#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xg0 h ALA 4 N 0.00 1.00 -0.21 2.24 0.00 -2.03 -1.90 119.26 118.36 1xg0 h ALA 4 Ca 0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1xg0 h ALA 4 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1xg0 h ALA 4 CO 0.00 0.59 -0.52 0.74 0.00 0.00 0.00 179.25 180.06 1xg0 h PHE 5 N 1.10 0.73 -0.90 0.00 0.05 -2.00 -3.04 116.94 112.89 1xg0 h PHE 5 Ca 0.26 -0.25 0.01 0.00 3.82 0.00 0.00 57.97 61.81 1xg0 h PHE 5 Cb 0.15 -0.14 -0.05 0.00 2.00 0.00 0.00 35.95 37.91 1xg0 h PHE 5 CO 0.01 0.98 0.59 0.77 -0.18 0.00 0.00 178.31 180.49 1xg0 h SER 6 N 0.46 1.02 -0.68 2.17 0.02 -1.85 -0.64 113.55 114.06 1xg0 h SER 6 Ca 0.02 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 1xg0 h SER 6 Cb 1.06 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.30 1xg0 h SER 6 CO 0.10 0.74 0.42 0.03 -1.14 0.00 0.00 176.83 176.98 1xg0 h ARG 7 N 1.21 0.80 -0.03 3.45 3.08 -1.32 -2.31 114.38 119.25 1xg0 h ARG 7 Ca 0.33 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1xg0 h ARG 7 Cb -0.13 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.74 1xg0 h ARG 7 CO -0.08 0.53 -0.01 0.28 -1.07 0.00 0.00 179.97 179.63 1xg0 h VAL 8 N 0.82 1.29 0.00 2.04 2.07 -1.27 -1.39 116.25 119.82 1xg0 h VAL 8 Ca 0.27 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1xg0 h VAL 8 Cb 0.03 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1xg0 h VAL 8 CO -0.11 0.24 0.00 -0.37 0.02 0.00 0.00 177.57 177.35 1xg0 h VAL 9 N -0.30 0.00 0.00 2.57 -1.51 -0.96 -3.41 116.25 112.65 1xg0 h VAL 9 Ca 0.01 -0.61 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 1xg0 h VAL 9 Cb 0.39 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.13 1xg0 h VAL 9 CO 0.00 0.00 -0.32 0.35 -1.23 0.00 0.00 177.57 176.37 1xg0 n THR 10 N -2.55 0.56 0.00 7.19 -2.24 -0.89 -5.10 114.28 111.26 1xg0 n THR 10 Ca 0.05 0.33 0.00 0.00 -2.27 0.00 0.00 64.05 62.16 1xg0 n THR 10 Cb 0.43 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 66.93 1xg0 n THR 10 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xg0 n ALA 12 N -3.19 0.00 -2.71 6.98 0.00 -0.89 -5.06 120.51 115.63 1xg0 n ALA 12 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.04 1xg0 n ALA 12 Cb 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.53 1xg0 n ALA 12 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xg0 s ASP 13 N 0.00 6.16 0.11 0.00 -1.08 -0.58 -5.00 116.67 116.28 1xg0 s ASP 13 Ca 0.00 0.19 0.03 0.00 -0.52 0.00 0.00 52.55 52.25 1xg0 s ASP 13 Cb 0.00 -2.09 -0.22 0.00 -1.46 0.00 0.00 42.92 39.15 1xg0 s ASP 13 CO 0.00 0.14 1.24 -1.28 0.52 0.00 0.00 175.17 175.80 1xg0 h SER 14 N 6.94 0.15 -3.66 -0.34 0.87 -1.90 -3.37 113.55 112.24 1xg0 h SER 14 Ca -0.40 -0.15 -0.50 0.00 -1.23 0.00 0.00 61.79 59.51 1xg0 h SER 14 Cb 1.16 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 1xg0 h SER 14 CO 0.73 1.11 0.07 -1.59 -0.53 0.00 0.00 176.83 176.61 1xg0 s LYS 15 N -2.73 3.86 0.75 2.24 -2.85 -1.26 -5.03 119.74 114.73 1xg0 s LYS 15 Ca -0.01 0.50 -0.15 0.00 -1.00 0.00 0.00 55.97 55.32 1xg0 s LYS 15 Cb 0.09 -2.45 0.05 0.00 -2.06 0.00 0.00 37.83 33.47 1xg0 s LYS 15 CO 0.84 0.09 1.21 0.00 0.10 0.00 0.00 175.35 177.59 1xg0 s ALA 16 N -2.15 2.05 -0.17 0.59 0.00 -1.26 -4.81 121.76 116.01 1xg0 s ALA 16 Ca 0.52 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 53.22 1xg0 s ALA 16 Cb -0.10 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1xg0 s ALA 16 CO 0.25 -1.99 0.26 0.00 0.00 0.00 0.00 175.76 174.28 1xg0 s ALA 17 N -2.02 3.62 -0.35 0.00 0.00 -1.26 -5.07 121.76 116.67 1xg0 s ALA 17 Ca 0.74 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 52.22 1xg0 s ALA 17 Cb -0.29 -2.34 0.10 0.00 0.00 0.00 0.00 23.12 20.59 1xg0 s ALA 17 CO 0.47 0.12 0.08 0.71 0.00 0.00 0.00 175.76 177.13 1xg0 s TYR 18 N 0.41 3.69 -0.47 0.00 1.51 -1.26 -5.06 117.35 116.17 1xg0 s TYR 18 Ca 0.15 -2.81 -0.07 0.00 -1.01 0.00 0.00 57.07 53.33 1xg0 s TYR 18 Cb -0.13 -2.95 0.12 0.00 -0.11 0.00 0.00 41.96 38.90 1xg0 s TYR 18 CO 0.03 -0.95 0.31 0.08 -1.11 0.00 0.00 175.55 173.91 1xg0 s VAL 19 N 0.98 3.88 0.23 0.71 1.01 -1.26 -5.04 120.40 120.91 1xg0 s VAL 19 Ca 0.09 -2.00 0.01 0.00 0.00 0.00 0.00 61.98 60.08 1xg0 s VAL 19 Cb -0.20 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1xg0 s VAL 19 CO -0.07 -0.76 0.09 -0.83 0.00 0.00 0.00 175.10 173.53 1xg0 s GLY 20 N 2.20 1.60 0.00 4.51 0.00 -1.26 -4.42 107.32 109.95 1xg0 s GLY 20 Ca 0.08 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.00 1xg0 s GLY 20 CO -0.02 -1.54 0.00 0.61 0.00 0.00 0.00 173.10 172.14 1xg0 n GLY 21 N -0.39 2.76 0.35 0.20 0.00 -1.26 -2.11 105.19 104.74 1xg0 n GLY 21 Ca -0.00 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.71 1xg0 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg0 h ALA 22 N -0.87 1.84 -0.52 4.61 0.00 -1.99 -1.03 119.26 121.31 1xg0 h ALA 22 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1xg0 h ALA 22 Cb 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1xg0 h ALA 22 CO 0.00 0.04 0.10 -0.44 0.00 0.00 0.00 179.25 178.95 1xg0 h ASP 23 N 0.58 0.76 -0.27 0.00 3.32 -1.80 -0.87 116.42 118.13 1xg0 h ASP 23 Ca 0.28 -0.15 -0.17 0.00 0.02 0.00 0.00 57.03 57.01 1xg0 h ASP 23 Cb 0.35 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 1xg0 h ASP 23 CO -0.09 0.77 -0.49 0.25 -1.72 0.00 0.00 179.24 177.96 1xg0 h LEU 24 N 0.78 0.94 -0.56 1.55 5.85 -1.12 -0.72 115.31 122.02 1xg0 h LEU 24 Ca 0.17 -0.48 0.07 0.00 0.84 0.00 0.00 57.88 58.48 1xg0 h LEU 24 Cb 0.33 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 1xg0 h LEU 24 CO 0.00 1.26 0.23 -0.61 -0.34 0.00 0.00 178.44 178.99 1xg0 h GLN 25 N 0.67 0.42 -0.54 1.25 4.15 -0.98 -1.62 115.11 118.46 1xg0 h GLN 25 Ca 0.03 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.33 1xg0 h GLN 25 Cb 1.09 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.66 1xg0 h GLN 25 CO 0.11 0.28 -0.01 0.00 -1.93 0.00 0.00 178.83 177.28 1xg0 h ALA 26 N 1.36 0.73 -0.57 3.38 0.00 -1.05 -2.97 119.26 120.14 1xg0 h ALA 26 Ca 0.27 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1xg0 h ALA 26 Cb 0.28 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1xg0 h ALA 26 CO -0.25 0.56 0.28 1.25 0.00 0.00 0.00 179.25 181.10 1xg0 h LEU 27 N 0.84 0.39 -0.48 0.00 5.85 -0.57 -1.38 115.31 119.97 1xg0 h LEU 27 Ca 0.15 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1xg0 h LEU 27 Cb 0.55 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1xg0 h LEU 27 CO 0.03 0.26 0.00 0.29 -0.34 0.00 0.00 178.44 178.68 1xg0 n LYS 28 N -4.88 0.13 0.08 1.25 5.02 -0.66 -1.54 118.16 117.56 1xg0 n LYS 28 Ca 0.06 0.37 0.13 0.00 -2.02 0.00 0.00 58.31 56.86 1xg0 n LYS 28 Cb 0.18 -1.75 0.39 0.00 -0.02 0.00 0.00 35.03 33.83 1xg0 n LYS 28 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xg0 n LYS 29 N -1.99 0.22 0.00 1.97 5.02 -0.52 -4.07 118.16 118.79 1xg0 n LYS 29 Ca 0.02 0.16 0.06 0.00 -2.02 0.00 0.00 58.31 56.53 1xg0 n LYS 29 Cb 0.20 -1.73 -0.01 0.00 -0.02 0.00 0.00 35.03 33.47 1xg0 n LYS 29 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1xg0 n PHE 30 N -2.11 0.00 -4.65 2.13 3.72 -0.59 -4.94 117.46 111.03 1xg0 n PHE 30 Ca 0.05 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.15 1xg0 n PHE 30 Cb 0.42 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.83 1xg0 n PHE 30 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 1xg0 s ILE 31 N -1.62 2.83 0.46 4.37 -4.36 -1.11 -5.06 121.20 116.71 1xg0 s ILE 31 Ca 0.10 -1.17 -0.22 0.00 -0.26 0.00 0.00 60.65 59.10 1xg0 s ILE 31 Cb 0.10 -2.19 -0.08 0.00 1.25 0.00 0.00 42.46 41.54 1xg0 s ILE 31 CO 0.33 0.34 1.10 -0.94 0.24 0.00 0.00 174.94 176.01 1xg0 s SER 32 N -1.44 6.33 -1.33 4.36 1.04 -1.26 -3.80 113.70 117.61 1xg0 s SER 32 Ca 0.15 2.13 -0.08 0.00 0.48 0.00 0.00 55.95 58.63 1xg0 s SER 32 Cb -0.11 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1xg0 s SER 32 CO 0.05 -0.80 0.52 -0.62 0.98 0.00 0.00 173.24 173.38 1xg0 n GLU 33 N -0.56 -2.47 -0.07 4.02 1.02 -1.26 -4.63 120.64 116.70 1xg0 n GLU 33 Ca 0.08 0.39 -0.07 0.00 -0.02 0.00 0.00 57.16 57.53 1xg0 n GLU 33 Cb 0.50 -4.25 -0.01 0.00 -0.02 0.00 0.00 31.44 27.66 1xg0 n GLU 33 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1xg0 h GLY 34 N -1.91 0.14 0.93 0.62 0.00 -1.76 0.25 103.07 101.34 1xg0 h GLY 34 Ca -0.65 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 1xg0 h GLY 34 CO 0.58 -0.13 0.04 3.43 0.00 0.00 0.00 176.54 180.46 1xg0 h ASN 35 N -0.06 0.09 -0.91 0.19 2.35 -1.90 -1.20 115.58 114.14 1xg0 h ASN 35 Ca 0.14 -0.08 0.05 0.00 -0.55 0.00 0.00 56.30 55.86 1xg0 h ASN 35 Cb 0.27 -0.02 -0.06 0.00 0.05 0.00 0.00 38.32 38.56 1xg0 h ASN 35 CO -0.31 0.14 0.58 0.11 -1.65 0.00 0.00 177.43 176.30 1xg0 h LYS 36 N 0.03 1.07 -0.61 0.81 1.57 -1.79 -1.69 116.57 115.96 1xg0 h LYS 36 Ca 0.03 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1xg0 h LYS 36 Cb 0.07 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 1xg0 h LYS 36 CO -0.00 0.71 0.32 -0.09 -0.57 0.00 0.00 179.45 179.82 1xg0 h ARG 37 N 1.10 0.86 -0.35 3.15 2.43 -0.24 0.49 114.38 121.83 1xg0 h ARG 37 Ca 0.38 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.32 1xg0 h ARG 37 Cb 0.08 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1xg0 h ARG 37 CO -0.14 0.67 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.64 1xg0 h LEU 38 N 0.83 0.75 -0.63 3.80 3.38 -0.89 -0.30 115.31 122.24 1xg0 h LEU 38 Ca 0.21 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.92 1xg0 h LEU 38 Cb 0.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1xg0 h LEU 38 CO -0.03 0.99 0.40 0.44 0.09 0.00 0.00 178.44 180.32 1xg0 h ASP 39 N 0.62 0.65 -0.25 -0.43 3.32 -0.98 -0.96 116.42 118.40 1xg0 h ASP 39 Ca 0.08 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.14 1xg0 h ASP 39 Cb 0.79 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1xg0 h ASP 39 CO 0.07 0.46 0.14 0.28 -1.72 0.00 0.00 179.24 178.46 1xg0 h SER 40 N 0.78 0.23 -0.29 6.45 0.02 -0.36 -1.08 113.55 119.29 1xg0 h SER 40 Ca 0.25 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1xg0 h SER 40 Cb 0.00 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1xg0 h SER 40 CO -0.10 0.17 0.15 0.58 -1.14 0.00 0.00 176.83 176.49 1xg0 h VAL 41 N 0.29 1.14 -0.52 2.27 2.07 -0.92 -2.70 116.25 117.89 1xg0 h VAL 41 Ca 0.10 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1xg0 h VAL 41 Cb 0.00 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1xg0 h VAL 41 CO -0.05 0.14 0.23 -1.13 0.02 0.00 0.00 177.57 176.79 1xg0 h ASN 42 N 0.35 0.66 0.13 0.57 -1.24 -0.94 0.28 115.58 115.39 1xg0 h ASN 42 Ca 0.10 -0.07 -0.02 0.00 0.71 0.00 0.00 56.30 57.02 1xg0 h ASN 42 Cb 0.09 -0.17 -0.00 0.00 0.73 0.00 0.00 38.32 38.97 1xg0 h ASN 42 CO -0.01 0.58 -0.10 0.77 -1.29 0.00 0.00 177.43 177.38 1xg0 h SER 43 N 0.73 0.00 0.00 1.15 4.64 -0.87 -0.38 113.55 118.83 1xg0 h SER 43 Ca 0.18 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.44 1xg0 h SER 43 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1xg0 h SER 43 CO -0.02 0.10 -0.51 0.40 -0.87 0.00 0.00 176.83 175.93 1xg0 h ILE 44 N 0.00 0.46 -0.71 0.95 2.04 -1.26 -3.36 117.51 115.63 1xg0 h ILE 44 Ca -0.00 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.39 1xg0 h ILE 44 Cb 0.19 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1xg0 h ILE 44 CO 0.01 0.16 0.45 0.58 0.00 0.00 0.00 178.15 179.35 1xg0 h VAL 45 N -1.00 1.20 0.00 1.67 2.07 -0.88 -1.48 116.25 117.83 1xg0 h VAL 45 Ca -0.09 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1xg0 h VAL 45 Cb 0.65 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1xg0 h VAL 45 CO -0.05 0.20 0.00 0.77 0.02 0.00 0.00 177.57 178.50 1xg0 h SER 46 N 0.97 0.00 -0.38 0.57 4.64 -1.29 -2.47 113.55 115.59 1xg0 h SER 46 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1xg0 h SER 46 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1xg0 h SER 46 CO -0.05 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.50 1xg0 n ASN 47 N -2.52 3.66 -0.19 4.97 3.02 -0.64 -4.79 115.26 118.78 1xg0 n ASN 47 Ca 0.02 -2.46 -0.01 0.00 -0.03 0.00 0.00 54.58 52.10 1xg0 n ASN 47 Cb 0.26 -0.42 0.20 0.00 -0.61 0.00 0.00 39.78 39.22 1xg0 n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xg0 h ALA 48 N 2.39 1.32 -0.36 5.41 0.00 -0.84 -2.08 119.26 125.10 1xg0 h ALA 48 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 1xg0 h ALA 48 Cb 1.14 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1xg0 h ALA 48 CO 0.13 0.54 -0.25 0.77 0.00 0.00 0.00 179.25 180.43 1xg0 h SER 49 N 0.96 0.74 -0.14 0.00 0.02 -1.86 -1.09 113.55 112.17 1xg0 h SER 49 Ca 0.24 -0.27 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 1xg0 h SER 49 Cb 0.08 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1xg0 h SER 49 CO -0.03 0.96 -0.36 0.00 -1.14 0.00 0.00 176.83 176.26 1xg0 h ILE 51 N 0.55 0.93 -0.26 0.00 2.04 -1.03 0.68 117.51 120.42 1xg0 h ILE 51 Ca 0.05 -0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 1xg0 h ILE 51 Cb 0.88 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1xg0 h ILE 51 CO 0.08 0.00 0.04 0.58 0.00 0.00 0.00 178.15 178.85 1xg0 h VAL 52 N -0.10 1.23 -0.24 1.67 2.07 -1.16 -1.62 116.25 118.10 1xg0 h VAL 52 Ca -0.01 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1xg0 h VAL 52 Cb 0.07 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1xg0 h VAL 52 CO 0.02 0.25 0.15 -1.28 0.02 0.00 0.00 177.57 176.73 1xg0 h SER 53 N 0.25 0.25 -0.74 0.57 0.87 -1.17 -0.99 113.55 112.58 1xg0 h SER 53 Ca 0.08 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1xg0 h SER 53 Cb 0.34 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 1xg0 h SER 53 CO 0.01 0.18 0.31 -0.78 -0.53 0.00 0.00 176.83 176.02 1xg0 h ASP 54 N 0.31 1.03 -0.26 6.23 3.58 -0.79 0.13 116.42 126.65 1xg0 h ASP 54 Ca 0.09 -0.15 -0.06 0.00 0.42 0.00 0.00 57.03 57.33 1xg0 h ASP 54 Cb -0.02 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 1xg0 h ASP 54 CO -0.03 0.91 -0.08 0.00 -2.88 0.00 0.00 179.24 177.16 1xg0 h ALA 55 N 1.24 0.36 -0.41 -0.78 0.00 -1.04 0.27 119.26 118.90 1xg0 h ALA 55 Ca 0.25 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 1xg0 h ALA 55 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1xg0 h ALA 55 CO -0.02 0.18 -0.34 0.28 0.00 0.00 0.00 179.25 179.35 1xg0 h VAL 56 N 0.25 1.27 -0.80 0.00 2.07 -1.07 -0.47 116.25 117.50 1xg0 h VAL 56 Ca 0.06 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.06 1xg0 h VAL 56 Cb 0.56 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1xg0 h VAL 56 CO 0.03 0.51 0.44 -1.28 0.02 0.00 0.00 177.57 177.28 1xg0 h SER 57 N 0.78 1.01 -0.20 0.57 0.87 -0.73 -1.32 113.55 114.53 1xg0 h SER 57 Ca 0.07 -0.10 -0.21 0.00 -1.23 0.00 0.00 61.79 60.32 1xg0 h SER 57 Cb 0.93 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.64 1xg0 h SER 57 CO 0.09 0.82 -0.69 1.23 -0.53 0.00 0.00 176.83 177.75 1xg0 h GLY 58 N 1.12 0.91 0.30 5.77 0.00 -0.81 0.17 103.07 110.52 1xg0 h GLY 58 Ca 0.28 -1.19 0.10 0.00 0.00 0.00 0.00 47.33 46.52 1xg0 h GLY 58 CO -0.04 1.06 0.19 1.98 0.00 0.00 0.00 176.54 179.73 1xg0 h MET 59 N 0.59 0.33 -0.19 4.80 -1.53 -0.90 -1.63 114.93 116.41 1xg0 h MET 59 Ca -0.03 -0.02 -0.20 0.00 -3.44 0.00 0.00 59.70 56.02 1xg0 h MET 59 Cb 1.31 -0.07 0.01 0.00 -0.55 0.00 0.00 31.60 32.29 1xg0 h MET 59 CO 0.15 0.22 -0.65 0.82 0.14 0.00 0.00 176.91 177.59 1xg0 h ILE 60 N 0.34 1.29 0.00 1.77 2.04 -1.05 -2.55 117.51 119.36 1xg0 h ILE 60 Ca 0.31 -1.86 -0.05 0.00 1.00 0.00 0.00 64.86 64.26 1xg0 h ILE 60 Cb 0.43 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1xg0 h ILE 60 CO -0.35 0.59 -0.25 0.00 0.00 0.00 0.00 178.15 178.14 1xg0 h GLU 62 N 0.00 0.00 -1.45 0.00 5.08 -1.29 -3.40 114.58 113.52 1xg0 h GLU 62 Ca -0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 1xg0 h GLU 62 Cb 0.62 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.62 1xg0 h GLU 62 CO 0.03 0.00 -0.70 -1.71 -1.00 0.00 0.00 179.01 175.63 1xg0 n ASN 63 N -2.73 -2.16 0.28 1.42 5.15 -0.23 -5.01 115.26 111.98 1xg0 n ASN 63 Ca 0.04 -2.75 0.19 0.00 -0.60 0.00 0.00 54.58 51.46 1xg0 n ASN 63 Cb 0.45 0.81 0.92 0.00 -0.53 0.00 0.00 39.78 41.43 1xg0 n ASN 63 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1xg0 h PRO 64 N 5.07 0.00 -0.03 1.20 0.11 -1.47 -1.98 132.00 134.91 1xg0 h PRO 64 Ca 0.12 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.23 1xg0 h PRO 64 Cb 1.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1xg0 h PRO 64 CO 0.19 0.00 0.20 0.66 -0.21 0.00 0.00 178.00 178.85 1xg0 h SER 65 N 0.00 0.00 -0.00 -2.05 4.64 -1.95 -1.52 113.55 112.67 1xg0 h SER 65 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xg0 h SER 65 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1xg0 h SER 65 CO 0.00 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.89 1xg0 h LEU 66 N 0.00 0.00 -2.83 5.97 3.38 -1.69 -1.74 115.31 118.40 1xg0 h LEU 66 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xg0 h LEU 66 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1xg0 h LEU 66 CO -0.00 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.83 1xg0 n ILE 67 N -3.99 0.96 -1.48 1.22 -5.35 -0.58 -1.11 119.36 109.03 1xg0 n ILE 67 Ca -0.03 -0.98 -0.29 0.00 -0.27 0.00 0.00 62.75 61.18 1xg0 n ILE 67 Cb 0.08 0.53 0.14 0.00 -1.74 0.00 0.00 39.64 38.65 1xg0 n ILE 67 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1xg0 s SER 68 N -1.00 3.46 0.60 7.28 1.04 -0.66 -4.77 113.70 119.66 1xg0 s SER 68 Ca 0.24 1.03 0.35 0.00 0.48 0.00 0.00 55.95 58.05 1xg0 s SER 68 Cb 0.12 -1.64 1.94 0.00 0.10 0.00 0.00 66.02 66.55 1xg0 s SER 68 CO 0.16 -2.59 2.25 -0.65 0.98 0.00 0.00 173.24 173.40 1xg0 h PRO 69 N -1.52 0.00 -0.02 4.02 0.11 -1.94 -0.35 132.00 132.30 1xg0 h PRO 69 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1xg0 h PRO 69 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1xg0 h PRO 69 CO 0.61 0.02 -0.03 -1.13 -0.21 0.00 0.00 178.00 177.27 1xg0 n SER 70 N -3.51 2.13 0.00 -2.05 3.41 -1.26 -4.93 113.62 107.41 1xg0 n SER 70 Ca -0.03 -1.69 0.00 0.00 -0.26 0.00 0.00 58.87 56.90 1xg0 n SER 70 Cb 0.12 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1xg0 n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xg0 n GLY 71 N 1.26 0.89 0.00 5.00 0.00 -0.14 -5.02 105.19 107.19 1xg0 n GLY 71 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1xg0 n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg0 s TYR 74 N 0.00 3.18 0.00 0.00 5.04 -1.19 -3.40 117.35 120.98 1xg0 s TYR 74 Ca 0.00 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.13 1xg0 s TYR 74 Cb 0.00 -3.56 0.00 0.00 0.35 0.00 0.00 41.96 38.75 1xg0 s TYR 74 CO 0.00 -1.49 0.00 0.25 -1.34 0.00 0.00 175.55 172.97 1xg0 n THR 75 N 0.82 -0.28 -0.23 4.34 -2.24 -1.26 -4.21 114.28 111.22 1xg0 n THR 75 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1xg0 n THR 75 Cb 0.43 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 68.96 1xg0 n THR 75 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1xg0 h ASN 76 N 0.00 0.78 -0.20 3.42 2.35 -1.99 -1.26 115.58 118.68 1xg0 h ASN 76 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1xg0 h ASN 76 Cb 0.00 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 1xg0 h ASN 76 CO 0.00 0.51 0.06 -0.09 -1.65 0.00 0.00 177.43 176.26 1xg0 h ARG 77 N 0.89 0.15 -0.23 0.81 2.43 -1.93 -0.23 114.38 116.27 1xg0 h ARG 77 Ca 0.33 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.33 1xg0 h ARG 77 Cb 0.18 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1xg0 h ARG 77 CO -0.11 0.10 -0.48 0.00 -1.51 0.00 0.00 179.97 177.97 1xg0 h ARG 78 N 0.16 0.72 -0.75 0.20 3.08 -1.63 -2.40 114.38 113.76 1xg0 h ARG 78 Ca 0.09 -0.48 0.05 0.00 0.07 0.00 0.00 59.98 59.71 1xg0 h ARG 78 Cb 0.06 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.12 1xg0 h ARG 78 CO -0.10 1.10 0.45 1.98 -1.07 0.00 0.00 179.97 182.34 1xg0 h MET 79 N 0.45 0.81 -0.46 0.04 4.05 -1.18 -0.89 114.93 117.75 1xg0 h MET 79 Ca 0.00 -0.05 0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1xg0 h MET 79 Cb 1.09 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.68 1xg0 h MET 79 CO 0.11 0.54 0.26 0.00 0.23 0.00 0.00 176.91 178.05 1xg0 h ALA 80 N 1.36 0.58 -0.72 0.39 0.00 -0.98 -0.28 119.26 119.62 1xg0 h ALA 80 Ca 0.33 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1xg0 h ALA 80 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1xg0 h ALA 80 CO -0.17 -0.06 0.36 0.00 0.00 0.00 0.00 179.25 179.39 1xg0 h ALA 81 N 1.21 1.27 -0.12 0.00 0.00 -0.86 0.36 119.26 121.12 1xg0 h ALA 81 Ca 0.19 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1xg0 h ALA 81 Cb 0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1xg0 h ALA 81 CO -0.09 0.57 -0.06 0.00 0.00 0.00 0.00 179.25 179.66 1xg0 h LEU 83 N -0.09 0.42 -0.12 0.00 3.38 -0.96 -0.27 115.31 117.67 1xg0 h LEU 83 Ca 0.03 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1xg0 h LEU 83 Cb 0.53 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1xg0 h LEU 83 CO 0.02 0.27 0.00 -0.09 0.09 0.00 0.00 178.44 178.73 1xg0 h ARG 84 N 0.56 0.05 -0.72 1.13 2.43 -0.84 -2.26 114.38 114.73 1xg0 h ARG 84 Ca 0.29 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.43 1xg0 h ARG 84 Cb 0.24 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1xg0 h ARG 84 CO -0.22 0.03 0.34 -0.44 -1.51 0.00 0.00 179.97 178.17 1xg0 h ASP 85 N 0.05 0.93 -0.58 -3.80 5.19 -0.33 0.13 116.42 118.01 1xg0 h ASP 85 Ca 0.05 -0.11 0.04 0.00 -0.62 0.00 0.00 57.03 56.40 1xg0 h ASP 85 Cb 0.06 -0.24 -0.04 0.00 0.18 0.00 0.00 39.33 39.29 1xg0 h ASP 85 CO -0.09 0.79 0.33 1.23 -3.12 0.00 0.00 179.24 178.38 1xg0 h GLY 86 N 1.08 0.83 1.00 2.75 0.00 -0.89 -0.29 103.07 107.54 1xg0 h GLY 86 Ca 0.25 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 1xg0 h GLY 86 CO -0.03 0.17 0.08 -2.09 0.00 0.00 0.00 176.54 174.67 1xg0 h GLU 87 N 0.63 0.87 -0.12 4.80 4.81 -0.76 -1.02 114.58 123.79 1xg0 h GLU 87 Ca 0.25 -0.24 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 1xg0 h GLU 87 Cb 0.10 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1xg0 h GLU 87 CO -0.14 0.85 -0.06 0.82 -0.73 0.00 0.00 179.01 179.75 1xg0 h ILE 88 N 0.75 0.80 -0.27 2.32 2.04 -0.43 0.19 117.51 122.90 1xg0 h ILE 88 Ca 0.16 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.03 1xg0 h ILE 88 Cb 0.41 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1xg0 h ILE 88 CO 0.01 0.00 0.16 0.40 0.00 0.00 0.00 178.15 178.73 1xg0 h ILE 89 N -0.06 1.04 -0.93 -0.67 2.04 -0.94 -1.03 117.51 116.97 1xg0 h ILE 89 Ca 0.07 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1xg0 h ILE 89 Cb 0.16 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 1xg0 h ILE 89 CO -0.16 0.06 0.58 0.25 0.00 0.00 0.00 178.15 178.89 1xg0 h LEU 90 N 0.34 1.09 -0.48 1.44 5.85 -0.99 -0.80 115.31 121.77 1xg0 h LEU 90 Ca 0.11 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1xg0 h LEU 90 Cb -0.01 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1xg0 h LEU 90 CO -0.04 0.82 0.25 0.03 -0.34 0.00 0.00 178.44 179.16 1xg0 h ARG 91 N 1.27 0.67 -0.45 1.25 3.08 -0.44 0.51 114.38 120.28 1xg0 h ARG 91 Ca 0.33 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 60.20 1xg0 h ARG 91 Cb -0.09 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 1xg0 h ARG 91 CO -0.07 0.54 -0.13 1.88 -1.07 0.00 0.00 179.97 181.12 1xg0 h TYR 92 N 0.63 0.91 -0.53 3.04 0.05 -0.76 -0.89 116.97 119.42 1xg0 h TYR 92 Ca 0.17 -0.18 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 1xg0 h TYR 92 Cb 0.07 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.56 1xg0 h TYR 92 CO -0.02 0.90 0.18 0.28 -1.05 0.00 0.00 178.16 178.46 1xg0 h VAL 93 N 0.74 1.23 -0.77 -2.88 2.07 -0.94 -0.98 116.25 114.72 1xg0 h VAL 93 Ca 0.12 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1xg0 h VAL 93 Cb 0.63 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1xg0 h VAL 93 CO 0.04 0.28 0.39 0.28 0.02 0.00 0.00 177.57 178.58 1xg0 h SER 94 N 0.73 0.97 0.30 0.57 0.02 -0.66 -1.53 113.55 113.95 1xg0 h SER 94 Ca 0.17 -0.10 -0.12 0.00 -0.84 0.00 0.00 61.79 60.91 1xg0 h SER 94 Cb 0.25 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1xg0 h SER 94 CO -0.01 0.80 -0.49 0.22 -1.14 0.00 0.00 176.83 176.21 1xg0 h TYR 95 N 1.08 0.28 -0.77 3.45 3.20 -0.89 -0.46 116.97 122.85 1xg0 h TYR 95 Ca 0.27 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 1xg0 h TYR 95 Cb 0.07 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 1xg0 h TYR 95 CO 0.01 0.68 0.42 0.00 -1.64 0.00 0.00 178.16 177.63 1xg0 h ALA 96 N 1.31 0.99 -0.51 1.82 0.00 -0.59 -0.34 119.26 121.94 1xg0 h ALA 96 Ca 0.01 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1xg0 h ALA 96 Cb 0.94 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1xg0 h ALA 96 CO 0.08 0.50 -0.15 1.25 0.00 0.00 0.00 179.25 180.93 1xg0 h LEU 97 N 1.07 0.99 -0.44 0.00 5.85 -0.93 0.14 115.31 121.99 1xg0 h LEU 97 Ca 0.27 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1xg0 h LEU 97 Cb 0.04 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1xg0 h LEU 97 CO -0.04 1.13 0.24 0.25 -0.34 0.00 0.00 178.44 179.67 1xg0 h LEU 98 N 0.86 0.55 -0.45 2.25 5.85 -0.80 -3.13 115.31 120.45 1xg0 h LEU 98 Ca 0.13 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 1xg0 h LEU 98 Cb 0.71 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1xg0 h LEU 98 CO 0.05 0.48 -0.48 0.28 -0.34 0.00 0.00 178.44 178.43 1xg0 h SER 99 N 0.57 0.00 -0.93 1.25 0.02 -0.95 -3.48 113.55 110.02 1xg0 h SER 99 Ca 0.15 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.92 1xg0 h SER 99 Cb 0.06 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1xg0 h SER 99 CO -0.02 0.48 -0.20 0.61 -1.14 0.00 0.00 176.83 176.56 1xg0 n GLY 100 N 0.76 0.43 3.35 -3.77 0.00 0.44 -4.94 105.19 101.47 1xg0 n GLY 100 Ca 0.01 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 1xg0 n GLY 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xg0 s ASP 101 N -2.72 -0.38 0.00 1.61 2.15 -0.98 -5.03 116.67 111.31 1xg0 s ASP 101 Ca 0.00 0.32 0.23 0.00 0.43 0.00 0.00 52.55 53.54 1xg0 s ASP 101 Cb 0.00 0.41 0.44 0.00 -0.30 0.00 0.00 42.92 43.47 1xg0 s ASP 101 CO 0.00 -0.52 1.41 0.00 -0.17 0.00 0.00 175.17 175.88 1xg0 n ALA 102 N 1.09 2.44 -0.05 3.66 0.00 -1.26 -4.38 120.51 122.01 1xg0 n ALA 102 Ca -0.20 -0.86 -0.11 0.00 0.00 0.00 0.00 53.44 52.27 1xg0 n ALA 102 Cb 0.57 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 19.07 1xg0 n ALA 102 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xg0 h SER 103 N 4.18 0.25 -0.59 0.00 4.64 -1.97 0.16 113.55 120.22 1xg0 h SER 103 Ca 0.00 -0.14 -0.09 0.00 -0.47 0.00 0.00 61.79 61.10 1xg0 h SER 103 Cb 0.91 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.92 1xg0 h SER 103 CO 0.00 0.32 0.03 0.58 -0.87 0.00 0.00 176.83 176.89 1xg0 h VAL 104 N 0.17 1.26 -0.31 0.95 2.07 -1.99 -0.48 116.25 117.92 1xg0 h VAL 104 Ca 0.06 -1.10 0.04 0.00 0.82 0.00 0.00 66.70 66.53 1xg0 h VAL 104 Cb 0.14 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 1xg0 h VAL 104 CO -0.01 0.40 0.06 0.25 0.02 0.00 0.00 177.57 178.29 1xg0 h LEU 105 N 0.91 0.02 -0.12 2.57 5.85 -1.78 0.11 115.31 122.87 1xg0 h LEU 105 Ca 0.17 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1xg0 h LEU 105 Cb 0.51 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 1xg0 h LEU 105 CO 0.02 0.05 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.84 1xg0 h GLU 106 N 0.18 0.21 -0.06 1.25 5.08 -0.77 -1.14 114.58 119.33 1xg0 h GLU 106 Ca 0.15 -0.07 -0.20 0.00 -1.00 0.00 0.00 59.36 58.24 1xg0 h GLU 106 Cb 0.16 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1xg0 h GLU 106 CO -0.19 0.46 -0.73 0.22 -1.00 0.00 0.00 179.01 177.77 1xg0 h ASP 107 N -0.06 0.74 0.07 1.42 3.58 -0.90 0.03 116.42 121.30 1xg0 h ASP 107 Ca 0.03 -0.70 -0.03 0.00 0.42 0.00 0.00 57.03 56.76 1xg0 h ASP 107 Cb 0.36 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1xg0 h ASP 107 CO 0.01 1.33 -1.96 0.54 -2.88 0.00 0.00 179.24 176.27 1xg0 n ARG 108 N -4.07 0.66 -0.05 0.28 5.12 0.36 -4.40 116.66 114.55 1xg0 n ARG 108 Ca -0.09 -0.16 -0.10 0.00 -1.93 0.00 0.00 57.85 55.57 1xg0 n ARG 108 Cb 0.72 -1.54 -0.04 0.00 -1.16 0.00 0.00 32.46 30.44 1xg0 n ARG 108 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xg0 n LEU 110 N -3.16 1.78 -4.62 0.00 4.77 -0.51 -4.48 117.00 110.78 1xg0 n LEU 110 Ca -0.20 0.17 -0.43 0.00 -0.03 0.00 0.00 56.01 55.52 1xg0 n LEU 110 Cb 0.67 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1xg0 n LEU 110 CO 0.06 0.68 1.62 0.21 -1.33 0.00 0.00 177.39 178.62 1xg0 s ASN 111 N -6.42 6.00 0.00 -1.43 3.84 -0.01 -1.42 114.94 115.50 1xg0 s ASN 111 Ca -0.18 1.91 0.00 0.00 0.21 0.00 0.00 52.86 54.81 1xg0 s ASN 111 Cb 0.07 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.25 1xg0 s ASN 111 CO 0.76 -1.52 0.00 0.61 -2.79 0.00 0.00 177.10 174.16 1xg0 n GLY 112 N 5.13 0.86 0.12 1.21 0.00 -1.26 -4.93 105.19 106.32 1xg0 n GLY 112 Ca 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 1xg0 n GLY 112 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xg0 h LEU 113 N 0.00 0.32 -0.91 0.99 5.85 -1.46 -2.51 115.31 117.59 1xg0 h LEU 113 Ca 0.00 -0.42 0.06 0.00 0.84 0.00 0.00 57.88 58.36 1xg0 h LEU 113 Cb 0.00 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 1xg0 h LEU 113 CO 0.00 0.67 0.57 0.50 -0.34 0.00 0.00 178.44 179.84 1xg0 h LYS 114 N -0.03 1.03 -0.64 1.25 3.64 -1.77 -0.44 116.57 119.59 1xg0 h LYS 114 Ca 0.03 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1xg0 h LYS 114 Cb 0.55 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1xg0 h LYS 114 CO 0.02 0.68 0.42 0.93 -2.27 0.00 0.00 179.45 179.24 1xg0 h GLU 115 N 1.06 0.84 -0.22 1.90 3.07 -1.90 0.13 114.58 119.45 1xg0 h GLU 115 Ca 0.39 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.19 1xg0 h GLU 115 Cb 0.14 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 1xg0 h GLU 115 CO -0.16 0.56 0.11 1.15 -1.40 0.00 0.00 179.01 179.26 1xg0 h THR 116 N 0.87 1.13 -0.46 1.13 2.02 -0.95 -1.88 112.91 114.76 1xg0 h THR 116 Ca 0.24 -0.37 -0.05 0.00 0.77 0.00 0.00 66.41 67.00 1xg0 h THR 116 Cb -0.10 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1xg0 h THR 116 CO -0.05 0.13 0.07 1.88 0.37 0.00 0.00 175.52 177.91 1xg0 h TYR 117 N 0.24 0.75 -0.50 3.16 0.99 -0.69 -1.27 116.97 119.65 1xg0 h TYR 117 Ca 0.08 -0.07 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 1xg0 h TYR 117 Cb 0.10 -0.22 -0.02 0.00 1.00 0.00 0.00 36.73 37.59 1xg0 h TYR 117 CO -0.03 0.66 0.29 0.77 -0.00 0.00 0.00 178.16 179.86 1xg0 h SER 118 N 0.69 0.61 -0.56 3.88 0.02 -0.61 -0.21 113.55 117.37 1xg0 h SER 118 Ca 0.15 -0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 1xg0 h SER 118 Cb 0.32 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1xg0 h SER 118 CO 0.01 0.50 -0.03 -1.28 -1.14 0.00 0.00 176.83 174.88 1xg0 h SER 119 N 0.67 1.01 1.07 3.07 0.87 -0.91 -2.94 113.55 116.40 1xg0 h SER 119 Ca 0.18 -0.30 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 1xg0 h SER 119 Cb 0.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 1xg0 h SER 119 CO -0.03 1.08 -0.24 -0.07 -0.53 0.00 0.00 176.83 177.04 1xg0 h LEU 120 N 0.94 0.00 0.00 2.23 3.38 -1.04 -3.47 115.31 117.34 1xg0 h LEU 120 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1xg0 h LEU 120 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1xg0 h LEU 120 CO 0.03 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.42 1xg0 n GLY 121 N 0.35 0.38 3.66 0.83 0.00 -0.20 -5.03 105.19 105.19 1xg0 n GLY 121 Ca 0.01 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 1xg0 n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xg0 s VAL 122 N -2.00 4.00 -0.00 1.61 1.01 -0.56 -4.94 120.40 119.52 1xg0 s VAL 122 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.92 1xg0 s VAL 122 Cb 0.00 -3.80 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1xg0 s VAL 122 CO 0.00 -0.09 1.45 -2.16 0.00 0.00 0.00 175.10 174.30 1xg0 s PRO 123 N 3.51 4.26 0.19 2.72 0.04 -1.26 -4.71 135.00 139.75 1xg0 s PRO 123 Ca 0.62 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 63.63 1xg0 s PRO 123 Cb -0.26 -3.62 0.11 0.00 0.04 0.00 0.00 34.50 30.76 1xg0 s PRO 123 CO 0.21 -0.63 1.53 0.00 0.04 0.00 0.00 177.00 178.15 1xg0 h ALA 124 N 8.06 0.72 -0.52 8.56 0.00 -1.92 -1.40 119.26 132.75 1xg0 h ALA 124 Ca -0.38 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.01 1xg0 h ALA 124 Cb 1.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1xg0 h ALA 124 CO 0.91 0.67 0.12 -2.95 0.00 0.00 0.00 179.25 178.00 1xg0 h ASN 125 N 0.55 0.80 -0.38 0.00 -1.07 -1.91 0.60 115.58 114.17 1xg0 h ASN 125 Ca 0.04 -0.24 -0.03 0.00 0.07 0.00 0.00 56.30 56.14 1xg0 h ASN 125 Cb 0.98 -0.21 -0.02 0.00 -2.07 0.00 0.00 38.32 37.01 1xg0 h ASN 125 CO 0.09 0.83 0.12 0.28 0.07 0.00 0.00 177.43 178.82 1xg0 h SER 126 N 0.73 0.55 -0.54 6.14 0.02 -1.94 -1.99 113.55 116.51 1xg0 h SER 126 Ca 0.16 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1xg0 h SER 126 Cb 0.34 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 1xg0 h SER 126 CO 0.00 0.60 0.34 -1.13 -1.14 0.00 0.00 176.83 175.50 1xg0 h ASN 127 N 0.46 0.56 -0.95 3.07 -0.73 -1.09 -1.42 115.58 115.49 1xg0 h ASN 127 Ca 0.12 -0.00 0.07 0.00 1.87 0.00 0.00 56.30 58.36 1xg0 h ASN 127 Cb 0.25 -0.13 -0.06 0.00 0.27 0.00 0.00 38.32 38.65 1xg0 h ASN 127 CO -0.00 0.40 0.62 0.00 -0.37 0.00 0.00 177.43 178.07 1xg0 h ALA 128 N 1.22 1.48 -0.38 1.57 0.00 -0.68 -1.16 119.26 121.31 1xg0 h ALA 128 Ca 0.21 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1xg0 h ALA 128 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1xg0 h ALA 128 CO -0.08 0.37 -0.18 -0.09 0.00 0.00 0.00 179.25 179.27 1xg0 h ARG 129 N 1.08 0.79 -0.57 0.00 9.65 -0.61 0.16 114.38 124.89 1xg0 h ARG 129 Ca 0.42 -0.35 0.06 0.00 -1.10 0.00 0.00 59.98 59.01 1xg0 h ARG 129 Cb 0.22 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.72 1xg0 h ARG 129 CO -0.17 0.97 0.27 0.00 2.80 0.00 0.00 179.97 183.85 1xg0 h ALA 130 N 0.80 0.73 -0.68 2.80 0.00 -0.74 -0.51 119.26 121.67 1xg0 h ALA 130 Ca 0.08 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1xg0 h ALA 130 Cb 0.73 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1xg0 h ALA 130 CO 0.06 -0.09 0.28 0.28 0.00 0.00 0.00 179.25 179.77 1xg0 h VAL 131 N 0.51 1.24 -0.51 0.00 2.07 -0.97 -1.30 116.25 117.29 1xg0 h VAL 131 Ca 0.26 -0.75 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 1xg0 h VAL 131 Cb 0.21 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1xg0 h VAL 131 CO -0.20 0.30 -0.02 0.28 0.02 0.00 0.00 177.57 177.95 1xg0 h SER 132 N 0.96 0.84 -0.32 0.57 0.02 -0.46 0.06 113.55 115.23 1xg0 h SER 132 Ca 0.23 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 1xg0 h SER 132 Cb 0.20 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1xg0 h SER 132 CO -0.02 0.92 0.01 0.40 -1.14 0.00 0.00 176.83 177.00 1xg0 h ILE 133 N 0.80 1.25 -1.01 3.27 2.04 -0.91 -1.87 117.51 121.09 1xg0 h ILE 133 Ca 0.15 -0.93 0.06 0.00 1.00 0.00 0.00 64.86 65.14 1xg0 h ILE 133 Cb 0.50 1.23 -0.07 0.00 -0.74 0.00 0.00 36.82 37.75 1xg0 h ILE 133 CO 0.03 0.30 0.65 0.24 0.00 0.00 0.00 178.15 179.37 1xg0 h MET 134 N 0.36 1.16 -0.14 2.37 2.86 -0.85 -0.86 114.93 119.83 1xg0 h MET 134 Ca 0.09 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 1xg0 h MET 134 Cb 0.42 -0.26 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1xg0 h MET 134 CO 0.01 0.77 -0.03 -0.22 1.06 0.00 0.00 176.91 178.51 1xg0 h LYS 135 N 1.20 0.01 -0.80 1.72 3.64 -0.80 -0.26 116.57 121.28 1xg0 h LYS 135 Ca 0.43 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.84 1xg0 h LYS 135 Cb 0.14 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 1xg0 h LYS 135 CO -0.17 0.01 0.51 0.00 -2.27 0.00 0.00 179.45 177.53 1xg0 h ALA 136 N 1.13 1.04 -0.09 5.00 0.00 -0.79 -1.01 119.26 124.55 1xg0 h ALA 136 Ca 0.07 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xg0 h ALA 136 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1xg0 h ALA 136 CO -0.14 0.35 0.01 0.00 0.00 0.00 0.00 179.25 179.47 1xg0 h ALA 138 N 1.06 0.82 -0.39 0.00 0.00 -0.52 -0.90 119.26 119.33 1xg0 h ALA 138 Ca 0.04 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xg0 h ALA 138 Cb 0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1xg0 h ALA 138 CO -0.05 0.33 0.21 0.28 0.00 0.00 0.00 179.25 180.02 1xg0 h VAL 139 N 0.88 1.01 -0.62 0.00 2.07 -1.13 -0.00 116.25 118.44 1xg0 h VAL 139 Ca 0.23 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.55 1xg0 h VAL 139 Cb 0.02 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1xg0 h VAL 139 CO -0.04 0.08 0.20 0.00 0.02 0.00 0.00 177.57 177.83 1xg0 h ALA 140 N 1.19 0.81 -0.65 1.67 0.00 -1.14 -1.63 119.26 119.52 1xg0 h ALA 140 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1xg0 h ALA 140 Cb 0.04 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1xg0 h ALA 140 CO -0.10 0.48 0.18 0.74 0.00 0.00 0.00 179.25 180.55 1xg0 h PHE 141 N 0.89 1.07 -0.47 0.00 0.04 -0.80 0.71 116.94 118.38 1xg0 h PHE 141 Ca 0.20 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 1xg0 h PHE 141 Cb 0.28 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1xg0 h PHE 141 CO 0.02 0.88 0.27 0.28 -0.60 0.00 0.00 178.31 179.16 1xg0 h VAL 142 N 0.95 1.15 -0.00 -0.55 2.07 -0.80 -1.99 116.25 117.08 1xg0 h VAL 142 Ca 0.21 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1xg0 h VAL 142 Cb 0.33 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1xg0 h VAL 142 CO -0.00 0.16 -0.00 0.59 0.02 0.00 0.00 177.57 178.33 1xg0 n ASN 143 N -4.71 0.05 -3.72 0.57 3.02 -0.63 -4.88 115.26 104.96 1xg0 n ASN 143 Ca 0.02 -0.98 -0.24 0.00 -0.03 0.00 0.00 54.58 53.35 1xg0 n ASN 143 Cb 0.06 -0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.26 1xg0 n ASN 143 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1xg0 n ASN 144 N -0.98 -2.90 -0.07 6.41 5.15 -0.02 -4.92 115.26 117.94 1xg0 n ASN 144 Ca 0.23 -0.75 0.02 0.00 -0.60 0.00 0.00 54.58 53.49 1xg0 n ASN 144 Cb 0.12 -4.24 0.04 0.00 -0.53 0.00 0.00 39.78 35.17 1xg0 n ASN 144 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1xg0 n THR 145 N -4.46 1.19 -1.21 -0.44 -2.24 0.04 -4.88 114.28 102.28 1xg0 n THR 145 Ca -0.17 -1.26 -0.29 0.00 -2.27 0.00 0.00 64.05 60.06 1xg0 n THR 145 Cb 0.62 0.35 0.15 0.00 -2.10 0.00 0.00 70.33 69.35 1xg0 n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xg0 s ALA 146 N -1.39 1.30 0.28 6.98 0.00 -1.21 -4.94 121.76 122.78 1xg0 s ALA 146 Ca 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.82 1xg0 s ALA 146 Cb 0.07 -3.15 0.40 0.00 0.00 0.00 0.00 23.12 20.44 1xg0 s ALA 146 CO 0.02 -2.55 1.81 0.66 0.00 0.00 0.00 175.76 175.70 1xg0 h SER 147 N -1.69 0.74 -3.60 0.00 4.64 -1.96 -3.36 113.55 108.33 1xg0 h SER 147 Ca -0.52 -0.14 -0.64 0.00 -0.47 0.00 0.00 61.79 60.02 1xg0 h SER 147 Cb 1.31 -0.19 -0.14 0.00 -0.31 0.00 0.00 62.40 63.06 1xg0 h SER 147 CO 0.56 0.76 -0.00 -1.10 -0.87 0.00 0.00 176.83 176.17 1xg0 s GLN 148 N -5.13 3.70 0.08 4.77 -1.52 -1.26 -5.07 119.66 115.23 1xg0 s GLN 148 Ca -0.09 -0.04 0.05 0.00 -1.95 0.00 0.00 55.36 53.33 1xg0 s GLN 148 Cb 0.15 -3.78 -0.04 0.00 -0.22 0.00 0.00 33.01 29.12 1xg0 s GLN 148 CO 0.80 -0.62 -0.04 0.15 -0.25 0.00 0.00 175.29 175.34 1xg0 s LYS 149 N 2.45 2.45 -0.01 2.91 1.02 -1.26 -4.93 119.74 122.37 1xg0 s LYS 149 Ca 0.20 -0.86 -0.28 0.00 0.02 0.00 0.00 55.97 55.06 1xg0 s LYS 149 Cb -0.15 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.64 1xg0 s LYS 149 CO 0.13 0.55 0.88 0.21 -0.92 0.00 0.00 175.35 176.20 1xg0 s LYS 150 N -2.10 4.53 0.01 1.68 2.20 -1.26 -4.96 119.74 119.84 1xg0 s LYS 150 Ca 0.23 1.24 -0.21 0.00 -0.36 0.00 0.00 55.97 56.87 1xg0 s LYS 150 Cb -0.11 -3.44 -0.19 0.00 -1.51 0.00 0.00 37.83 32.57 1xg0 s LYS 150 CO 0.15 0.03 1.19 1.25 -0.36 0.00 0.00 175.35 177.61 1xg0 h LEU 151 N 6.62 0.42 -0.89 5.43 5.85 -2.01 -3.38 115.31 127.35 1xg0 h LEU 151 Ca -0.41 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 57.66 1xg0 h LEU 151 Cb 1.21 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1xg0 h LEU 151 CO 0.75 1.00 -0.37 -1.54 -0.34 0.00 0.00 178.44 177.93 1xg0 n SER 152 N -4.41 1.76 -4.74 1.25 3.41 -1.26 -4.99 113.62 104.64 1xg0 n SER 152 Ca -0.08 -1.35 -0.42 0.00 -0.26 0.00 0.00 58.87 56.76 1xg0 n SER 152 Cb 0.51 0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 64.78 1xg0 n SER 152 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1xg0 s THR 153 N -2.45 2.20 0.29 6.66 2.01 -1.26 -4.93 115.64 118.15 1xg0 s THR 153 Ca 0.21 0.16 -0.30 0.00 0.31 0.00 0.00 61.69 62.07 1xg0 s THR 153 Cb 0.19 -3.10 -0.12 0.00 0.01 0.00 0.00 72.50 69.47 1xg0 s THR 153 CO 0.54 0.02 1.54 -2.65 -0.69 0.00 0.00 174.62 173.38 1xg0 n PRO 154 N 2.52 2.53 -1.94 4.92 -0.02 -1.26 -4.91 135.00 136.83 1xg0 n PRO 154 Ca 0.09 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 62.05 1xg0 n PRO 154 Cb 0.38 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.19 1xg0 n PRO 154 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1xg0 s GLN 155 N -0.60 4.22 0.00 -0.52 2.00 -1.26 -4.97 119.66 118.53 1xg0 s GLN 155 Ca 0.64 2.38 0.00 0.00 -2.00 0.00 0.00 55.36 56.39 1xg0 s GLN 155 Cb -0.53 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.18 1xg0 s GLN 155 CO 0.50 -0.50 0.00 0.41 -0.50 0.00 0.00 175.29 175.20 1xg0 n GLY 156 N 2.40 -1.30 3.61 2.59 0.00 -1.26 -5.13 105.19 106.10 1xg0 n GLY 156 Ca 0.08 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.72 1xg0 n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xg0 s ASP 157 N -0.84 6.04 -0.18 1.61 2.15 -1.26 -4.93 116.67 119.25 1xg0 s ASP 157 Ca 0.00 0.03 0.16 0.00 0.43 0.00 0.00 52.55 53.17 1xg0 s ASP 157 Cb 0.00 -2.11 0.50 0.00 -0.30 0.00 0.00 42.92 41.01 1xg0 s ASP 157 CO 0.00 -0.02 1.39 0.00 -0.17 0.00 0.00 175.17 176.38 1xg0 h SER 159 N 1.50 0.07 -0.14 0.00 4.64 -1.94 -0.64 113.55 117.04 1xg0 h SER 159 Ca 0.02 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1xg0 h SER 159 Cb 1.42 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1xg0 h SER 159 CO 0.21 0.05 0.03 1.23 -0.87 0.00 0.00 176.83 177.48 1xg0 h GLY 160 N 0.08 0.24 1.45 -0.77 0.00 -2.00 -0.38 103.07 101.69 1xg0 h GLY 160 Ca 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 1xg0 h GLY 160 CO -0.01 0.15 0.11 1.41 0.00 0.00 0.00 176.54 178.20 1xg0 h LEU 161 N 0.01 0.65 -0.68 3.11 3.38 -1.81 -0.50 115.31 119.47 1xg0 h LEU 161 Ca 0.04 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1xg0 h LEU 161 Cb 0.28 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1xg0 h LEU 161 CO 0.00 0.65 -0.07 0.00 0.09 0.00 0.00 178.44 179.11 1xg0 h ALA 162 N 1.44 0.88 -0.58 1.53 0.00 -0.96 -0.67 119.26 120.91 1xg0 h ALA 162 Ca 0.15 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1xg0 h ALA 162 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xg0 h ALA 162 CO -0.00 0.65 0.17 1.03 0.00 0.00 0.00 179.25 181.09 1xg0 h SER 163 N 0.86 0.86 -0.11 0.00 0.87 -0.66 -1.60 113.55 113.77 1xg0 h SER 163 Ca 0.15 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1xg0 h SER 163 Cb 0.60 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1xg0 h SER 163 CO 0.04 0.85 0.07 -0.08 -0.53 0.00 0.00 176.83 177.18 1xg0 h GLU 164 N 0.82 0.15 -0.48 2.24 4.81 -0.73 -1.09 114.58 120.30 1xg0 h GLU 164 Ca 0.18 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.33 1xg0 h GLU 164 Cb 0.31 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1xg0 h GLU 164 CO -0.00 0.11 0.01 -0.24 -0.73 0.00 0.00 179.01 178.16 1xg0 h VAL 165 N 0.13 1.24 -0.98 0.32 3.04 -1.08 -1.93 116.25 116.99 1xg0 h VAL 165 Ca 0.04 -0.98 0.06 0.00 -1.01 0.00 0.00 66.70 64.82 1xg0 h VAL 165 Cb 0.00 0.86 -0.06 0.00 -2.01 0.00 0.00 31.29 30.08 1xg0 h VAL 165 CO -0.01 0.35 0.63 1.23 -1.01 0.00 0.00 177.57 178.76 1xg0 h GLY 166 N 0.97 1.47 1.59 3.17 0.00 -0.88 -1.62 103.07 107.77 1xg0 h GLY 166 Ca 0.15 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 1xg0 h GLY 166 CO 0.02 0.34 -0.03 -1.33 0.00 0.00 0.00 176.54 175.53 1xg0 h GLY 167 N 1.15 0.54 0.94 4.60 0.00 -0.44 -0.70 103.07 109.16 1xg0 h GLY 167 Ca 0.42 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1xg0 h GLY 167 CO -0.16 0.31 0.01 -0.97 0.00 0.00 0.00 176.54 175.73 1xg0 h TYR 168 N 0.48 0.73 -0.99 5.60 0.05 -0.87 -1.51 116.97 120.46 1xg0 h TYR 168 Ca 0.10 -0.12 0.07 0.00 0.05 0.00 0.00 58.73 58.82 1xg0 h TYR 168 Cb 0.37 -0.19 -0.07 0.00 1.01 0.00 0.00 36.73 37.85 1xg0 h TYR 168 CO 0.01 0.75 0.63 0.74 -1.05 0.00 0.00 178.16 179.25 1xg0 h PHE 169 N 0.50 1.18 -0.18 4.88 -1.00 -1.00 -2.19 116.94 119.12 1xg0 h PHE 169 Ca 0.11 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.87 1xg0 h PHE 169 Cb 0.45 -0.39 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 1xg0 h PHE 169 CO 0.04 0.61 -0.13 -0.44 -1.61 0.00 0.00 178.31 176.77 1xg0 h ASP 170 N 1.15 0.27 -0.74 2.17 3.32 -0.77 -0.58 116.42 121.24 1xg0 h ASP 170 Ca 0.43 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.39 1xg0 h ASP 170 Cb 0.17 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1xg0 h ASP 170 CO -0.17 0.43 0.35 0.11 -1.72 0.00 0.00 179.24 178.24 1xg0 h LYS 171 N 0.27 1.06 -0.00 3.56 1.57 -0.67 -0.24 116.57 122.11 1xg0 h LYS 171 Ca 0.05 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xg0 h LYS 171 Cb 0.40 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1xg0 h LYS 171 CO 0.02 0.83 0.00 0.28 -0.57 0.00 0.00 179.45 180.02 1xg0 h VAL 172 N 1.03 1.03 -0.48 0.50 2.07 -0.84 -1.53 116.25 118.04 1xg0 h VAL 172 Ca 0.25 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.73 1xg0 h VAL 172 Cb 0.12 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1xg0 h VAL 172 CO -0.03 0.02 0.21 0.74 0.02 0.00 0.00 177.57 178.54 1xg0 h THR 173 N -0.03 0.91 -0.60 2.57 2.02 -0.93 -1.90 112.91 114.95 1xg0 h THR 173 Ca 0.00 -0.14 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 1xg0 h THR 173 Cb 0.04 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 66.87 1xg0 h THR 173 CO -0.00 0.08 0.21 0.00 0.37 0.00 0.00 175.52 176.18 1xg0 h ALA 174 N 1.28 1.24 -0.17 6.16 0.00 -0.91 -1.42 119.26 125.44 1xg0 h ALA 174 Ca 0.22 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 1xg0 h ALA 174 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xg0 h ALA 174 CO -0.18 0.55 -0.56 0.00 0.00 0.00 0.00 179.25 179.06 1xg0 h ALA 175 N 1.36 0.72 -0.00 0.00 0.00 -0.58 -3.33 119.26 117.42 1xg0 h ALA 175 Ca 0.20 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1xg0 h ALA 175 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xg0 h ALA 175 CO -0.01 0.69 -0.66 0.44 0.00 0.00 0.00 179.25 179.71 1xg0 n ILE 176 N -3.95 0.00 1.53 0.00 -5.35 -0.78 -4.44 119.36 106.37 1xg0 n ILE 176 Ca -0.03 -0.17 0.12 0.00 -0.27 0.00 0.00 62.75 62.40 1xg0 n ILE 176 Cb 0.61 1.05 0.72 0.00 -1.74 0.00 0.00 39.64 40.28 1xg0 n ILE 176 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59