#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2buy s LEU 5 N 0.00 4.32 0.11 4.31 1.43 -1.26 -5.11 118.68 122.48 2buy s LEU 5 Ca 0.00 0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 53.19 2buy s LEU 5 Cb 0.00 -2.92 -0.06 0.00 0.03 0.00 0.00 46.19 43.24 2buy s LEU 5 CO 0.00 0.01 0.40 -0.54 0.23 0.00 0.00 176.35 176.45 2buy s LYS 6 N -3.43 3.71 0.40 1.70 1.02 -1.26 -5.05 119.74 116.84 2buy s LYS 6 Ca 0.35 0.10 -0.27 0.00 0.02 0.00 0.00 55.97 56.17 2buy s LYS 6 Cb -0.11 -2.93 -0.10 0.00 -0.52 0.00 0.00 37.83 34.18 2buy s LYS 6 CO 0.29 0.51 1.36 -1.91 -0.92 0.00 0.00 175.35 174.68 2buy n GLU 7 N 0.58 2.23 -1.70 1.68 2.13 -1.26 -4.91 120.64 119.39 2buy n GLU 7 Ca -0.06 0.79 -0.44 0.00 0.66 0.00 0.00 57.16 58.12 2buy n GLU 7 Cb 0.52 -2.49 -0.03 0.00 0.27 0.00 0.00 31.44 29.71 2buy n GLU 7 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 2buy n THR 8 N 0.09 0.17 -2.22 6.31 -1.04 -1.26 -4.91 114.28 111.42 2buy n THR 8 Ca 0.04 -0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 2buy n THR 8 Cb 0.39 -1.80 -0.02 0.00 -1.82 0.00 0.00 70.33 67.08 2buy n THR 8 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2buy s PRO 9 N 0.80 4.25 0.65 -2.82 0.04 -1.26 -5.02 135.00 131.63 2buy s PRO 9 Ca 0.75 2.03 -0.15 0.00 0.04 0.00 0.00 61.00 63.67 2buy s PRO 9 Cb -0.57 -2.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.04 2buy s PRO 9 CO 0.37 -0.21 1.09 0.45 0.04 0.00 0.00 177.00 178.73 2buy s SER 10 N -0.79 5.33 0.04 6.66 0.15 -1.26 -5.08 113.70 118.75 2buy s SER 10 Ca 0.52 1.89 -0.05 0.00 0.70 0.00 0.00 55.95 59.02 2buy s SER 10 Cb -0.35 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.40 2buy s SER 10 CO 0.46 -1.48 0.07 -1.10 1.20 0.00 0.00 173.24 172.39 2buy s GLN 11 N -4.21 0.57 0.71 5.44 -1.52 -1.19 -4.92 119.66 114.54 2buy s GLN 11 Ca 0.65 -0.79 -0.16 0.00 -1.95 0.00 0.00 55.36 53.11 2buy s GLN 11 Cb -0.18 0.22 -0.00 0.00 -0.22 0.00 0.00 33.01 32.83 2buy s GLN 11 CO 0.42 -0.14 0.94 -2.37 -0.25 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4.01 -1.26 -4.66 117.16 115.91 2buy n TYR 16 Ca 0.01 -1.33 0.07 0.00 -0.16 0.00 0.00 57.90 56.49 2buy n TYR 16 Cb 0.25 -0.55 0.37 0.00 -0.31 0.00 0.00 39.34 39.10 2buy n TYR 16 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 2buy h VAL 17 N 1.65 0.00 0.00 -0.72 3.04 -1.68 -0.05 116.25 118.50 2buy h VAL 17 Ca 0.22 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.79 2buy h VAL 17 Cb 1.92 0.30 -0.02 0.00 -2.01 0.00 0.00 31.29 31.48 2buy h VAL 17 CO 0.52 0.00 -0.56 0.45 -1.01 0.00 0.00 177.57 176.97 2buy h HIS 18 N 0.00 0.00 -0.44 3.17 3.86 -1.90 -1.56 115.15 118.28 2buy h HIS 18 Ca 0.00 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.26 2buy h HIS 18 Cb 0.75 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.17 2buy h HIS 18 CO 0.00 0.56 0.17 0.82 0.86 0.00 0.00 177.93 180.34 2buy h ILE 19 N 0.00 0.89 0.00 2.45 2.04 -1.28 0.29 117.51 121.90 2buy h ILE 19 Ca -0.01 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.65 2buy h ILE 19 Cb 1.11 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2buy h ILE 19 CO 0.07 0.07 -1.65 0.61 0.00 0.00 0.00 178.15 177.25 2buy n GLY 20 N -1.24 -1.17 0.02 5.37 0.00 -1.20 -3.51 105.19 103.46 2buy n GLY 20 Ca 0.03 -0.33 0.07 0.00 0.00 0.00 0.00 46.02 45.80 2buy n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2buy n LEU 21 N -2.57 0.00 -3.18 0.99 4.77 -0.59 -4.63 117.00 111.78 2buy n LEU 21 Ca -0.08 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.71 2buy n LEU 21 Cb 0.70 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.84 2buy n LEU 21 CO 0.43 0.08 -0.23 0.18 -1.33 0.00 0.00 177.39 176.53 2buy n LEU 22 N -2.32 0.64 -0.42 2.23 4.77 0.04 -4.88 117.00 117.06 2buy n LEU 22 Ca -0.09 -4.92 0.34 0.00 -0.03 0.00 0.00 56.01 51.31 2buy n LEU 22 Cb 0.65 0.71 0.62 0.00 -2.33 0.00 0.00 43.42 43.07 2buy n LEU 22 CO 0.44 2.25 1.23 1.55 -1.33 0.00 0.00 177.39 181.53 2buy h PRO 23 N 3.17 0.14 -0.82 3.23 0.13 -1.46 0.19 132.00 136.59 2buy h PRO 23 Ca 0.09 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 65.25 2buy h PRO 23 Cb 0.96 -0.03 -0.05 0.00 0.13 0.00 0.00 31.00 32.00 2buy h PRO 23 CO 0.48 0.09 0.52 0.87 -0.23 0.00 0.00 178.00 179.74 2buy h LYS 24 N 0.15 0.97 0.00 0.86 1.79 -1.86 0.15 116.57 118.62 2buy h LYS 24 Ca 0.77 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 59.19 2buy h LYS 24 Cb 2.35 -0.22 0.00 0.00 -1.58 0.00 0.00 32.23 32.78 2buy h LYS 24 CO -0.40 0.64 0.00 0.37 -1.08 0.00 0.00 179.45 178.98 2buy h GLN 25 N 1.00 0.00 -0.16 3.15 4.15 -0.93 -0.27 115.11 122.04 2buy h GLN 25 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.76 2buy h GLN 25 Cb 0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.74 2buy h GLN 25 CO -0.13 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 176.77 2buy n ALA 26 N -2.03 2.46 -3.06 3.38 0.00 -0.24 -4.96 120.51 116.06 2buy n ALA 26 Ca -0.01 -0.77 -0.13 0.00 0.00 0.00 0.00 53.44 52.54 2buy n ALA 26 Cb 0.19 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 18.80 2buy n ALA 26 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2buy n ASN 27 N 1.24 -4.09 -4.07 0.00 4.13 -0.11 -5.03 115.26 107.32 2buy n ASN 27 Ca 0.16 -0.30 -0.32 0.00 1.68 0.00 0.00 54.58 55.80 2buy n ASN 27 Cb 0.57 -3.00 -0.15 0.00 -1.54 0.00 0.00 39.78 35.65 2buy n ASN 27 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2buy s ILE 28 N -3.18 2.04 -0.91 2.41 1.01 0.37 -4.99 121.20 117.96 2buy s ILE 28 Ca 0.28 -1.30 -0.09 0.00 0.00 0.00 0.00 60.65 59.53 2buy s ILE 28 Cb -0.12 -2.04 0.23 0.00 0.01 0.00 0.00 42.46 40.54 2buy s ILE 28 CO 0.40 0.19 0.85 -1.61 0.00 0.00 0.00 174.94 174.77 2buy s GLU 29 N 1.21 3.64 -0.06 2.79 2.02 -1.26 -3.76 118.70 123.29 2buy s GLU 29 Ca -0.03 -2.83 0.09 0.00 0.02 0.00 0.00 54.97 52.22 2buy s GLU 29 Cb -0.17 -4.33 -0.14 0.00 0.10 0.00 0.00 34.13 29.59 2buy s GLU 29 CO -0.08 -1.26 0.12 1.33 0.02 0.00 0.00 175.26 175.39 2buy n VAL 30 N 3.28 0.37 -4.43 2.63 0.24 -1.26 -5.01 118.33 114.15 2buy n VAL 30 Ca 0.17 -0.33 -0.34 0.00 -2.04 0.00 0.00 64.34 61.81 2buy n VAL 30 Cb 0.42 -0.31 -0.10 0.00 -1.47 0.00 0.00 33.84 32.38 2buy n VAL 30 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2buy s PHE 31 N -2.44 3.04 -0.06 6.34 2.99 -1.26 -5.02 117.98 121.58 2buy s PHE 31 Ca -0.04 0.09 -0.26 0.00 0.00 0.00 0.00 56.93 56.72 2buy s PHE 31 Cb 0.04 -1.71 -0.22 0.00 0.00 0.00 0.00 43.02 41.13 2buy s PHE 31 CO 0.41 0.42 1.07 1.49 -0.00 0.00 0.00 175.22 178.60 2buy h GLU 32 N 4.88 0.09 -4.92 0.44 4.81 -2.01 -3.42 114.58 114.44 2buy h GLU 32 Ca -0.49 -0.09 -0.64 0.00 -0.13 0.00 0.00 59.36 58.01 2buy h GLU 32 Cb 1.18 0.02 -0.17 0.00 0.63 0.00 0.00 28.75 30.41 2buy h GLU 32 CO 0.54 0.79 -0.52 -1.01 -0.73 0.00 0.00 179.01 178.09 2buy s HIS 33 N -3.35 3.23 0.02 0.92 3.76 -1.26 -5.08 115.29 113.53 2buy s HIS 33 Ca -0.16 0.13 0.05 0.00 -0.15 0.00 0.00 55.06 54.92 2buy s HIS 33 Cb 0.01 -2.37 -0.03 0.00 1.11 0.00 0.00 32.58 31.30 2buy s HIS 33 CO 0.71 -0.13 -0.12 -0.80 -0.85 0.00 0.00 174.74 173.54 2buy s ASN 34 N 1.68 4.22 0.29 1.40 0.01 -1.26 -5.11 114.94 116.16 2buy s ASN 34 Ca 0.07 -0.28 -0.21 0.00 -0.71 0.00 0.00 52.86 51.73 2buy s ASN 34 Cb -0.16 -0.85 -0.09 0.00 0.41 0.00 0.00 41.25 40.56 2buy s ASN 34 CO 0.10 0.27 0.81 -0.76 -1.51 0.00 0.00 177.10 176.02 2buy s LEU 35 N -1.42 4.26 0.00 0.60 1.43 -1.26 -5.05 118.68 117.24 2buy s LEU 35 Ca 0.16 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.81 2buy s LEU 35 Cb -0.11 -3.89 0.00 0.00 0.03 0.00 0.00 46.19 42.22 2buy s LEU 35 CO 0.06 -0.08 0.00 -0.90 0.23 0.00 0.00 176.35 175.67 2buy n ASP 36 N 0.36 0.00 -1.39 2.29 5.68 -1.26 -4.91 116.55 117.32 2buy n ASP 36 Ca 0.01 -0.33 0.08 0.00 -0.50 0.00 0.00 54.79 54.05 2buy n ASP 36 Cb 0.51 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.80 2buy n ASP 36 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2buy n ASN 37 N -0.60 4.08 -4.21 -1.12 6.94 -0.84 -1.52 115.26 117.99 2buy n ASN 37 Ca 0.00 -2.34 -0.38 0.00 -0.02 0.00 0.00 54.58 51.84 2buy n ASN 37 Cb 0.00 -0.52 -0.12 0.00 -2.36 0.00 0.00 39.78 36.78 2buy n ASN 37 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2buy s ASN 38 N -0.85 5.33 0.00 0.53 3.04 -1.26 -1.69 114.94 120.04 2buy s ASN 38 Ca 0.44 -1.55 0.26 0.00 0.04 0.00 0.00 52.86 52.05 2buy s ASN 38 Cb 0.28 -1.87 0.61 0.00 -1.54 0.00 0.00 41.25 38.72 2buy s ASN 38 CO 0.22 -0.45 1.49 0.18 -3.04 0.00 0.00 177.10 175.50 2buy n LEU 39 N 4.75 2.19 -4.60 3.21 4.32 -0.09 -4.86 117.00 121.92 2buy n LEU 39 Ca -0.09 -0.73 -0.40 0.00 -0.02 0.00 0.00 56.01 54.78 2buy n LEU 39 Cb 0.43 -0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.14 2buy n LEU 39 CO 0.34 0.37 0.10 -0.69 -1.22 0.00 0.00 177.39 176.28 2buy s VAL 40 N -2.04 5.15 0.36 4.08 1.01 -1.25 -4.65 120.40 123.06 2buy s VAL 40 Ca 0.32 0.54 0.07 0.00 0.00 0.00 0.00 61.98 62.91 2buy s VAL 40 Cb 0.20 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 2buy s VAL 40 CO 0.33 0.09 0.49 -1.10 0.00 0.00 0.00 175.10 174.91 2buy s GLN 41 N 2.12 3.02 0.26 2.72 -0.21 -1.26 -5.00 119.66 121.30 2buy s GLN 41 Ca 0.16 -1.09 -0.03 0.00 0.02 0.00 0.00 55.36 54.41 2buy s GLN 41 Cb -0.16 -2.78 0.38 0.00 1.00 0.00 0.00 33.01 31.45 2buy s GLN 41 CO 0.10 -0.03 1.87 0.38 -2.12 0.00 0.00 175.29 175.49 2buy h ASP 42 N 0.84 0.96 -0.47 5.90 2.03 -1.97 -1.97 116.42 121.74 2buy h ASP 42 Ca -0.44 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 2buy h ASP 42 Cb 1.26 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 39.57 2buy h ASP 42 CO 0.51 0.61 0.00 0.59 -1.03 0.00 0.00 179.24 179.92 2buy n ASN 43 N -4.55 2.49 -4.76 4.15 4.13 -1.26 -4.96 115.26 110.50 2buy n ASN 43 Ca 0.14 -2.00 -0.41 0.00 1.68 0.00 0.00 54.58 53.99 2buy n ASN 43 Cb 0.19 -0.31 -0.02 0.00 -1.54 0.00 0.00 39.78 38.10 2buy n ASN 43 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2buy s THR 44 N -1.38 2.46 0.41 3.41 2.01 -0.74 -4.86 115.64 116.94 2buy s THR 44 Ca 0.31 0.41 -0.10 0.00 0.31 0.00 0.00 61.69 62.62 2buy s THR 44 Cb 0.16 -3.26 -0.06 0.00 0.01 0.00 0.00 72.50 69.35 2buy s THR 44 CO 0.21 0.08 0.76 -1.10 -0.69 0.00 0.00 174.62 173.88 2buy s GLN 45 N -0.90 3.75 0.00 4.92 -0.21 -1.26 -4.93 119.66 121.03 2buy s GLN 45 Ca 0.57 0.42 0.00 0.00 0.02 0.00 0.00 55.36 56.37 2buy s GLN 45 Cb -0.43 -2.40 0.00 0.00 1.00 0.00 0.00 33.01 31.17 2buy s GLN 45 CO 0.49 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 174.03 2buy n GLY 46 N -1.37 1.49 3.69 3.09 0.00 -1.26 -4.56 105.19 106.27 2buy n GLY 46 Ca 0.02 -2.12 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 2buy n GLY 46 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2buy s GLN 47 N -1.68 4.37 0.19 1.61 -2.07 -1.26 -4.94 119.66 115.87 2buy s GLN 47 Ca 0.00 0.88 -0.30 0.00 -1.82 0.00 0.00 55.36 54.12 2buy s GLN 47 Cb 0.00 -3.50 -0.09 0.00 -1.09 0.00 0.00 33.01 28.33 2buy s GLN 47 CO 0.00 -0.09 1.32 1.03 -1.32 0.00 0.00 175.29 176.23 2buy s ARG 48 N 1.34 4.37 0.06 9.60 3.00 -1.26 -1.30 118.95 134.77 2buy s ARG 48 Ca 0.37 2.06 -0.02 0.00 0.00 0.00 0.00 55.73 58.13 2buy s ARG 48 Cb -0.17 -3.20 -0.03 0.00 0.00 0.00 0.00 34.95 31.55 2buy s ARG 48 CO 0.15 -0.28 0.01 0.96 0.00 0.00 0.00 175.30 176.14 2buy s ILE 49 N 0.25 0.20 -0.10 1.52 -4.36 -0.38 -4.51 121.20 113.83 2buy s ILE 49 Ca 0.58 -1.68 0.03 0.00 -0.26 0.00 0.00 60.65 59.31 2buy s ILE 49 Cb -0.37 -1.47 -0.01 0.00 1.25 0.00 0.00 42.46 41.86 2buy s ILE 49 CO 0.37 -0.93 -0.18 -0.60 0.24 0.00 0.00 174.94 173.84 2buy s ARG 50 N -3.88 3.02 -0.18 0.37 3.52 0.26 -1.75 118.95 120.31 2buy s ARG 50 Ca 0.06 -0.78 -0.03 0.00 -0.13 0.00 0.00 55.73 54.86 2buy s ARG 50 Cb 0.07 -2.42 -0.01 0.00 -1.56 0.00 0.00 34.95 31.03 2buy s ARG 50 CO -0.10 0.29 -0.07 -1.17 -0.81 0.00 0.00 175.30 173.44 2buy s LEU 51 N 0.11 2.92 0.12 -0.88 2.96 -0.22 -0.31 118.68 123.37 2buy s LEU 51 Ca -0.09 -0.31 -0.09 0.00 -0.22 0.00 0.00 54.13 53.42 2buy s LEU 51 Cb -0.15 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 2buy s LEU 51 CO 0.06 0.08 0.24 -1.83 -1.32 0.00 0.00 176.35 173.58 2buy s GLU 52 N 0.85 0.96 0.00 1.98 -1.05 -0.57 -1.04 118.70 119.84 2buy s GLU 52 Ca -0.02 -1.00 0.00 0.00 -0.15 0.00 0.00 54.97 53.80 2buy s GLU 52 Cb -0.15 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 2buy s GLU 52 CO 0.01 -0.33 0.00 0.41 0.95 0.00 0.00 175.26 176.30 2buy n GLY 53 N -0.12 -1.02 3.22 -3.83 0.00 -0.97 0.00 105.19 102.47 2buy n GLY 53 Ca -0.13 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 2buy n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2buy s GLN 54 N -0.82 1.01 -0.14 1.61 -0.21 -1.26 -1.30 119.66 118.55 2buy s GLN 54 Ca 0.00 -1.45 0.01 0.00 0.02 0.00 0.00 55.36 53.94 2buy s GLN 54 Cb 0.00 -0.29 -0.00 0.00 1.00 0.00 0.00 33.01 33.72 2buy s GLN 54 CO 0.00 -0.06 -0.17 0.08 -2.12 0.00 0.00 175.29 173.02 2buy s VAL 55 N -3.60 2.56 -0.01 1.09 1.01 -1.26 -0.60 120.40 119.59 2buy s VAL 55 Ca 0.19 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.38 2buy s VAL 55 Cb 0.05 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2buy s VAL 55 CO 0.00 0.53 -0.07 -0.36 0.00 0.00 0.00 175.10 175.20 2buy s PHE 56 N 0.70 2.89 0.55 5.22 0.40 0.20 -0.37 117.98 127.57 2buy s PHE 56 Ca -0.08 -0.03 -0.04 0.00 -0.60 0.00 0.00 56.93 56.18 2buy s PHE 56 Cb -0.16 -1.63 0.12 0.00 0.51 0.00 0.00 43.02 41.86 2buy s PHE 56 CO 0.02 0.36 0.74 -0.40 0.70 0.00 0.00 175.22 176.64 2buy n ASP 57 N 1.69 0.58 0.00 1.36 5.68 -0.08 -1.65 116.55 124.12 2buy n ASP 57 Ca -0.16 -1.59 0.06 0.00 -0.50 0.00 0.00 54.79 52.60 2buy n ASP 57 Cb 0.53 -0.52 0.28 0.00 -1.14 0.00 0.00 41.12 40.26 2buy n ASP 57 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2buy n GLY 58 N -0.33 -0.79 0.89 6.12 0.00 -1.26 -1.24 105.19 108.58 2buy n GLY 58 Ca 0.11 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.17 2buy n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2buy n LEU 59 N -1.39 3.03 0.00 0.99 4.77 -1.26 -4.88 117.00 118.26 2buy n LEU 59 Ca 0.04 -1.52 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 2buy n LEU 59 Cb 0.11 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2buy n LEU 59 CO 0.10 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2buy n GLY 60 N 1.09 0.59 3.86 -0.72 0.00 -0.37 -5.05 105.19 104.58 2buy n GLY 60 Ca 0.15 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 2buy n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2buy s LEU 61 N 0.00 4.43 0.42 0.99 1.02 -1.26 -4.79 118.68 119.49 2buy s LEU 61 Ca 0.00 0.78 -0.24 0.00 0.02 0.00 0.00 54.13 54.69 2buy s LEU 61 Cb 0.00 -2.51 -0.08 0.00 0.02 0.00 0.00 46.19 43.62 2buy s LEU 61 CO 0.00 0.32 1.13 -2.16 0.02 0.00 0.00 176.35 175.66 2buy s PRO 62 N -1.23 3.99 -0.13 1.29 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-0.09 -0.71 -0.04 0.00 0.10 0.00 0.00 34.13 33.39 2buy s GLU 69 CO 0.01 0.14 -0.13 0.96 0.02 0.00 0.00 175.26 176.26 2buy s ILE 70 N -1.79 1.38 -0.06 -1.63 -4.36 -0.78 -1.82 121.20 112.13 2buy s ILE 70 Ca 0.02 -1.95 -0.02 0.00 -0.26 0.00 0.00 60.65 58.44 2buy s ILE 70 Cb -0.07 -1.76 0.04 0.00 1.25 0.00 0.00 42.46 41.92 2buy s ILE 70 CO 0.02 -0.57 0.12 0.86 0.24 0.00 0.00 174.94 175.61 2buy s TRP 71 N -2.72 -0.12 0.24 1.37 -0.00 -0.10 -2.77 118.94 114.84 2buy s TRP 71 Ca 0.15 0.42 -0.17 0.00 -0.00 0.00 0.00 56.10 56.49 2buy s TRP 71 Cb -0.01 -0.15 0.02 0.00 -0.00 0.00 0.00 33.47 33.32 2buy s TRP 71 CO 0.03 -0.16 0.57 1.14 -0.00 0.00 0.00 176.95 178.53 2buy s GLN 72 N 1.33 1.56 0.59 5.86 -2.07 -0.67 -0.94 119.66 125.32 2buy s GLN 72 Ca -0.07 -1.02 -0.02 0.00 -1.82 0.00 0.00 55.36 52.43 2buy s GLN 72 Cb -0.12 0.54 0.04 0.00 -1.09 0.00 0.00 33.01 32.37 2buy s GLN 72 CO -0.05 -0.68 0.86 0.00 -1.32 0.00 0.00 175.29 174.09 2buy s ALA 73 N -3.93 3.59 1.00 2.60 0.00 -1.26 -4.61 121.76 119.14 2buy s ALA 73 Ca 0.14 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.99 2buy s ALA 73 Cb -0.02 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2buy s ALA 73 CO 0.04 -0.90 0.00 -0.40 0.00 0.00 0.00 175.76 174.50 2buy n ASP 74 N -2.53 -0.19 0.26 0.00 5.68 0.01 -4.50 116.55 115.27 2buy n ASP 74 Ca 0.07 -0.83 0.10 0.00 -0.50 0.00 0.00 54.79 53.63 2buy n ASP 74 Cb 0.60 0.00 0.69 0.00 -1.14 0.00 0.00 41.12 41.27 2buy n ASP 74 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2buy h THR 75 N -1.03 0.77 -0.61 2.12 1.03 -1.81 -0.88 112.91 112.51 2buy h THR 75 Ca 0.00 -0.41 0.00 0.00 -0.01 0.00 0.00 66.41 65.99 2buy h THR 75 Cb 0.00 1.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.32 2buy h THR 75 CO 0.00 0.10 0.00 0.59 -0.01 0.00 0.00 175.52 176.20 2buy n ASN 76 N -3.97 4.33 -0.61 0.00 3.02 -1.26 -2.99 115.26 113.78 2buy n ASN 76 Ca -0.02 -2.37 -0.05 0.00 -0.03 0.00 0.00 54.58 52.11 2buy n ASN 76 Cb 0.19 -0.54 -0.00 0.00 -0.61 0.00 0.00 39.78 38.82 2buy n ASN 76 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2buy n GLY 77 N 1.13 0.18 3.26 7.41 0.00 -0.70 -4.72 105.19 111.76 2buy n GLY 77 Ca 0.24 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 2buy n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2buy s VAL 78 N -2.29 2.16 0.16 1.61 1.01 -1.26 -4.53 120.40 117.26 2buy s VAL 78 Ca 0.01 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 60.71 2buy s VAL 78 Cb -0.00 -1.81 -0.08 0.00 0.00 0.00 0.00 36.38 34.49 2buy s VAL 78 CO 0.01 0.56 0.82 -0.31 0.00 0.00 0.00 175.10 176.18 2buy s TYR 79 N 0.07 3.89 -1.39 5.22 1.51 -1.26 -0.81 117.35 124.57 2buy s TYR 79 Ca -0.10 1.68 -0.11 0.00 -1.01 0.00 0.00 57.07 57.53 2buy s TYR 79 Cb -0.16 -2.84 0.09 0.00 -0.11 0.00 0.00 41.96 38.94 2buy s TYR 79 CO 0.06 0.44 2.17 -0.35 -1.11 0.00 0.00 175.55 176.76 2buy n PRO 80 N 1.86 3.36 -3.80 -1.71 -0.04 -1.26 -4.74 135.00 128.67 2buy n PRO 80 Ca -0.04 -3.00 -0.13 0.00 -0.04 0.00 0.00 63.50 60.30 2buy n PRO 80 Cb 0.49 -3.05 -0.12 0.00 -0.04 0.00 0.00 33.50 30.77 2buy n PRO 80 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2buy s SER 81 N 1.96 -0.19 0.60 3.54 0.15 -1.26 -4.95 113.70 113.55 2buy s SER 81 Ca 0.46 0.37 0.40 0.00 0.70 0.00 0.00 55.95 57.88 2buy s SER 81 Cb 0.13 0.35 2.19 0.00 -1.71 0.00 0.00 66.02 66.98 2buy s SER 81 CO -0.05 -0.08 2.23 1.56 1.20 0.00 0.00 173.24 178.11 2buy h GLN 82 N 6.07 0.00 -0.00 5.44 4.20 -2.06 -1.01 115.11 127.75 2buy h GLN 82 Ca -0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.43 2buy h GLN 82 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2buy h GLN 82 CO 0.40 0.00 -0.11 0.00 -0.67 0.00 0.00 178.83 178.45 2buy n ALA 83 N -2.02 2.69 -2.44 3.87 0.00 -1.26 -4.78 120.51 116.57 2buy n ALA 83 Ca -0.03 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.79 2buy n ALA 83 Cb 0.06 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 2buy n ALA 83 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2buy s ASP 84 N -2.70 7.07 -0.18 0.00 2.15 -0.39 -4.92 116.67 117.71 2buy s ASP 84 Ca 0.23 1.90 0.16 0.00 0.43 0.00 0.00 52.55 55.27 2buy s ASP 84 Cb 0.19 -2.57 0.59 0.00 -0.30 0.00 0.00 42.92 40.84 2buy s ASP 84 CO 0.51 -0.53 1.50 0.35 -0.17 0.00 0.00 175.17 176.83 2buy n THR 85 N 4.30 2.28 0.55 1.71 -2.24 -1.26 -4.62 114.28 115.00 2buy n THR 85 Ca 0.10 -1.68 0.11 0.00 -2.27 0.00 0.00 64.05 60.32 2buy n THR 85 Cb 0.46 -0.19 0.45 0.00 -2.10 0.00 0.00 70.33 68.96 2buy n THR 85 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2buy n GLN 86 N -0.10 0.15 -0.93 -0.78 6.02 -1.26 -4.89 117.38 115.59 2buy n GLN 86 Ca 0.22 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 2buy n GLN 86 Cb 0.93 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 30.45 2buy n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2buy n GLY 87 N 0.50 0.44 3.88 1.08 0.00 -1.26 -4.99 105.19 104.84 2buy n GLY 87 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 2buy n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2buy s LYS 88 N -0.59 3.20 0.13 1.61 1.02 -1.26 -5.08 119.74 118.76 2buy s LYS 88 Ca 0.00 -0.69 -0.28 0.00 0.02 0.00 0.00 55.97 55.01 2buy s LYS 88 Cb 0.00 -2.84 -0.07 0.00 -0.52 0.00 0.00 37.83 34.41 2buy s LYS 88 CO 0.00 0.52 0.89 -1.14 -0.92 0.00 0.00 175.35 174.70 2buy s GLN 88 N -3.07 4.67 0.35 1.68 0.74 -1.26 -5.04 119.66 117.74 2buy s GLN 88 Ca 0.33 1.34 -0.06 0.00 0.05 0.00 0.00 55.36 57.02 2buy s GLN 88 Cb -0.11 -3.34 -0.05 0.00 1.10 0.00 0.00 33.01 30.61 2buy s GLN 88 CO 0.26 0.33 0.64 0.54 -0.55 0.00 0.00 175.29 176.52 2buy s VAL 88 N -0.38 4.95 -0.13 1.34 0.11 -1.26 -4.98 120.40 120.05 2buy s VAL 88 Ca 0.43 0.19 -0.32 0.00 -2.93 0.00 0.00 61.98 59.35 2buy s VAL 88 Cb -0.23 -3.76 -0.10 0.00 -1.53 0.00 0.00 36.38 30.76 2buy s VAL 88 CO 0.28 -0.46 2.01 -0.67 -3.33 0.00 0.00 175.10 172.93 2buy n ASP 88 N -1.27 3.38 0.00 3.54 -0.08 -1.26 -4.83 116.55 116.02 2buy n ASP 88 Ca -0.00 0.73 0.07 0.00 -1.51 0.00 0.00 54.79 54.07 2buy n ASP 88 Cb 0.54 -1.42 0.30 0.00 2.34 0.00 0.00 41.12 42.88 2buy n ASP 88 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2buy n PRO 88 N 7.45 0.03 -2.50 -0.67 -0.04 -1.26 -3.27 135.00 134.73 2buy n PRO 88 Ca 0.26 0.25 -0.32 0.00 -0.04 0.00 0.00 63.50 63.66 2buy n PRO 88 Cb 0.34 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 2buy n PRO 88 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2buy n ASN 88 N -1.47 5.59 -3.59 3.54 3.02 -1.26 -4.94 115.26 116.14 2buy n ASN 88 Ca 0.04 -3.73 -0.09 0.00 -0.03 0.00 0.00 54.58 50.77 2buy n ASN 88 Cb 0.15 -0.70 -0.09 0.00 -0.61 0.00 0.00 39.78 38.52 2buy n ASN 88 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2buy s PHE 89 N -3.74 -0.80 0.04 3.10 5.36 -1.20 -4.36 117.98 116.39 2buy s PHE 89 Ca 0.48 1.37 0.09 0.00 -0.96 0.00 0.00 56.93 57.91 2buy s PHE 89 Cb 0.35 0.24 -0.14 0.00 -0.34 0.00 0.00 43.02 43.13 2buy s PHE 89 CO -0.22 -0.53 1.30 1.25 -1.46 0.00 0.00 175.22 175.56 2buy h LEU 90 N 8.18 0.00 0.00 6.12 5.85 -1.91 -3.45 115.31 130.11 2buy h LEU 90 Ca -0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2buy h LEU 90 Cb 1.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2buy h LEU 90 CO 0.15 0.87 0.00 0.61 -0.34 0.00 0.00 178.44 179.73 2buy n GLY 91 N 1.33 1.52 3.06 3.75 0.00 -1.26 -4.78 105.19 108.81 2buy n GLY 91 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2buy n GLY 91 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2buy s TRP 92 N -3.37 0.67 0.18 1.61 -0.00 -1.26 -1.67 118.94 115.10 2buy s TRP 92 Ca 0.00 -0.50 -0.15 0.00 -0.00 0.00 0.00 56.10 55.45 2buy s TRP 92 Cb 0.00 -0.40 0.02 0.00 -0.00 0.00 0.00 33.47 33.09 2buy s TRP 92 CO 0.00 -0.08 0.46 0.20 -0.00 0.00 0.00 176.95 177.53 2buy s GLY 93 N -1.57 0.01 0.01 5.86 0.00 -1.11 -4.79 107.32 105.73 2buy s GLY 93 Ca -0.10 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.28 2buy s GLY 93 CO 0.00 -0.39 -0.04 -1.60 0.00 0.00 0.00 173.10 171.07 2buy s ARG 94 N -3.89 0.33 0.17 2.90 3.52 -0.57 -1.87 118.95 119.54 2buy s ARG 94 Ca 0.10 -0.39 -0.13 0.00 -0.13 0.00 0.00 55.73 55.18 2buy s ARG 94 Cb 0.00 -0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.23 2buy s ARG 94 CO -0.03 0.03 0.39 -0.08 -0.81 0.00 0.00 175.30 174.81 2buy s THR 95 N -0.73 0.05 0.20 4.11 -1.32 -0.08 -1.98 115.64 115.90 2buy s THR 95 Ca -0.06 -1.04 0.10 0.00 -1.21 0.00 0.00 61.69 59.48 2buy s THR 95 Cb -0.05 -1.64 -0.04 0.00 -1.51 0.00 0.00 72.50 69.25 2buy s THR 95 CO -0.00 -0.24 -0.19 -0.83 -2.21 0.00 0.00 174.62 171.15 2buy s GLY 96 N -2.91 1.58 0.56 6.08 0.00 -1.26 -0.79 107.32 110.59 2buy s GLY 96 Ca 0.12 -1.64 -0.17 0.00 0.00 0.00 0.00 44.72 43.03 2buy s GLY 96 CO -0.03 -1.70 1.05 0.00 0.00 0.00 0.00 173.10 172.42 2buy s ALA 97 N -2.23 2.79 0.14 3.20 0.00 -1.02 -4.67 121.76 119.97 2buy s ALA 97 Ca 0.21 0.43 -0.31 0.00 0.00 0.00 0.00 51.96 52.29 2buy s ALA 97 Cb -0.05 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 2buy s ALA 97 CO 0.09 -0.66 1.50 0.34 0.00 0.00 0.00 175.76 177.03 2buy s ASP 98 N -2.63 6.68 0.46 0.00 -1.08 0.05 -4.83 116.67 115.33 2buy s ASP 98 Ca 0.64 2.49 0.18 0.00 -0.52 0.00 0.00 52.55 55.34 2buy s ASP 98 Cb -0.16 -2.59 1.15 0.00 -1.46 0.00 0.00 42.92 39.86 2buy s ASP 98 CO 0.33 -0.76 1.97 -0.26 0.52 0.00 0.00 175.17 176.96 2buy h PHE 99 N 6.90 0.32 0.00 -5.34 0.05 -1.92 0.26 116.94 117.21 2buy h PHE 99 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2buy s PHE 103 Cb 0.00 -3.02 -0.05 0.00 0.51 0.00 0.00 43.02 40.46 2buy s PHE 103 CO 0.00 0.26 -0.16 1.67 0.70 0.00 0.00 175.22 177.69 2buy s TRP 104 N -1.23 1.94 0.15 0.36 1.48 -0.42 -0.77 118.94 120.45 2buy s TRP 104 Ca 0.43 -0.49 -0.22 0.00 -1.06 0.00 0.00 56.10 54.76 2buy s TRP 104 Cb -0.26 -0.88 0.06 0.00 -1.16 0.00 0.00 33.47 31.23 2buy s TRP 104 CO 0.32 0.49 0.57 -1.54 -4.06 0.00 0.00 176.95 172.74 2buy s SER 105 N -3.40 -0.52 0.03 -2.66 1.04 -1.26 -2.30 113.70 104.64 2buy s SER 105 Ca 0.26 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.66 2buy s SER 105 Cb -0.02 0.58 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 2buy s SER 105 CO 0.10 -0.94 -0.05 -0.36 0.98 0.00 0.00 173.24 172.96 2buy s PHE 106 N -3.71 0.49 -0.25 5.02 0.40 -0.20 -4.87 117.98 114.86 2buy s PHE 106 Ca 0.01 -0.55 -0.06 0.00 -0.60 0.00 0.00 56.93 55.74 2buy s PHE 106 Cb -0.01 -0.31 -0.01 0.00 0.51 0.00 0.00 43.02 43.20 2buy s PHE 106 CO -0.12 -0.14 0.02 -0.80 0.70 0.00 0.00 175.22 174.88 2buy s ASN 107 N -1.63 4.77 0.00 1.36 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33.85 2buy s VAL 114 CO 0.42 0.43 1.37 -2.65 0.00 0.00 0.00 175.10 174.67 2buy n PRO 115 N 1.86 1.93 -2.27 2.72 -0.02 -1.26 -0.44 135.00 137.51 2buy n PRO 115 Ca -0.16 0.70 -0.12 0.00 -2.02 0.00 0.00 63.50 61.90 2buy n PRO 115 Cb 0.52 -2.57 0.03 0.00 -0.02 0.00 0.00 33.50 31.46 2buy n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2buy n GLY 116 N 0.70 2.16 3.79 -1.23 0.00 0.57 -4.59 105.19 106.59 2buy n GLY 116 Ca 0.08 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 2buy n GLY 116 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2buy s ARG 117 N -3.43 3.24 -1.30 1.61 0.52 -1.26 -4.06 118.95 114.26 2buy s ARG 117 Ca 0.30 1.32 -0.08 0.00 -0.52 0.00 0.00 55.73 56.76 2buy s ARG 117 Cb -0.02 -2.01 -0.00 0.00 0.52 0.00 0.00 34.95 33.43 2buy s ARG 117 CO 0.19 -0.89 0.58 1.63 0.02 0.00 0.00 175.30 176.84 2buy n LYS 118 N -1.91 -2.76 -0.56 3.54 5.02 -1.26 -2.02 118.16 118.21 2buy n LYS 118 Ca 0.10 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 2buy n LYS 118 Cb 0.52 -4.44 0.00 0.00 -0.02 0.00 0.00 35.03 31.09 2buy n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2buy n GLY 119 N -1.83 1.25 3.81 0.72 0.00 -1.26 -5.01 105.19 102.87 2buy n GLY 119 Ca -0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 2buy n GLY 119 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2buy s SER 120 N -2.99 3.21 -0.07 1.61 1.04 -0.86 -4.88 113.70 110.76 2buy s SER 120 Ca 0.00 0.72 0.03 0.00 0.48 0.00 0.00 55.95 57.18 2buy s SER 120 Cb 0.00 -1.11 0.01 0.00 0.10 0.00 0.00 66.02 65.02 2buy s SER 120 CO 0.00 -2.71 -0.16 -0.89 0.98 0.00 0.00 173.24 170.45 2buy s THR 121 N -3.43 1.43 0.20 2.02 2.01 -1.26 -0.32 115.64 116.29 2buy s THR 121 Ca 0.67 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.89 2buy s THR 121 Cb -0.11 -1.27 -0.07 0.00 0.01 0.00 0.00 72.50 71.06 2buy s THR 121 CO 0.53 0.42 0.54 -1.10 -0.69 0.00 0.00 174.62 174.32 2buy s GLN 122 N 0.47 3.85 0.67 4.92 -0.21 0.41 -4.59 119.66 125.19 2buy s GLN 122 Ca -0.14 0.34 -0.13 0.00 0.02 0.00 0.00 55.36 55.44 2buy s GLN 122 Cb -0.16 -2.75 0.00 0.00 1.00 0.00 0.00 33.01 31.11 2buy s GLN 122 CO 0.05 0.38 1.08 0.00 -2.12 0.00 0.00 175.29 174.67 2buy s ALA 123 N -1.69 2.55 0.19 6.09 0.00 -1.26 -3.60 121.76 124.04 2buy s ALA 123 Ca 0.44 0.34 -0.32 0.00 0.00 0.00 0.00 51.96 52.41 2buy s ALA 123 Cb -0.12 -3.25 -0.15 0.00 0.00 0.00 0.00 23.12 19.60 2buy s ALA 123 CO 0.20 -1.23 1.23 -2.30 0.00 0.00 0.00 175.76 173.67 2buy n PRO 124 N -2.70 1.42 -3.47 0.00 -0.02 -1.26 -4.73 135.00 124.24 2buy n PRO 124 Ca 0.09 0.51 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 2buy n PRO 124 Cb 0.53 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.93 2buy n PRO 124 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2buy s HIS 125 N -0.17 -0.51 -0.09 6.00 -3.43 -1.26 -4.37 115.29 111.46 2buy s HIS 125 Ca 0.71 0.50 0.03 0.00 -0.80 0.00 0.00 55.06 55.50 2buy s HIS 125 Cb -0.79 0.51 -0.01 0.00 -1.43 0.00 0.00 32.58 30.86 2buy s HIS 125 CO 0.52 -0.69 -0.18 0.42 -2.00 0.00 0.00 174.74 172.80 2buy s ILE 126 N -2.86 2.62 -0.01 -5.38 1.01 -0.68 -4.69 121.20 111.21 2buy s ILE 126 Ca -0.01 -0.84 -0.19 0.00 0.00 0.00 0.00 60.65 59.61 2buy s ILE 126 Cb -0.01 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 2buy s ILE 126 CO -0.06 0.56 0.53 -0.44 0.00 0.00 0.00 174.94 175.52 2buy s SER 127 N 0.01 6.90 0.02 3.58 0.01 -0.12 -1.33 113.70 122.76 2buy s SER 127 Ca -0.06 1.07 0.04 0.00 1.31 0.00 0.00 55.95 58.30 2buy s SER 127 Cb -0.15 -2.32 -0.02 0.00 0.21 0.00 0.00 66.02 63.74 2buy s SER 127 CO 0.05 0.16 -0.11 -0.22 0.41 0.00 0.00 173.24 173.53 2buy s LEU 128 N -0.38 2.12 0.01 2.44 0.20 -0.39 -0.92 118.68 121.76 2buy s LEU 128 Ca 0.28 -0.36 0.02 0.00 0.69 0.00 0.00 54.13 54.76 2buy s LEU 128 Cb -0.17 -0.49 -0.01 0.00 -0.43 0.00 0.00 46.19 45.09 2buy s LEU 128 CO 0.15 0.03 -0.07 -0.51 -0.29 0.00 0.00 176.35 175.66 2buy s ILE 129 N -0.68 0.56 -0.07 6.68 2.07 -0.76 -0.73 121.20 128.27 2buy s ILE 129 Ca 0.01 -0.45 0.05 0.00 -1.41 0.00 0.00 60.65 58.85 2buy s ILE 129 Cb -0.06 -0.50 -0.01 0.00 0.13 0.00 0.00 42.46 42.02 2buy s ILE 129 CO 0.01 0.06 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n HIS 133 Cb 0.61 -2.46 0.00 0.00 -0.12 0.00 0.00 29.99 28.02 2buy n HIS 133 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2buy n GLY 134 N 1.55 1.92 3.32 1.57 0.00 -1.26 -4.95 105.19 107.34 2buy n GLY 134 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2buy n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2buy s ILE 135 N -2.44 3.90 0.14 -0.61 1.01 -0.55 -4.97 121.20 117.68 2buy s ILE 135 Ca 0.00 -0.82 0.07 0.00 0.00 0.00 0.00 60.65 59.89 2buy s ILE 135 Cb 0.00 -3.07 -0.19 0.00 0.01 0.00 0.00 42.46 39.22 2buy s ILE 135 CO 0.00 0.01 1.32 0.78 0.00 0.00 0.00 174.94 177.05 2buy h ASN 136 N 8.23 0.03 -3.59 3.58 2.35 -1.90 -3.36 115.58 120.91 2buy h ASN 136 Ca -0.29 -0.03 -0.38 0.00 -0.55 0.00 0.00 56.30 55.05 2buy h ASN 136 Cb 1.11 -0.01 -0.32 0.00 0.05 0.00 0.00 38.32 39.15 2buy h ASN 136 CO 0.60 0.97 -0.76 -0.63 -1.65 0.00 0.00 177.43 175.96 2buy s ILE 137 N -2.84 0.44 0.16 2.81 1.01 -1.26 -3.16 121.20 118.36 2buy s ILE 137 Ca 0.00 -0.12 -0.33 0.00 0.00 0.00 0.00 60.65 60.21 2buy s ILE 137 Cb 0.10 -0.46 -0.16 0.00 0.01 0.00 0.00 42.46 41.95 2buy s ILE 137 CO 0.82 0.18 1.13 0.61 0.00 0.00 0.00 174.94 177.68 2buy n GLY 138 N 3.75 -0.03 3.63 6.18 0.00 -1.26 -4.92 105.19 112.53 2buy n GLY 138 Ca -0.23 0.54 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 2buy n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2buy s LEU 139 N 0.71 4.08 -0.06 0.99 1.43 -0.62 -4.87 118.68 120.34 2buy s LEU 139 Ca 0.74 0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 54.05 2buy s LEU 139 Cb -0.88 -2.41 -0.05 0.00 0.03 0.00 0.00 46.19 42.87 2buy s LEU 139 CO 0.52 -0.13 0.30 -1.00 0.23 0.00 0.00 176.35 176.28 2buy s HIS 140 N 1.75 3.65 0.37 0.29 3.76 -1.26 -1.26 115.29 122.60 2buy s HIS 140 Ca 0.15 0.78 -0.07 0.00 -0.15 0.00 0.00 55.06 55.78 2buy s HIS 140 Cb -0.15 -2.17 0.03 0.00 1.11 0.00 0.00 32.58 31.40 2buy s HIS 140 CO 0.09 0.63 0.61 -2.37 -0.85 0.00 0.00 174.74 172.85 2buy n THR 141 N 2.07 0.00 -4.09 1.30 5.66 0.09 -0.68 114.28 118.63 2buy n THR 141 Ca -0.16 -1.52 -0.12 0.00 -3.05 0.00 0.00 64.05 59.20 2buy n THR 141 Cb 0.53 1.08 -0.11 0.00 -1.55 0.00 0.00 70.33 70.28 2buy n THR 141 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2buy s ARG 142 N -2.55 0.60 -0.19 1.09 0.52 -1.26 -1.26 118.95 115.91 2buy s ARG 142 Ca 0.25 -0.92 -0.01 0.00 -0.52 0.00 0.00 55.73 54.52 2buy s ARG 142 Cb -0.02 -0.23 0.01 0.00 0.52 0.00 0.00 34.95 35.22 2buy s ARG 142 CO 0.18 0.02 -0.13 0.08 0.02 0.00 0.00 175.30 175.47 2buy s VAL 143 N -2.08 2.66 0.50 3.52 1.01 -0.44 -4.76 120.40 120.80 2buy s VAL 143 Ca -0.04 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.27 2buy s VAL 143 Cb -0.05 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.19 2buy s VAL 143 CO -0.01 0.49 0.46 -0.31 0.00 0.00 0.00 175.10 175.73 2buy s TYR 144 N 1.26 2.05 -0.09 5.22 1.51 0.91 -1.69 117.35 126.52 2buy s TYR 144 Ca 0.03 -0.67 0.04 0.00 -1.01 0.00 0.00 57.07 55.45 2buy s TYR 144 Cb -0.14 -2.07 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 2buy s TYR 144 CO -0.07 -0.44 -0.22 -0.06 -1.11 0.00 0.00 175.55 173.65 2buy s PHE 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31.44 28.84 2buy n GLU 148 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2buy h ALA 149 N 2.47 0.28 -0.59 0.62 0.00 -1.76 0.24 119.26 120.53 2buy h ALA 149 Ca 0.46 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.54 2buy h ALA 149 Cb 0.79 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2buy h ALA 149 CO 1.17 -0.46 0.30 0.93 0.00 0.00 0.00 179.25 181.18 2buy h GLU 150 N -0.02 0.84 -0.67 0.00 5.08 -1.94 -2.08 114.58 115.78 2buy h GLU 150 Ca 0.23 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2buy h GLU 150 Cb 0.38 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2buy h GLU 150 CO -0.51 0.66 0.20 0.00 -1.00 0.00 0.00 179.01 178.37 2buy h ALA 151 N 1.13 0.88 -0.53 3.43 0.00 -1.83 -3.02 119.26 119.32 2buy h ALA 151 Ca 0.20 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2buy h ALA 151 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2buy h ALA 151 CO -0.03 0.56 0.10 -0.91 0.00 0.00 0.00 179.25 178.97 2buy h ASN 152 N 0.98 0.78 0.23 0.00 2.35 -0.77 -2.03 115.58 117.11 2buy h ASN 152 Ca 0.21 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2buy h ASN 152 Cb 0.31 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 2buy h ASN 152 CO -0.00 0.78 -0.09 0.00 -1.65 0.00 0.00 177.43 176.47 2buy h ALA 153 N 1.32 1.41 -0.28 -0.83 0.00 -1.25 -2.04 119.26 117.58 2buy h ALA 153 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2buy h ALA 153 Cb 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2buy h ALA 153 CO 0.00 0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.99 2buy n LYS 154 N -3.78 2.12 -2.34 0.00 5.02 -0.89 -4.94 118.16 113.35 2buy n LYS 154 Ca -0.02 -1.96 -0.42 0.00 -2.02 0.00 0.00 58.31 53.89 2buy n LYS 154 Cb 0.19 -1.38 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 2buy n LYS 154 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2buy s ASP 155 N -1.24 6.98 0.14 4.39 -1.08 -0.77 -4.86 116.67 120.23 2buy s ASP 155 Ca 0.29 2.08 -0.18 0.00 -0.52 0.00 0.00 52.55 54.22 2buy s ASP 155 Cb 0.17 -2.58 -0.01 0.00 -1.46 0.00 0.00 42.92 39.04 2buy s ASP 155 CO 0.24 -0.56 1.78 -0.65 0.52 0.00 0.00 175.17 176.50 2buy h PRO 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39.50 2buy n ASN 159 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2buy n SER 160 N -1.44 1.36 -4.53 6.41 3.41 -0.15 -4.66 113.62 114.02 2buy n SER 160 Ca 0.07 -1.41 -0.42 0.00 -0.26 0.00 0.00 58.87 56.85 2buy n SER 160 Cb 0.25 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.14 2buy n SER 160 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2buy s ILE 161 N -2.05 4.91 0.36 -1.33 1.01 -0.99 -4.95 121.20 118.16 2buy s ILE 161 Ca 0.37 0.22 0.10 0.00 0.00 0.00 0.00 60.65 61.35 2buy s ILE 161 Cb 0.21 -4.11 0.11 0.00 0.01 0.00 0.00 42.46 38.68 2buy s ILE 161 CO 0.35 -0.43 1.84 1.05 0.00 0.00 0.00 174.94 177.75 2buy h GLU 162 N 8.68 0.15 -6.29 2.79 4.11 -1.88 -3.39 114.58 118.76 2buy h GLU 162 Ca -0.26 -0.05 -0.55 0.00 0.07 0.00 0.00 59.36 58.57 2buy h GLU 162 Cb 1.11 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.26 2buy h GLU 162 CO 0.84 0.43 1.15 -1.58 0.07 0.00 0.00 179.01 179.92 2buy s TRP 163 N -4.41 2.29 0.44 2.06 0.51 -1.26 -4.86 118.94 113.71 2buy s TRP 163 Ca -0.04 -0.14 0.16 0.00 -2.12 0.00 0.00 56.10 53.95 2buy s TRP 163 Cb 0.15 -4.61 1.08 0.00 -0.81 0.00 0.00 33.47 29.27 2buy s TRP 163 CO 0.74 -2.06 1.95 0.00 -0.51 0.00 0.00 176.95 177.07 2buy h ALA 164 N 10.25 2.11 0.00 0.98 0.00 -1.98 0.75 119.26 131.38 2buy h ALA 164 Ca -0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2buy h ALA 164 Cb 1.05 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2buy h ALA 164 CO 1.30 -0.28 -0.10 0.00 0.00 0.00 0.00 179.25 180.17 2buy h THR 165 N 0.37 0.44 0.00 0.00 1.03 -1.94 -2.80 112.91 110.00 2buy h THR 165 Ca 0.32 -0.51 -0.06 0.00 -0.01 0.00 0.00 66.41 66.15 2buy h THR 165 Cb 0.75 1.36 -0.01 0.00 -1.07 0.00 0.00 68.15 69.17 2buy h THR 165 CO -0.09 0.10 -0.50 0.03 -0.01 0.00 0.00 175.52 175.04 2buy h ARG 166 N 0.00 0.00 -0.78 0.00 3.08 -1.24 -3.26 114.38 112.18 2buy h ARG 166 Ca -0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 2buy h ARG 166 Cb 0.35 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 2buy h ARG 166 CO 0.01 0.25 0.51 0.00 -1.07 0.00 0.00 179.97 179.67 2buy h ARG 167 N 0.00 0.84 0.00 0.04 3.08 -1.46 -1.62 114.38 115.27 2buy h ARG 167 Ca -0.02 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 2buy h ARG 167 Cb 1.23 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 2buy h ARG 167 CO 0.03 0.56 -0.09 -0.56 -1.07 0.00 0.00 179.97 178.85 2buy h GLN 168 N 0.87 0.00 0.00 0.04 3.07 -1.69 -0.52 115.11 116.87 2buy h GLN 168 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.07 2buy h GLN 168 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.75 2buy h GLN 168 CO -0.11 0.09 0.00 1.79 0.09 0.00 0.00 178.83 180.69 2buy h THR 169 N 0.00 0.00 -0.34 1.86 1.35 -1.48 -2.50 112.91 111.80 2buy h THR 169 Ca -0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 2buy h THR 169 Cb 0.22 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.39 2buy h THR 169 CO 0.01 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.46 2buy n LEU 170 N -2.43 2.70 -4.40 3.87 4.77 -0.20 -4.82 117.00 116.48 2buy n LEU 170 Ca -0.01 -1.20 -0.39 0.00 -0.03 0.00 0.00 56.01 54.39 2buy n LEU 170 Cb 0.11 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 40.86 2buy n LEU 170 CO 0.15 0.60 -0.22 -0.69 -1.33 0.00 0.00 177.39 175.90 2buy s VAL 171 N -1.55 4.41 0.44 4.08 1.01 -0.94 -0.06 120.40 127.78 2buy s VAL 171 Ca 0.36 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.53 2buy s VAL 171 Cb 0.20 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 33.18 2buy s VAL 171 CO 0.28 0.01 1.01 0.00 0.00 0.00 0.00 175.10 176.40 2buy s ALA 172 N 1.57 2.98 -0.22 5.51 0.00 -0.25 -4.85 121.76 126.51 2buy s ALA 172 Ca 0.03 0.56 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 2buy s ALA 172 Cb -0.18 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 2buy s ALA 172 CO 0.05 -0.14 0.17 0.15 0.00 0.00 0.00 175.76 176.00 2buy s LYS 173 N -3.00 4.13 0.21 0.00 1.02 -0.82 -2.04 119.74 119.25 2buy s LYS 173 Ca 0.63 -0.20 -0.30 0.00 0.02 0.00 0.00 55.97 56.12 2buy s LYS 173 Cb -0.15 -3.49 -0.08 0.00 -0.52 0.00 0.00 37.83 33.59 2buy s LYS 173 CO 0.20 0.16 1.10 0.50 -0.92 0.00 0.00 175.35 176.38 2buy s ARG 174 N 0.77 4.61 0.09 1.68 3.52 -1.26 -0.98 118.95 127.39 2buy s ARG 174 Ca 0.09 1.74 -0.02 0.00 -0.13 0.00 0.00 55.73 57.41 2buy s ARG 174 Cb -0.13 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 2buy s ARG 174 CO 0.02 0.12 0.03 -1.21 -0.81 0.00 0.00 175.30 173.46 2buy s GLU 175 N -0.68 0.79 -0.46 5.12 2.02 0.17 -4.95 118.70 120.70 2buy s GLU 175 Ca 0.48 -1.31 0.03 0.00 0.02 0.00 0.00 54.97 54.19 2buy s GLU 175 Cb -0.30 0.24 0.15 0.00 0.10 0.00 0.00 34.13 34.31 2buy s GLU 175 CO 0.36 -0.20 0.28 -1.21 0.02 0.00 0.00 175.26 174.52 2buy s GLU 176 N -3.98 1.31 -0.64 1.61 2.02 -1.26 -1.23 118.70 116.53 2buy s GLU 176 Ca 0.15 -2.13 -0.25 0.00 0.02 0.00 0.00 54.97 52.76 2buy s GLU 176 Cb 0.07 -2.24 0.04 0.00 0.10 0.00 0.00 34.13 32.11 2buy s GLU 176 CO -0.04 -1.22 1.10 1.03 0.02 0.00 0.00 175.26 176.15 2buy s ARG 177 N 0.15 3.28 -0.74 1.61 3.00 -0.74 -4.55 118.95 120.97 2buy s ARG 177 Ca 0.21 -0.27 -0.07 0.00 0.00 0.00 0.00 55.73 55.60 2buy s ARG 177 Cb -0.17 -4.12 0.01 0.00 0.00 0.00 0.00 34.95 30.67 2buy s ARG 177 CO -0.05 -1.80 0.63 -0.25 0.00 0.00 0.00 175.30 173.84 2buy n ASP 178 N 8.29 -5.60 0.00 0.23 8.00 -1.26 -2.01 116.55 124.19 2buy n ASP 178 Ca 0.02 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.90 2buy n ASP 178 Cb 0.48 -2.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.11 2buy n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2buy n GLY 179 N -1.38 2.15 3.79 0.44 0.00 -1.26 -4.98 105.19 103.95 2buy n GLY 179 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 2buy n GLY 179 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2buy s GLU 180 N 0.00 4.46 -0.22 1.61 2.02 -0.85 -5.05 118.70 120.67 2buy s GLU 180 Ca 0.00 1.08 -0.15 0.00 0.02 0.00 0.00 54.97 55.92 2buy s GLU 180 Cb 0.00 -3.08 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 2buy s GLU 180 CO 0.00 0.48 0.34 0.08 0.02 0.00 0.00 175.26 176.18 2buy s VAL 181 N -1.33 5.23 -0.05 2.63 1.01 -1.26 -1.78 120.40 124.84 2buy s VAL 181 Ca 0.40 0.58 0.06 0.00 0.00 0.00 0.00 61.98 63.02 2buy s VAL 181 Cb -0.20 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 2buy s VAL 181 CO 0.24 0.26 -0.23 -0.69 0.00 0.00 0.00 175.10 174.68 2buy s VAL 182 N 1.33 1.91 -0.17 2.92 1.01 -0.37 -0.58 120.40 126.45 2buy s VAL 182 Ca 0.16 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 2buy s VAL 182 Cb -0.15 -1.62 -0.00 0.00 0.00 0.00 0.00 36.38 34.62 2buy s VAL 182 CO 0.07 0.53 -0.12 -0.31 0.00 0.00 0.00 175.10 175.28 2buy s TYR 183 N -0.15 2.84 -0.19 5.22 1.51 0.58 0.45 117.35 127.61 2buy s TYR 183 Ca -0.03 -1.02 -0.17 0.00 -1.01 0.00 0.00 57.07 54.85 2buy s TYR 183 Cb -0.13 -1.95 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 2buy s TYR 183 CO 0.03 -0.49 0.44 0.50 -1.11 0.00 0.00 175.55 174.92 2buy s ARG 184 N 1.00 4.20 -0.25 -0.62 6.06 -0.15 -1.51 118.95 127.68 2buy s ARG 184 Ca -0.01 0.29 -0.03 0.00 -2.50 0.00 0.00 55.73 53.48 2buy s ARG 184 Cb -0.15 -3.53 0.08 0.00 0.06 0.00 0.00 34.95 31.41 2buy s ARG 184 CO -0.02 -0.05 0.08 0.12 -2.50 0.00 0.00 175.30 172.93 2buy s PHE 185 N 1.33 1.02 0.02 5.12 5.36 0.10 -1.93 117.98 129.00 2buy s PHE 185 Ca 0.21 -1.09 -0.09 0.00 -0.96 0.00 0.00 56.93 55.00 2buy s PHE 185 Cb -0.15 -1.18 -0.05 0.00 -0.34 0.00 0.00 43.02 41.29 2buy s PHE 185 CO 0.09 -0.73 0.33 -0.51 -1.46 0.00 0.00 175.22 172.93 2buy s ASP 186 N 1.86 6.59 -0.12 6.13 1.01 -1.26 -4.04 116.67 126.83 2buy s ASP 186 Ca 0.05 0.69 0.00 0.00 0.71 0.00 0.00 52.55 54.01 2buy s ASP 186 Cb -0.17 -2.14 -0.02 0.00 1.01 0.00 0.00 42.92 41.60 2buy s ASP 186 CO -0.20 0.25 -0.14 -0.63 0.21 0.00 0.00 175.17 174.66 2buy s ILE 187 N -1.28 3.02 -0.29 0.77 1.01 0.23 -4.96 121.20 119.70 2buy s ILE 187 Ca 0.28 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 60.24 2buy s ILE 187 Cb -0.14 -2.25 0.05 0.00 0.01 0.00 0.00 42.46 40.13 2buy s ILE 187 CO 0.16 0.53 -0.03 -0.13 0.00 0.00 0.00 174.94 175.47 2buy s ARG 188 N 0.24 2.37 0.37 2.79 0.52 -1.26 -0.62 118.95 123.36 2buy s ARG 188 Ca -0.09 -1.30 0.16 0.00 -0.52 0.00 0.00 55.73 53.98 2buy s ARG 188 Cb -0.15 -3.11 0.72 0.00 0.52 0.00 0.00 34.95 32.92 2buy s ARG 188 CO 0.05 -0.61 1.78 0.82 0.02 0.00 0.00 175.30 177.36 2buy h ILE 189 N 6.55 1.07 -2.37 1.52 2.04 -1.61 0.17 117.51 124.87 2buy h ILE 189 Ca -0.20 -1.45 -0.07 0.00 1.00 0.00 0.00 64.86 64.13 2buy h ILE 189 Cb 1.06 1.83 -0.23 0.00 -0.74 0.00 0.00 36.82 38.74 2buy h ILE 189 CO 0.51 0.38 -0.08 -1.58 0.00 0.00 0.00 178.15 177.39 2buy s GLN 190 N -3.85 0.62 0.00 2.37 0.74 -1.26 -4.80 119.66 113.48 2buy s GLN 190 Ca -0.01 0.84 0.00 0.00 0.05 0.00 0.00 55.36 56.23 2buy s GLN 190 Cb 0.13 0.25 0.00 0.00 1.10 0.00 0.00 33.01 34.48 2buy s GLN 190 CO 0.70 -0.10 0.00 0.41 -0.55 0.00 0.00 175.29 175.75 2buy n GLY 191 N 3.18 0.02 3.76 2.59 0.00 -1.26 -4.31 105.19 109.18 2buy n GLY 191 Ca -0.16 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 2buy n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2buy s GLU 192 N 0.00 4.33 -1.63 1.61 2.02 -1.26 -2.21 118.70 121.56 2buy s GLU 192 Ca 0.00 2.24 -0.02 0.00 0.02 0.00 0.00 54.97 57.21 2buy s GLU 192 Cb 0.00 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 31.16 2buy s GLU 192 CO 0.00 -0.24 0.19 0.09 0.02 0.00 0.00 175.26 175.32 2buy n ASN 193 N 1.09 -5.69 -4.69 -0.19 3.02 -1.26 -4.90 115.26 102.63 2buy n ASN 193 Ca 0.01 -0.08 -0.44 0.00 -0.03 0.00 0.00 54.58 54.04 2buy n ASN 193 Cb 0.41 -4.70 -0.03 0.00 -0.61 0.00 0.00 39.78 34.85 2buy n ASN 193 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2buy n GLU 194 N -3.31 2.44 -1.99 3.52 2.13 -0.94 -4.64 120.64 117.84 2buy n GLU 194 Ca -0.19 0.88 -0.41 0.00 0.66 0.00 0.00 57.16 58.10 2buy n GLU 194 Cb 0.66 -2.67 -0.01 0.00 0.27 0.00 0.00 31.44 29.68 2buy n GLU 194 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2buy s THR 195 N 0.88 2.46 0.20 6.31 2.01 0.61 -4.96 115.64 123.16 2buy s THR 195 Ca 0.76 0.46 -0.31 0.00 0.31 0.00 0.00 61.69 62.91 2buy s THR 195 Cb -0.59 -3.29 -0.10 0.00 0.01 0.00 0.00 72.50 68.53 2buy s THR 195 CO 0.37 0.11 1.48 -0.69 -0.69 0.00 0.00 174.62 175.19 2buy s VAL 196 N -1.06 2.73 0.06 3.82 1.01 -1.26 -4.94 120.40 120.76 2buy s VAL 196 Ca 0.51 0.57 0.09 0.00 0.00 0.00 0.00 61.98 63.15 2buy s VAL 196 Cb -0.42 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 2buy s VAL 196 CO 0.56 0.07 -0.25 -0.36 0.00 0.00 0.00 175.10 175.12 2buy s PHE 197 N 0.52 2.20 0.12 5.22 0.08 -1.26 -4.68 117.98 120.18 2buy s PHE 197 Ca 0.64 -0.40 0.06 0.00 0.12 0.00 0.00 56.93 57.35 2buy s PHE 197 Cb -0.42 -1.29 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 2buy s PHE 197 CO 0.37 0.16 -0.03 -0.06 -0.10 0.00 0.00 175.22 175.56 2buy s PHE 198 N -0.86 2.87 -0.38 0.36 0.08 0.14 -4.99 117.98 115.20 2buy s PHE 198 Ca 0.11 -0.10 -0.11 0.00 0.12 0.00 0.00 56.93 56.95 2buy s PHE 198 Cb -0.10 -1.45 0.03 0.00 -0.57 0.00 0.00 43.02 40.93 2buy s PHE 198 CO 0.03 0.48 0.22 0.34 -0.10 0.00 0.00 175.22 176.18 2buy s ASP 199 N -2.51 5.77 0.00 1.36 3.68 -1.26 -4.28 116.67 119.43 2buy s ASP 199 Ca 0.25 -1.02 0.24 0.00 2.13 0.00 0.00 52.55 54.15 2buy s ASP 199 Cb -0.11 -2.03 0.20 0.00 -1.45 0.00 0.00 42.92 39.53 2buy s ASP 199 CO 0.17 -0.40 1.27 2.30 0.13 0.00 0.00 175.17 178.63