0.32 0.04 0.00 0.48 0.00 0.00 55.95 57.34 2r17 s SER 149 Cb -0.51 0.25 -0.03 0.00 0.10 0.00 0.00 66.02 65.83 2r17 s SER 149 CO 0.62 -0.25 0.21 0.72 0.98 0.00 0.00 173.24 175.52 2r17 s PHE 150 N -1.01 1.53 -0.04 5.02 -0.71 -1.05 -2.85 117.98 118.87 2r17 s PHE 150 Ca 0.01 -1.53 -0.03 0.00 -1.04 0.00 0.00 56.93 54.34 2r17 s PHE 150 Cb -0.01 -0.68 0.01 0.00 -1.21 0.00 0.00 43.02 41.13 2r17 s PHE 150 CO -0.02 -0.74 0.10 0.08 -1.34 0.00 0.00 175.22 173.30 2r17 s VAL 151 N -3.72 -0.00 0.40 -2.49 1.01 -0.12 -1.22 120.40 114.27 2r17 s VAL 151 Ca 0.39 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.41 2r17 s VAL 151 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 2r17 s VAL 151 CO 0.21 0.00 0.15 0.00 0.00 0.00 0.00 175.10 175.45 2r17 n LEU 152 N 3.03 0.00 -3.15 3.92 -0.00 -0.74 0.11 117.00 120.17 2r17 n LEU 152 Ca -0.12 -3.10 0.04 0.00 -0.00 0.00 0.00 56.01 52.83 2r17 n LEU 152 Cb 0.59 1.03 -0.00 0.00 -0.00 0.00 0.00 43.42 45.04 2r17 n LEU 152 CO 0.23 -0.48 0.16 -0.62 -0.00 0.00 0.00 177.39 176.68 2r17 s ASP 154 N -3.49 -1.45 -0.33 1.45 -1.08 0.27 -2.06 116.67 109.98 2r17 s ASP 154 Ca 0.21 0.34 -0.16 0.00 -0.52 0.00 0.00 52.55 52.41 2r17 s ASP 154 Cb 0.01 1.98 -0.01 0.00 -1.46 0.00 0.00 42.92 43.44 2r17 s ASP 154 CO 0.15 -0.27 0.42 -0.63 0.52 0.00 0.00 175.17 175.36 2r17 s ILE 155 N 2.85 5.11 0.00 4.11 1.01 -1.26 -1.12 121.20 131.90 2r17 s ILE 155 Ca 0.14 0.26 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2r17 s ILE 155 Cb -0.10 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.52 2r17 s ILE 155 CO -0.24 -0.09 0.00 1.67 0.00 0.00 0.00 174.94 176.28 2r17 n GLN 156 N 5.50 0.00 -3.15 2.79 7.27 0.10 -4.80 117.38 125.08 2r17 n GLN 156 Ca -0.07 0.12 0.05 0.00 0.07 0.00 0.00 57.00 57.17 2r17 n GLN 156 Cb 0.49 -0.56 -0.02 0.00 2.41 0.00 0.00 30.24 32.56 2r17 n GLN 156 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2r17 s ALA 157 N -3.27 -3.83 -1.90 1.69 0.00 -1.26 -4.88 121.76 108.30 2r17 s ALA 157 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2r17 s ALA 157 Cb 0.00 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.55 2r17 s ALA 157 CO 0.00 -1.39 0.00 0.45 0.00 0.00 0.00 175.76 174.82 2r17 n SER 158 N 5.27 -5.54 -3.72 0.00 2.88 -1.26 -4.92 113.62 106.34 2r17 n SER 158 Ca -0.09 0.44 -0.12 0.00 -1.33 0.00 0.00 58.87 57.78 2r17 n SER 158 Cb 0.55 -4.65 -0.10 0.00 -0.75 0.00 0.00 64.21 59.26 2r17 n SER 158 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2r17 s THR 159 N -2.52 -0.01 -0.06 2.46 2.01 -1.26 -2.36 115.64 113.90 2r17 s THR 159 Ca 0.00 0.04 -0.01 0.00 0.31 0.00 0.00 61.69 62.03 2r17 s THR 159 Cb 0.00 -0.59 0.03 0.00 0.01 0.00 0.00 72.50 71.95 2r17 s THR 159 CO 0.00 0.02 0.02 0.54 -0.69 0.00 0.00 174.62 174.50 2r17 s VAL 160 N 0.76 0.25 -0.26 3.82 0.11 -0.47 -0.73 120.40 123.88 2r17 s VAL 160 Ca -0.04 0.19 -0.14 0.00 -2.93 0.00 0.00 61.98 59.06 2r17 s VAL 160 Cb -0.05 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2r17 s VAL 160 CO -0.05 0.24 0.32 -0.69 -3.33 0.00 0.00 175.10 171.58 2r17 s VAL 161 N 1.98 5.22 -0.32 2.04 1.01 -0.28 -1.69 120.40 128.36 2r17 s VAL 161 Ca 0.04 0.47 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 2r17 s VAL 161 Cb -0.12 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 2r17 s VAL 161 CO -0.05 0.20 0.18 -0.89 0.00 0.00 0.00 175.10 174.54 2r17 s THR 162 N 1.86 4.78 -0.19 3.92 2.01 0.21 -0.57 115.64 127.66 2r17 s THR 162 Ca 0.13 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 61.65 2r17 s THR 162 Cb -0.16 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2r17 s THR 162 CO 0.10 0.02 0.05 -0.31 -0.69 0.00 0.00 174.62 173.78 2r17 s TYR 163 N 1.64 3.19 -0.11 4.92 2.02 -0.87 -0.71 117.35 127.42 2r17 s TYR 163 Ca 0.05 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 2r17 s TYR 163 Cb -0.17 -2.08 -0.02 0.00 -0.40 0.00 0.00 41.96 39.28 2r17 s TYR 163 CO 0.07 0.06 -0.12 0.54 -1.57 0.00 0.00 175.55 174.54 2r17 s VAL 164 N 0.54 3.22 -0.47 0.71 0.11 -1.08 -1.79 120.40 121.64 2r17 s VAL 164 Ca 0.02 -0.62 -0.09 0.00 -2.93 0.00 0.00 61.98 58.37 2r17 s VAL 164 Cb -0.13 -2.34 0.12 0.00 -1.53 0.00 0.00 36.38 32.50 2r17 s VAL 164 CO 0.01 0.54 0.34 -0.31 -3.33 0.00 0.00 175.10 172.35 2r17 s TYR 165 N -0.01 3.44 -0.12 1.54 2.02 -0.35 -2.13 117.35 121.74 2r17 s TYR 165 Ca -0.03 -1.93 -0.07 0.00 -0.37 0.00 0.00 57.07 54.67 2r17 s TYR 165 Cb -0.14 -3.48 -0.04 0.00 -0.40 0.00 0.00 41.96 37.90 2r17 s TYR 165 CO 0.04 -0.99 0.14 -0.65 -1.57 0.00 0.00 175.55 172.51 2r17 s GLN 166 N 1.33 3.45 -0.64 -0.62 -0.21 -1.09 -2.53 119.66 119.34 2r17 s GLN 166 Ca 0.06 -0.14 -0.16 0.00 0.02 0.00 0.00 55.36 55.14 2r17 s GLN 166 Cb -0.26 -3.18 0.14 0.00 1.00 0.00 0.00 33.01 30.71 2r17 s GLN 166 CO -0.01 0.76 0.65 -1.17 -2.12 0.00 0.00 175.29 173.41 2r17 s LEU 167 N -0.99 6.05 -0.19 2.90 2.96 0.23 -1.19 118.68 128.45 2r17 s LEU 167 Ca 0.15 -1.92 -0.08 0.00 -0.22 0.00 0.00 54.13 52.06 2r17 s LEU 167 Cb -0.12 -2.25 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 2r17 s LEU 167 CO 0.04 -0.87 0.07 -0.63 -1.32 0.00 0.00 176.35 173.63 2r17 s ILE 168 N 1.62 4.78 0.00 6.68 1.01 -0.32 -4.24 121.20 130.73 2r17 s ILE 168 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.72 2r17 s ILE 168 Cb -0.22 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2r17 s ILE 168 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 174.94 176.00 2r17 n GLY 169 N 3.64 2.76 0.58 6.18 0.00 -1.26 -1.47 105.19 115.63 2r17 n GLY 169 Ca -0.16 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.66 2r17 n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2r17 n ASP 170 N 5.66 2.69 -4.61 1.61 8.00 -1.26 -5.01 116.55 123.62 2r17 n ASP 170 Ca 0.00 -1.88 -0.24 0.00 0.71 0.00 0.00 54.79 53.38 2r17 n ASP 170 Cb 0.00 -0.18 -0.08 0.00 -0.02 0.00 0.00 41.12 40.84 2r17 n ASP 170 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2r17 s ASP 171 N -0.98 4.41 -0.39 -2.24 1.01 -0.54 -5.03 116.67 112.91 2r17 s ASP 171 Ca 0.20 -0.64 -0.15 0.00 0.71 0.00 0.00 52.55 52.68 2r17 s ASP 171 Cb 0.11 -0.78 0.01 0.00 1.01 0.00 0.00 42.92 43.27 2r17 s ASP 171 CO 0.15 0.04 0.32 -0.69 0.21 0.00 0.00 175.17 175.20 2r17 s VAL 172 N -2.12 5.22 -0.36 -1.27 1.01 -1.26 -1.17 120.40 120.44 2r17 s VAL 172 Ca 0.29 -0.42 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 2r17 s VAL 172 Cb -0.07 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.44 2r17 s VAL 172 CO 0.18 -0.24 0.19 -0.54 0.00 0.00 0.00 175.10 174.69 2r17 s LYS 173 N 1.82 2.89 -0.00 2.72 1.02 -0.33 -4.95 119.74 122.91 2r17 s LYS 173 Ca 0.07 -1.03 -0.18 0.00 0.02 0.00 0.00 55.97 54.86 2r17 s LYS 173 Cb -0.18 -3.69 -0.06 0.00 -0.52 0.00 0.00 37.83 33.39 2r17 s LYS 173 CO 0.11 -0.65 0.49 0.08 -0.92 0.00 0.00 175.35 174.46 2r17 s VAL 174 N 1.55 4.95 0.43 3.17 1.01 -1.26 -2.67 120.40 127.59 2r17 s VAL 174 Ca 0.02 1.03 0.06 0.00 0.00 0.00 0.00 61.98 63.09 2r17 s VAL 174 Cb -0.19 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 2r17 s VAL 174 CO 0.06 0.50 0.10 -1.61 0.00 0.00 0.00 175.10 174.15 2r17 s GLU 175 N -0.65 2.11 -0.01 2.72 0.41 -0.91 -4.96 118.70 117.42 2r17 s GLU 175 Ca 0.27 -2.05 0.00 0.00 -0.41 0.00 0.00 54.97 52.78 2r17 s GLU 175 Cb -0.17 -1.78 0.01 0.00 -1.78 0.00 0.00 34.13 30.41 2r17 s GLU 175 CO 0.15 -0.16 0.00 0.50 -0.49 0.00 0.00 175.26 175.26 2r17 s ARG 176 N -3.84 0.08 -0.01 1.61 3.52 -1.26 -2.63 118.95 116.41 2r17 s ARG 176 Ca 0.33 0.04 0.01 0.00 -0.13 0.00 0.00 55.73 55.97 2r17 s ARG 176 Cb 0.06 -0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.28 2r17 s ARG 176 CO 0.18 -0.05 -0.02 0.42 -0.81 0.00 0.00 175.30 175.02 2r17 s ILE 177 N 0.40 0.19 -0.07 4.11 -1.09 0.11 -5.00 121.20 119.85 2r17 s ILE 177 Ca -0.03 -0.05 0.02 0.00 -2.23 0.00 0.00 60.65 58.35 2r17 s ILE 177 Cb -0.05 -0.21 -0.03 0.00 -1.58 0.00 0.00 42.46 40.59 2r17 s ILE 177 CO -0.01 0.08 -0.11 -1.83 -1.23 0.00 0.00 174.94 171.85 2r17 s GLU 178 N 0.27 2.75 -0.04 2.79 -1.05 -1.26 0.66 118.70 122.83 2r17 s GLU 178 Ca -0.02 -0.63 0.01 0.00 -0.15 0.00 0.00 54.97 54.17 2r17 s GLU 178 Cb -0.05 -2.51 0.02 0.00 -0.44 0.00 0.00 34.13 31.15 2r17 s GLU 178 CO -0.01 0.57 -0.03 -0.47 0.95 0.00 0.00 175.26 176.27 2r17 s TYR 179 N -0.58 0.60 -0.20 4.83 5.04 -0.68 -5.00 117.35 121.35 2r17 s TYR 179 Ca 0.08 -0.13 0.02 0.00 -2.44 0.00 0.00 57.07 54.60 2r17 s TYR 179 Cb -0.12 -0.56 0.03 0.00 0.35 0.00 0.00 41.96 41.67 2r17 s TYR 179 CO 0.02 -0.16 -0.16 0.15 -1.34 0.00 0.00 175.55 174.06 2r17 s LYS 180 N 0.87 2.64 -0.24 4.97 1.02 -1.26 -1.37 119.74 126.36 2r17 s LYS 180 Ca -0.11 -0.97 -0.32 0.00 0.02 0.00 0.00 55.97 54.59 2r17 s LYS 180 Cb -0.14 -2.62 -0.09 0.00 -0.52 0.00 0.00 37.83 34.46 2r17 s LYS 180 CO -0.00 -0.34 2.14 1.17 -0.92 0.00 0.00 175.35 177.40 2r17 n LYS 181 N 4.58 1.67 0.00 1.68 4.81 -0.99 -5.01 118.16 124.89 2r17 n LYS 181 Ca -0.18 0.50 0.09 0.00 -0.87 0.00 0.00 58.31 57.84 2r17 n LYS 181 Cb 0.47 -2.80 0.51 0.00 0.02 0.00 0.00 35.03 33.23 2r17 n LYS 181 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27