#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d29 s THR 2 N 0.00 0.77 0.07 12.58 2.01 -1.26 -1.18 115.64 128.62 3d29 s THR 2 Ca 0.00 -0.57 0.07 0.00 0.31 0.00 0.00 61.69 61.50 3d29 s THR 2 Cb 0.00 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 3d29 s THR 2 CO 0.00 -0.06 -0.20 0.27 -0.69 0.00 0.00 174.62 173.95 3d29 s ILE 3 N 1.76 1.58 0.15 1.82 -0.00 -0.89 -1.83 121.20 123.79 3d29 s ILE 3 Ca -0.00 -1.32 -0.02 0.00 -0.00 0.00 0.00 60.65 59.31 3d29 s ILE 3 Cb -0.16 -1.41 -0.04 0.00 -0.00 0.00 0.00 42.46 40.85 3d29 s ILE 3 CO -0.07 0.05 0.09 0.68 -0.00 0.00 0.00 174.94 175.68 3d29 s VAL 4 N -0.98 0.08 -0.01 8.37 -7.23 -0.52 -1.60 120.40 118.51 3d29 s VAL 4 Ca 0.06 -1.89 -0.01 0.00 -1.81 0.00 0.00 61.98 58.34 3d29 s VAL 4 Cb -0.09 -2.12 0.00 0.00 0.56 0.00 0.00 36.38 34.73 3d29 s VAL 4 CO 0.03 -0.36 0.02 -0.83 -0.31 0.00 0.00 175.10 173.65 3d29 s GLY 5 N -3.06 -0.01 -0.13 2.32 0.00 0.55 -2.01 107.32 104.96 3d29 s GLY 5 Ca 0.26 0.05 -0.05 0.00 0.00 0.00 0.00 44.72 44.98 3d29 s GLY 5 CO 0.04 0.05 0.28 0.14 0.00 0.00 0.00 173.10 173.61 3d29 s VAL 6 N 0.03 -0.32 0.21 1.40 1.01 0.34 -1.21 120.40 121.86 3d29 s VAL 6 Ca -0.00 0.22 -0.17 0.00 0.00 0.00 0.00 61.98 62.03 3d29 s VAL 6 Cb -0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 36.38 35.84 3d29 s VAL 6 CO -0.00 0.09 0.67 -0.54 0.00 0.00 0.00 175.10 175.32 3d29 s LYS 7 N 2.07 4.13 0.35 2.72 -0.14 0.16 -0.56 119.74 128.48 3d29 s LYS 7 Ca -0.02 0.71 0.03 0.00 -1.36 0.00 0.00 55.97 55.33 3d29 s LYS 7 Cb -0.11 -2.83 -0.04 0.00 -1.68 0.00 0.00 37.83 33.16 3d29 s LYS 7 CO -0.09 0.39 0.11 -0.59 -0.76 0.00 0.00 175.35 174.40 3d29 s PHE 8 N -1.57 1.78 0.47 3.18 -0.12 -0.39 -4.70 117.98 116.63 3d29 s PHE 8 Ca 0.43 -1.17 0.34 0.00 -0.05 0.00 0.00 56.93 56.47 3d29 s PHE 8 Cb -0.15 -1.12 1.47 0.00 -0.63 0.00 0.00 43.02 42.59 3d29 s PHE 8 CO 0.20 -0.23 1.64 -2.95 -0.05 0.00 0.00 175.22 173.83 3d29 h ASN 9 N 2.03 0.19 0.00 1.98 7.08 -0.79 -2.67 115.58 123.40 3d29 h ASN 9 Ca -0.37 0.10 -0.02 0.00 -3.08 0.00 0.00 56.30 52.93 3d29 h ASN 9 Cb 1.26 0.09 -0.04 0.00 -2.08 0.00 0.00 38.32 37.54 3d29 h ASN 9 CO 0.61 -0.12 -0.36 -3.20 -2.08 0.00 0.00 177.43 172.28 3d29 n ASN 10 N -4.51 1.21 0.00 6.14 5.15 -1.26 -5.06 115.26 116.93 3d29 n ASN 10 Ca 0.37 -2.63 0.00 0.00 -0.60 0.00 0.00 54.58 51.72 3d29 n ASN 10 Cb 1.49 -0.34 0.00 0.00 -0.53 0.00 0.00 39.78 40.40 3d29 n ASN 10 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d29 n GLY 11 N -0.63 -0.65 3.15 8.20 0.00 -1.01 -0.80 105.19 113.45 3d29 n GLY 11 Ca 0.09 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 3d29 n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d29 s VAL 12 N -3.50 0.04 0.03 1.61 0.11 -0.06 -1.26 120.40 117.37 3d29 s VAL 12 Ca 0.00 -0.34 0.04 0.00 -2.93 0.00 0.00 61.98 58.75 3d29 s VAL 12 Cb 0.00 -0.44 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 3d29 s VAL 12 CO 0.00 -0.19 -0.12 0.54 -3.33 0.00 0.00 175.10 172.00 3d29 s VAL 13 N -0.71 0.95 0.10 2.04 0.11 0.28 -1.02 120.40 122.15 3d29 s VAL 13 Ca -0.08 -0.86 0.06 0.00 -2.93 0.00 0.00 61.98 58.17 3d29 s VAL 13 Cb -0.04 -0.86 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 3d29 s VAL 13 CO 0.02 0.01 -0.15 0.27 -3.33 0.00 0.00 175.10 171.91 3d29 s ILE 14 N -0.76 1.32 0.16 7.04 -4.36 -0.86 -0.51 121.20 123.23 3d29 s ILE 14 Ca 0.01 -1.57 -0.04 0.00 -0.26 0.00 0.00 60.65 58.79 3d29 s ILE 14 Cb -0.07 -1.39 -0.03 0.00 1.25 0.00 0.00 42.46 42.22 3d29 s ILE 14 CO 0.01 -0.31 0.17 0.00 0.24 0.00 0.00 174.94 175.05 3d29 s ALA 15 N -1.73 0.58 0.04 2.27 0.00 -0.85 -1.61 121.76 120.46 3d29 s ALA 15 Ca 0.05 -1.30 -0.27 0.00 0.00 0.00 0.00 51.96 50.44 3d29 s ALA 15 Cb -0.07 0.98 0.08 0.00 0.00 0.00 0.00 23.12 24.12 3d29 s ALA 15 CO 0.03 -0.58 0.73 0.00 0.00 0.00 0.00 175.76 175.94 3d29 s ALA 16 N -4.04 -1.73 0.82 0.00 0.00 -0.69 -1.44 121.76 114.68 3d29 s ALA 16 Ca 0.25 0.93 -0.06 0.00 0.00 0.00 0.00 51.96 53.07 3d29 s ALA 16 Cb 0.06 0.40 0.13 0.00 0.00 0.00 0.00 23.12 23.70 3d29 s ALA 16 CO 0.04 -0.61 0.80 -0.40 0.00 0.00 0.00 175.76 175.59 3d29 n ASP 17 N 0.07 0.47 -0.46 0.00 5.75 -0.76 -0.80 116.55 120.82 3d29 n ASP 17 Ca -0.15 -1.54 0.06 0.00 -0.01 0.00 0.00 54.79 53.15 3d29 n ASP 17 Cb 0.62 -0.57 0.11 0.00 -1.03 0.00 0.00 41.12 40.24 3d29 n ASP 17 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3d29 n THR 18 N -2.85 1.28 -3.59 2.12 -2.24 -1.08 -4.55 114.28 103.37 3d29 n THR 18 Ca 0.11 -1.78 -0.38 0.00 -2.27 0.00 0.00 64.05 59.74 3d29 n THR 18 Cb 0.40 0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.65 3d29 n THR 18 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3d29 s ARG 19 N -1.92 3.85 -0.02 -0.78 3.52 -1.23 -1.50 118.95 120.87 3d29 s ARG 19 Ca 0.26 0.24 0.07 0.00 -0.13 0.00 0.00 55.73 56.17 3d29 s ARG 19 Cb 0.24 -3.24 -0.02 0.00 -1.56 0.00 0.00 34.95 30.37 3d29 s ARG 19 CO -0.02 0.64 -0.22 0.45 -0.81 0.00 0.00 175.30 175.34 3d29 s SER 20 N -0.83 2.62 0.07 -2.12 0.15 -0.17 -4.64 113.70 108.77 3d29 s SER 20 Ca 0.21 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.47 3d29 s SER 20 Cb -0.15 -0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 63.81 3d29 s SER 20 CO 0.10 0.27 -0.06 0.42 1.20 0.00 0.00 173.24 175.16 3d29 s THR 21 N -0.50 0.58 -0.32 6.45 -4.23 -1.26 0.19 115.64 116.56 3d29 s THR 21 Ca 0.08 -1.62 -0.02 0.00 -1.18 0.00 0.00 61.69 58.95 3d29 s THR 21 Cb -0.09 -1.29 0.11 0.00 1.34 0.00 0.00 72.50 72.57 3d29 s THR 21 CO -0.01 -0.72 0.13 -1.10 -0.54 0.00 0.00 174.62 172.39 3d29 s GLN 22 N -3.06 0.56 7.20 3.99 -0.21 -0.48 -4.80 119.66 122.85 3d29 s GLN 22 Ca 0.04 -0.99 0.00 0.00 0.02 0.00 0.00 55.36 54.43 3d29 s GLN 22 Cb 0.00 -1.65 0.00 0.00 1.00 0.00 0.00 33.01 32.37 3d29 s GLN 22 CO -0.04 -1.04 0.00 0.41 -2.12 0.00 0.00 175.29 172.51 3d29 n GLY 23 N 4.79 2.29 0.88 3.09 0.00 -1.26 -2.16 105.19 112.82 3d29 n GLY 23 Ca -0.01 -0.34 0.10 0.00 0.00 0.00 0.00 46.02 45.77 3d29 n GLY 23 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d29 n PRO 24 N 13.18 2.13 -3.90 1.61 -0.04 -1.26 -4.90 135.00 141.81 3d29 n PRO 24 Ca 0.00 -1.72 -0.36 0.00 -0.04 0.00 0.00 63.50 61.38 3d29 n PRO 24 Cb 0.00 -1.43 -0.08 0.00 -0.04 0.00 0.00 33.50 31.95 3d29 n PRO 24 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3d29 s ILE 25 N -1.52 5.19 -0.23 0.52 1.09 -0.92 -5.05 121.20 120.29 3d29 s ILE 25 Ca 0.35 0.10 -0.29 0.00 -1.10 0.00 0.00 60.65 59.71 3d29 s ILE 25 Cb 0.19 -3.31 -0.01 0.00 -1.06 0.00 0.00 42.46 38.27 3d29 s ILE 25 CO 0.26 0.52 1.33 -0.69 -0.10 0.00 0.00 174.94 176.26 3d29 s VAL 26 N -0.20 4.13 -0.00 2.92 1.01 -1.26 -1.38 120.40 125.62 3d29 s VAL 26 Ca 0.10 1.32 -0.18 0.00 0.00 0.00 0.00 61.98 63.22 3d29 s VAL 26 Cb -0.12 -4.02 -0.34 0.00 0.00 0.00 0.00 36.38 31.90 3d29 s VAL 26 CO 0.01 -0.31 0.93 0.00 0.00 0.00 0.00 175.10 175.74 3d29 h ALA 27 N 9.01 -0.12 -3.26 5.51 0.00 -0.57 -3.45 119.26 126.38 3d29 h ALA 27 Ca -0.27 -0.82 -0.30 0.00 0.00 0.00 0.00 54.91 53.51 3d29 h ALA 27 Cb 1.11 0.17 -0.35 0.00 0.00 0.00 0.00 17.79 18.72 3d29 h ALA 27 CO 1.00 0.60 -0.67 0.34 0.00 0.00 0.00 179.25 180.52 3d29 s ASP 28 N -7.35 0.49 0.00 0.00 3.68 -1.18 -4.99 116.67 107.32 3d29 s ASP 28 Ca -0.11 0.22 0.28 0.00 2.13 0.00 0.00 52.55 55.06 3d29 s ASP 28 Cb 0.03 0.10 1.01 0.00 -1.45 0.00 0.00 42.92 42.60 3d29 s ASP 28 CO 0.90 -0.20 1.75 0.29 0.13 0.00 0.00 175.17 178.04 3d29 n LYS 29 N 4.82 0.17 -2.92 4.34 5.02 -1.26 -1.00 118.16 127.33 3d29 n LYS 29 Ca -0.14 -0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 55.96 3d29 n LYS 29 Cb 0.50 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.05 3d29 n LYS 29 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3d29 n ASN 30 N -1.36 -1.17 -4.94 4.39 4.05 -1.04 -4.50 115.26 110.69 3d29 n ASN 30 Ca 0.08 -3.36 -0.24 0.00 0.45 0.00 0.00 54.58 51.50 3d29 n ASN 30 Cb 0.32 0.90 0.03 0.00 1.23 0.00 0.00 39.78 42.26 3d29 n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3d29 s ALA 32 N -2.85 3.23 -2.23 0.00 0.00 -1.26 -4.56 121.76 114.09 3d29 s ALA 32 Ca 0.53 -1.58 0.19 0.00 0.00 0.00 0.00 51.96 51.11 3d29 s ALA 32 Cb -0.10 -2.44 0.56 0.00 0.00 0.00 0.00 23.12 21.14 3d29 s ALA 32 CO 0.42 -1.16 1.45 1.63 0.00 0.00 0.00 175.76 178.09 3d29 n LYS 33 N 4.96 2.01 -3.69 0.00 5.02 -1.26 -4.80 118.16 120.40 3d29 n LYS 33 Ca -0.13 -1.54 -0.37 0.00 -2.02 0.00 0.00 58.31 54.24 3d29 n LYS 33 Cb 0.47 -1.41 -0.12 0.00 -0.02 0.00 0.00 35.03 33.95 3d29 n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d29 s LEU 34 N -1.36 3.72 0.04 -0.35 1.02 -1.26 -1.05 118.68 119.44 3d29 s LEU 34 Ca 0.33 -0.21 0.08 0.00 0.02 0.00 0.00 54.13 54.35 3d29 s LEU 34 Cb 0.18 -1.99 -0.03 0.00 0.02 0.00 0.00 46.19 44.37 3d29 s LEU 34 CO 0.26 -0.07 -0.20 -1.00 0.02 0.00 0.00 176.35 175.36 3d29 s HIS 35 N 1.66 2.49 -0.32 0.29 3.76 0.18 -4.94 115.29 118.40 3d29 s HIS 35 Ca 0.06 -0.30 -0.15 0.00 -0.15 0.00 0.00 55.06 54.53 3d29 s HIS 35 Cb -0.16 -1.45 -0.02 0.00 1.11 0.00 0.00 32.58 32.06 3d29 s HIS 35 CO 0.06 0.21 0.35 0.50 -0.85 0.00 0.00 174.74 175.01 3d29 s ARG 36 N -1.36 3.72 -0.00 1.40 3.52 -1.26 0.64 118.95 125.60 3d29 s ARG 36 Ca 0.14 -0.29 0.05 0.00 -0.13 0.00 0.00 55.73 55.49 3d29 s ARG 36 Cb -0.10 -3.75 -0.24 0.00 -1.56 0.00 0.00 34.95 29.29 3d29 s ARG 36 CO 0.04 -0.43 0.83 0.82 -0.81 0.00 0.00 175.30 175.75 3d29 h ILE 37 N 5.48 1.10 -3.26 4.11 2.04 -1.21 -3.47 117.51 122.30 3d29 h ILE 37 Ca -0.31 -2.85 0.01 0.00 1.00 0.00 0.00 64.86 62.72 3d29 h ILE 37 Cb 1.15 2.62 -0.07 0.00 -0.74 0.00 0.00 36.82 39.79 3d29 h ILE 37 CO 0.67 0.73 0.08 -0.94 0.00 0.00 0.00 178.15 178.69 3d29 s SER 38 N -6.59 -0.21 0.34 1.72 1.04 -1.05 -4.50 113.70 104.45 3d29 s SER 38 Ca -0.06 -0.69 0.14 0.00 0.48 0.00 0.00 55.95 55.81 3d29 s SER 38 Cb 0.08 0.66 1.07 0.00 0.10 0.00 0.00 66.02 67.92 3d29 s SER 38 CO 0.83 -1.23 1.67 -0.65 0.98 0.00 0.00 173.24 174.84 3d29 h PRO 39 N 2.11 0.35 -0.00 4.02 0.11 -2.01 -2.38 132.00 134.20 3d29 h PRO 39 Ca -0.23 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.86 3d29 h PRO 39 Cb 1.25 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3d29 h PRO 39 CO 0.29 0.23 -0.15 1.63 -0.21 0.00 0.00 178.00 179.80 3d29 n LYS 40 N -5.01 1.38 -3.88 1.05 5.02 -1.26 -4.52 118.16 110.94 3d29 n LYS 40 Ca 0.31 -2.80 -0.30 0.00 -2.02 0.00 0.00 58.31 53.50 3d29 n LYS 40 Cb 0.96 -1.54 -0.16 0.00 -0.02 0.00 0.00 35.03 34.27 3d29 n LYS 40 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3d29 s ILE 41 N -2.99 1.31 0.20 -0.18 -1.09 -0.90 -2.05 121.20 115.50 3d29 s ILE 41 Ca 0.34 -1.18 0.09 0.00 -2.23 0.00 0.00 60.65 57.67 3d29 s ILE 41 Cb 0.31 -1.69 -0.04 0.00 -1.58 0.00 0.00 42.46 39.46 3d29 s ILE 41 CO 0.00 -0.21 -0.07 0.26 -1.23 0.00 0.00 174.94 173.69 3d29 s TRP 42 N 1.48 2.66 -0.04 3.97 0.52 -0.35 -0.66 118.94 126.52 3d29 s TRP 42 Ca -0.02 -0.21 0.01 0.00 0.02 0.00 0.00 56.10 55.90 3d29 s TRP 42 Cb -0.18 -1.28 0.02 0.00 -1.15 0.00 0.00 33.47 30.88 3d29 s TRP 42 CO -0.09 0.54 -0.06 0.00 0.02 0.00 0.00 176.95 177.36 3d29 s ALA 44 N 0.72 3.56 -0.06 0.00 0.00 -0.06 0.47 121.76 126.39 3d29 s ALA 44 Ca -0.10 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 50.93 3d29 s ALA 44 Cb -0.13 -2.36 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 3d29 s ALA 44 CO 0.01 -0.33 -0.17 0.20 0.00 0.00 0.00 175.76 175.48 3d29 s GLY 45 N 1.32 1.48 0.21 0.00 0.00 -0.21 -1.17 107.32 108.95 3d29 s GLY 45 Ca 0.07 -0.99 0.04 0.00 0.00 0.00 0.00 44.72 43.84 3d29 s GLY 45 CO 0.07 -0.71 -0.05 0.00 0.00 0.00 0.00 173.10 172.41 3d29 s ALA 46 N -0.53 1.77 0.00 3.20 0.00 0.25 -4.87 121.76 121.58 3d29 s ALA 46 Ca 0.07 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.35 3d29 s ALA 46 Cb -0.11 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.29 3d29 s ALA 46 CO 0.01 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.02 3d29 n GLY 47 N -0.36 0.87 3.59 0.00 0.00 -1.26 -1.59 105.19 106.43 3d29 n GLY 47 Ca -0.07 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 3d29 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d29 s THR 48 N 0.00 3.99 0.05 2.61 2.01 0.62 -4.93 115.64 119.99 3d29 s THR 48 Ca 0.00 0.92 -0.10 0.00 0.31 0.00 0.00 61.69 62.82 3d29 s THR 48 Cb 0.00 -4.57 -0.02 0.00 0.01 0.00 0.00 72.50 67.91 3d29 s THR 48 CO 0.00 -1.17 0.93 0.00 -0.69 0.00 0.00 174.62 173.69 3d29 n ALA 49 N 8.64 -0.20 -0.14 7.40 0.00 -1.26 -0.44 120.51 134.51 3d29 n ALA 49 Ca 0.11 0.26 0.15 0.00 0.00 0.00 0.00 53.44 53.96 3d29 n ALA 49 Cb 0.49 0.18 0.51 0.00 0.00 0.00 0.00 19.45 20.63 3d29 n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d29 h ALA 50 N -0.30 2.10 -0.22 0.00 0.00 -1.97 -1.69 119.26 117.19 3d29 h ALA 50 Ca 0.05 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3d29 h ALA 50 Cb 0.13 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3d29 h ALA 50 CO -0.29 -0.29 -0.14 -0.44 0.00 0.00 0.00 179.25 178.09 3d29 h ASP 51 N 0.40 0.51 -0.54 0.00 3.45 -1.09 -0.23 116.42 118.92 3d29 h ASP 51 Ca 0.34 -0.44 -0.02 0.00 0.43 0.00 0.00 57.03 57.35 3d29 h ASP 51 Cb 0.78 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.38 3d29 h ASP 51 CO -0.10 0.84 0.27 0.71 -1.57 0.00 0.00 179.24 179.38 3d29 h THR 52 N 0.18 1.20 0.39 0.35 1.35 -0.61 -1.54 112.91 114.23 3d29 h THR 52 Ca 0.04 -0.54 -0.02 0.00 -0.55 0.00 0.00 66.41 65.35 3d29 h THR 52 Cb 0.66 0.56 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 3d29 h THR 52 CO 0.04 0.22 -0.19 -0.08 -0.25 0.00 0.00 175.52 175.26 3d29 h GLU 53 N 0.72 -0.51 -0.32 4.72 4.57 -1.26 -1.09 114.58 121.42 3d29 h GLU 53 Ca 0.19 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 3d29 h GLU 53 Cb 0.10 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 3d29 h GLU 53 CO -0.03 -0.33 0.20 0.00 -1.18 0.00 0.00 179.01 177.68 3d29 h ALA 54 N 0.06 0.40 -0.12 2.92 0.00 -0.98 -0.30 119.26 121.23 3d29 h ALA 54 Ca -0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 3d29 h ALA 54 Cb 0.42 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3d29 h ALA 54 CO 0.09 -0.12 -0.35 -0.24 0.00 0.00 0.00 179.25 178.63 3d29 h VAL 55 N 0.42 1.28 -0.45 0.00 3.04 -1.30 -0.81 116.25 118.42 3d29 h VAL 55 Ca 0.11 -1.38 -0.13 0.00 -1.01 0.00 0.00 66.70 64.30 3d29 h VAL 55 Cb -0.03 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 30.82 3d29 h VAL 55 CO -0.02 0.41 -0.23 0.74 -1.01 0.00 0.00 177.57 177.46 3d29 h THR 56 N 0.22 1.27 -0.13 3.17 2.02 -0.79 -2.19 112.91 116.47 3d29 h THR 56 Ca 0.03 -1.39 -0.18 0.00 0.77 0.00 0.00 66.41 65.64 3d29 h THR 56 Cb 0.73 1.16 0.01 0.00 -1.74 0.00 0.00 68.15 68.31 3d29 h THR 56 CO 0.06 0.47 -0.61 1.56 0.37 0.00 0.00 175.52 177.37 3d29 h GLN 57 N 0.81 0.64 0.19 6.66 4.20 -0.77 -1.72 115.11 125.11 3d29 h GLN 57 Ca 0.10 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.30 3d29 h GLN 57 Cb 0.79 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 3d29 h GLN 57 CO 0.07 1.14 -0.19 1.25 -0.67 0.00 0.00 178.83 180.43 3d29 h LEU 58 N 0.30 -0.50 -0.83 1.46 5.85 -1.13 0.21 115.31 120.68 3d29 h LEU 58 Ca -0.04 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 3d29 h LEU 58 Cb 1.24 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 3d29 h LEU 58 CO 0.13 -0.28 -0.17 0.40 -0.34 0.00 0.00 178.44 178.17 3d29 h ILE 59 N -0.40 1.26 -0.42 4.05 5.03 -1.48 -1.41 117.51 124.14 3d29 h ILE 59 Ca 0.00 -1.22 0.02 0.00 -0.12 0.00 0.00 64.86 63.54 3d29 h ILE 59 Cb 0.38 1.17 -0.03 0.00 -3.03 0.00 0.00 36.82 35.31 3d29 h ILE 59 CO -0.05 0.41 0.24 1.23 -0.68 0.00 0.00 178.15 179.30 3d29 h GLY 60 N 0.98 0.58 0.95 5.37 0.00 -0.92 0.21 103.07 110.24 3d29 h GLY 60 Ca 0.10 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.26 3d29 h GLY 60 CO 0.04 0.15 0.28 0.23 0.00 0.00 0.00 176.54 177.25 3d29 h SER 61 N 0.48 0.47 0.36 0.19 0.87 -0.28 -1.19 113.55 114.44 3d29 h SER 61 Ca 0.17 -0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.64 3d29 h SER 61 Cb 0.02 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3d29 h SER 61 CO -0.09 0.34 -0.38 0.78 -0.53 0.00 0.00 176.83 176.95 3d29 h ASN 62 N 0.57 0.04 -0.39 6.23 2.35 -0.72 -2.04 115.58 121.63 3d29 h ASN 62 Ca 0.17 -0.02 -0.08 0.00 -0.55 0.00 0.00 56.30 55.82 3d29 h ASN 62 Cb -0.03 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 3d29 h ASN 62 CO -0.06 0.43 -0.08 0.40 -1.65 0.00 0.00 177.43 176.47 3d29 h ILE 63 N 0.04 1.27 -0.10 2.81 1.08 -0.05 -0.29 117.51 122.28 3d29 h ILE 63 Ca 0.00 -1.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.32 3d29 h ILE 63 Cb 0.70 1.22 -0.00 0.00 -3.07 0.00 0.00 36.82 35.67 3d29 h ILE 63 CO 0.05 0.38 0.06 -0.08 -0.69 0.00 0.00 178.15 177.88 3d29 h GLU 64 N 0.55 0.13 -0.70 2.37 4.81 -0.92 0.18 114.58 121.00 3d29 h GLU 64 Ca 0.10 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3d29 h GLU 64 Cb 0.59 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 3d29 h GLU 64 CO 0.04 0.08 0.45 -0.07 -0.73 0.00 0.00 179.01 178.78 3d29 h LEU 65 N 0.13 0.77 -0.50 1.64 3.38 -1.28 -1.00 115.31 118.45 3d29 h LEU 65 Ca 0.04 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3d29 h LEU 65 Cb -0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3d29 h LEU 65 CO -0.01 0.54 0.22 -0.74 0.09 0.00 0.00 178.44 178.55 3d29 h HIS 66 N 0.91 0.74 -0.15 1.13 2.76 -0.61 -0.79 115.15 119.13 3d29 h HIS 66 Ca 0.27 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.41 3d29 h HIS 66 Cb -0.05 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.66 3d29 h HIS 66 CO -0.03 0.60 0.00 1.03 -1.30 0.00 0.00 177.93 178.23 3d29 h SER 67 N 0.66 -0.05 -0.92 3.26 0.87 -0.25 0.52 113.55 117.64 3d29 h SER 67 Ca 0.17 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 3d29 h SER 67 Cb 0.16 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 3d29 h SER 67 CO -0.02 -0.00 0.53 -0.07 -0.53 0.00 0.00 176.83 176.74 3d29 h LEU 68 N 0.06 1.12 -0.70 2.23 4.07 -0.98 0.19 115.31 121.31 3d29 h LEU 68 Ca 0.07 -0.09 -0.12 0.00 0.08 0.00 0.00 57.88 57.82 3d29 h LEU 68 Cb 0.08 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.52 3d29 h LEU 68 CO -0.12 0.88 -0.32 0.22 -1.08 0.00 0.00 178.44 178.02 3d29 h TYR 69 N 1.27 0.75 -0.00 1.13 5.03 -0.56 -3.22 116.97 121.36 3d29 h TYR 69 Ca 0.33 -0.19 0.00 0.00 2.58 0.00 0.00 58.73 61.44 3d29 h TYR 69 Cb -0.01 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.10 3d29 h TYR 69 CO 0.01 0.89 -0.71 0.25 -1.32 0.00 0.00 178.16 177.27 3d29 n THR 70 N -4.07 0.00 -2.91 1.81 -2.24 0.12 -4.96 114.28 102.03 3d29 n THR 70 Ca -0.01 -0.06 -0.22 0.00 -2.27 0.00 0.00 64.05 61.50 3d29 n THR 70 Cb 0.48 0.80 0.02 0.00 -2.10 0.00 0.00 70.33 69.52 3d29 n THR 70 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3d29 n SER 71 N -1.17 -5.77 -4.28 3.42 7.64 0.65 -4.98 113.62 109.14 3d29 n SER 71 Ca 0.06 -0.22 -0.17 0.00 1.01 0.00 0.00 58.87 59.54 3d29 n SER 71 Cb 0.36 -4.71 -0.11 0.00 -1.01 0.00 0.00 64.21 58.75 3d29 n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3d29 s ARG 72 N -5.58 1.13 0.30 1.43 0.52 -1.15 -5.06 118.95 110.54 3d29 s ARG 72 Ca 0.24 -1.39 -0.29 0.00 -0.52 0.00 0.00 55.73 53.77 3d29 s ARG 72 Cb -0.11 -0.92 -0.10 0.00 0.52 0.00 0.00 34.95 34.34 3d29 s ARG 72 CO 0.30 0.16 1.19 -1.21 0.02 0.00 0.00 175.30 175.76 3d29 s GLU 73 N -3.18 4.51 0.60 3.54 0.41 -1.26 -4.59 118.70 118.73 3d29 s GLU 73 Ca 0.15 1.99 -0.19 0.00 -0.41 0.00 0.00 54.97 56.50 3d29 s GLU 73 Cb -0.02 -3.14 -0.03 0.00 -1.78 0.00 0.00 34.13 29.16 3d29 s GLU 73 CO 0.04 0.03 1.25 -2.14 -0.49 0.00 0.00 175.26 173.95 3d29 s PRO 74 N -1.55 2.88 0.02 0.39 0.02 -1.26 -4.84 135.00 130.65 3d29 s PRO 74 Ca 0.47 1.95 0.03 0.00 0.02 0.00 0.00 61.00 63.46 3d29 s PRO 74 Cb -0.35 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.18 3d29 s PRO 74 CO 0.46 -1.31 -0.02 1.03 -0.33 0.00 0.00 177.00 176.82 3d29 s ARG 75 N -3.28 2.66 0.33 5.54 0.52 -1.26 -4.73 118.95 118.73 3d29 s ARG 75 Ca 0.78 -0.69 0.02 0.00 -0.52 0.00 0.00 55.73 55.32 3d29 s ARG 75 Cb -0.34 -2.59 0.59 0.00 0.52 0.00 0.00 34.95 33.14 3d29 s ARG 75 CO 0.37 0.60 1.96 0.28 0.02 0.00 0.00 175.30 178.53 3d29 h VAL 76 N 3.50 1.11 -0.46 3.52 2.07 -1.91 -1.56 116.25 122.51 3d29 h VAL 76 Ca -0.49 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 3d29 h VAL 76 Cb 1.17 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 3d29 h VAL 76 CO 0.56 0.17 0.27 -0.37 0.02 0.00 0.00 177.57 178.22 3d29 h VAL 77 N 0.93 1.14 -0.50 2.57 -1.51 -1.99 -1.13 116.25 115.76 3d29 h VAL 77 Ca 0.31 -0.31 -0.04 0.00 -1.23 0.00 0.00 66.70 65.43 3d29 h VAL 77 Cb 0.07 0.49 -0.02 0.00 -2.13 0.00 0.00 31.29 29.70 3d29 h VAL 77 CO -0.09 0.14 0.16 0.28 -1.23 0.00 0.00 177.57 176.83 3d29 h SER 78 N 0.63 0.73 -0.65 4.19 0.02 -1.70 -0.38 113.55 116.41 3d29 h SER 78 Ca 0.17 -0.21 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 3d29 h SER 78 Cb -0.01 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 3d29 h SER 78 CO -0.03 0.75 0.26 0.00 -1.14 0.00 0.00 176.83 176.67 3d29 h ALA 79 N 1.02 0.84 -0.76 3.77 0.00 -1.33 -1.19 119.26 121.61 3d29 h ALA 79 Ca 0.16 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3d29 h ALA 79 Cb 0.27 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3d29 h ALA 79 CO -0.01 0.45 0.50 1.25 0.00 0.00 0.00 179.25 181.45 3d29 h LEU 80 N 0.91 0.87 -0.12 0.00 5.85 -0.80 -0.50 115.31 121.53 3d29 h LEU 80 Ca 0.22 -0.02 -0.18 0.00 0.84 0.00 0.00 57.88 58.73 3d29 h LEU 80 Cb 0.20 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.02 3d29 h LEU 80 CO -0.02 0.63 -0.63 -0.61 -0.34 0.00 0.00 178.44 177.48 3d29 h GLN 81 N 1.03 0.63 -0.63 1.25 5.75 -0.85 -1.85 115.11 120.46 3d29 h GLN 81 Ca 0.28 -0.52 -0.08 0.00 -0.15 0.00 0.00 58.65 58.18 3d29 h GLN 81 Cb -0.12 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 3d29 h GLN 81 CO -0.06 1.14 0.10 0.52 -2.65 0.00 0.00 178.83 177.88 3d29 h MET 82 N 0.29 1.04 0.33 1.69 2.86 -1.11 -1.90 114.93 118.13 3d29 h MET 82 Ca -0.04 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.30 3d29 h MET 82 Cb 1.27 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.81 3d29 h MET 82 CO 0.13 0.97 -0.16 -0.07 1.06 0.00 0.00 176.91 178.84 3d29 h LEU 83 N 0.95 -0.38 -0.68 1.22 3.38 -1.11 -2.67 115.31 116.02 3d29 h LEU 83 Ca 0.19 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.05 3d29 h LEU 83 Cb 0.44 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 3d29 h LEU 83 CO 0.01 -0.03 0.40 0.07 0.09 0.00 0.00 178.44 178.98 3d29 h LYS 84 N -0.76 0.74 -0.12 1.13 2.10 -1.33 0.86 116.57 119.19 3d29 h LYS 84 Ca -0.05 -0.04 -0.06 0.00 -2.00 0.00 0.00 60.65 58.50 3d29 h LYS 84 Cb 0.51 -0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 31.66 3d29 h LYS 84 CO 0.08 0.49 -0.19 1.96 -2.00 0.00 0.00 179.45 179.78 3d29 h GLN 85 N 0.76 0.21 0.14 0.07 4.20 -1.41 0.15 115.11 119.23 3d29 h GLN 85 Ca 0.29 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 3d29 h GLN 85 Cb 0.11 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3d29 h GLN 85 CO -0.15 0.40 -0.07 1.25 -0.67 0.00 0.00 178.83 179.60 3d29 h HIS 86 N 0.19 -0.18 -0.58 2.96 2.76 -0.94 -1.62 115.15 117.74 3d29 h HIS 86 Ca 0.04 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 3d29 h HIS 86 Cb 0.46 0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.45 3d29 h HIS 86 CO 0.01 0.25 0.38 -0.07 -1.30 0.00 0.00 177.93 177.20 3d29 h LEU 87 N -0.69 0.62 -0.31 0.26 3.38 -0.63 -2.13 115.31 115.80 3d29 h LEU 87 Ca -0.02 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 3d29 h LEU 87 Cb 0.51 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3d29 h LEU 87 CO 0.03 0.43 -0.52 0.15 0.09 0.00 0.00 178.44 178.62 3d29 h PHE 88 N 0.72 1.12 -0.37 1.13 3.57 -0.69 -2.75 116.94 119.67 3d29 h PHE 88 Ca 0.22 -0.39 0.11 0.00 3.53 0.00 0.00 57.97 61.44 3d29 h PHE 88 Cb 0.02 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3d29 h PHE 88 CO -0.00 1.23 0.30 -0.22 -2.23 0.00 0.00 178.31 177.39 3d29 h LYS 89 N 0.69 0.00 -0.65 1.11 3.64 -0.62 -0.84 116.57 119.91 3d29 h LYS 89 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3d29 h LYS 89 Cb 1.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3d29 h LYS 89 CO 0.12 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.96 3d29 n TYR 90 N -4.16 1.39 -3.92 1.91 4.01 -1.04 -4.96 117.16 110.39 3d29 n TYR 90 Ca 0.06 -0.55 -0.31 0.00 -0.16 0.00 0.00 57.90 56.95 3d29 n TYR 90 Cb 0.48 -0.24 -0.05 0.00 -0.31 0.00 0.00 39.34 39.23 3d29 n TYR 90 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3d29 n GLN 91 N 1.00 -1.89 -1.00 -0.72 6.02 -0.32 0.23 117.38 120.71 3d29 n GLN 91 Ca 0.24 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 3d29 n GLN 91 Cb 0.84 -4.79 0.00 0.00 1.02 0.00 0.00 30.24 27.30 3d29 n GLN 91 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d29 n GLY 93 N -1.01 0.76 0.26 1.08 0.00 -1.22 -4.90 105.19 100.16 3d29 n GLY 93 Ca 0.07 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.25 3d29 n GLY 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3d29 h HIS 94 N 0.00 0.00 -2.76 1.61 3.86 -0.50 -3.37 115.15 113.99 3d29 h HIS 94 Ca 0.00 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.54 3d29 h HIS 94 Cb 0.01 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 28.30 3d29 h HIS 94 CO 0.00 0.03 0.39 0.42 0.86 0.00 0.00 177.93 179.63 3d29 s ILE 95 N -3.59 4.62 -0.28 2.45 1.01 -1.26 -4.94 121.20 119.20 3d29 s ILE 95 Ca 0.02 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 59.81 3d29 s ILE 95 Cb 0.08 -4.61 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 3d29 s ILE 95 CO 0.58 -1.31 1.43 0.61 0.00 0.00 0.00 174.94 176.24 3d29 n GLY 96 N 5.29 2.06 3.61 6.18 0.00 -1.26 -4.74 105.19 116.34 3d29 n GLY 96 Ca -0.02 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 3d29 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d29 s ALA 97 N 3.73 3.18 -0.09 4.61 0.00 -1.26 -0.27 121.76 131.65 3d29 s ALA 97 Ca 0.17 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 3d29 s ALA 97 Cb 0.06 -1.52 0.03 0.00 0.00 0.00 0.00 23.12 21.69 3d29 s ALA 97 CO -0.01 0.44 -0.04 0.71 0.00 0.00 0.00 175.76 176.86 3d29 s TYR 98 N -0.39 1.07 0.08 0.00 2.02 -0.62 -1.14 117.35 118.38 3d29 s TYR 98 Ca 0.07 -0.45 0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3d29 s TYR 98 Cb -0.12 -1.02 -0.04 0.00 -0.40 0.00 0.00 41.96 40.39 3d29 s TYR 98 CO 0.02 -0.42 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.00 3d29 s LEU 99 N 1.84 2.43 -0.23 -1.29 1.43 0.20 -0.58 118.68 122.48 3d29 s LEU 99 Ca 0.05 -0.86 -0.00 0.00 -1.03 0.00 0.00 54.13 52.29 3d29 s LEU 99 Cb -0.12 -0.12 0.03 0.00 0.03 0.00 0.00 46.19 46.01 3d29 s LEU 99 CO -0.07 -0.37 -0.11 -0.63 0.23 0.00 0.00 176.35 175.40 3d29 s ILE 100 N -2.86 2.55 -0.15 -0.59 1.01 -0.32 0.97 121.20 121.81 3d29 s ILE 100 Ca 0.05 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 59.61 3d29 s ILE 100 Cb 0.00 -2.26 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 3d29 s ILE 100 CO -0.03 0.27 -0.10 0.54 0.00 0.00 0.00 174.94 175.62 3d29 s VAL 101 N 1.29 3.23 0.24 2.92 0.11 -0.49 -0.88 120.40 126.82 3d29 s VAL 101 Ca 0.00 -0.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.47 3d29 s VAL 101 Cb -0.16 -2.39 -0.05 0.00 -1.53 0.00 0.00 36.38 32.26 3d29 s VAL 101 CO -0.07 0.51 0.11 0.00 -3.33 0.00 0.00 175.10 172.32 3d29 s ALA 102 N 0.52 1.57 0.00 1.54 0.00 -0.47 -1.10 121.76 123.82 3d29 s ALA 102 Ca -0.07 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.07 3d29 s ALA 102 Cb -0.15 1.16 0.00 0.00 0.00 0.00 0.00 23.12 24.12 3d29 s ALA 102 CO 0.04 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.71 3d29 n GLY 103 N -0.41 1.08 3.25 0.00 0.00 -1.02 -1.22 105.19 106.87 3d29 n GLY 103 Ca 0.01 -1.28 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 3d29 n GLY 103 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d29 s VAL 104 N -1.95 1.75 0.28 1.61 -7.23 -0.87 -0.42 120.40 113.58 3d29 s VAL 104 Ca 0.00 -0.99 -0.01 0.00 -1.81 0.00 0.00 61.98 59.17 3d29 s VAL 104 Cb 0.00 -1.46 0.01 0.00 0.56 0.00 0.00 36.38 35.48 3d29 s VAL 104 CO 0.00 0.46 0.39 -0.90 -0.31 0.00 0.00 175.10 174.74 3d29 n ASP 105 N 2.44 -1.09 0.27 4.85 3.85 0.03 -4.75 116.55 122.14 3d29 n ASP 105 Ca -0.16 -2.53 0.10 0.00 -0.71 0.00 0.00 54.79 51.50 3d29 n ASP 105 Cb 0.52 2.05 0.54 0.00 -1.35 0.00 0.00 41.12 42.88 3d29 n ASP 105 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.20 175.54 3d29 h PRO 10 N 0.00 0.00 -0.02 0.11 0.11 -1.88 -0.02 132.00 130.30 3d29 h PRO 10 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3d29 h PRO 10 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3d29 h PRO 10 CO 0.30 0.00 -0.20 0.25 -0.21 0.00 0.00 178.00 178.14 3d29 n THR 106 N -2.50 0.00 0.00 -1.15 -2.24 -1.26 -5.08 114.28 102.05 3d29 n THR 106 Ca -0.01 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3d29 n THR 106 Cb 0.43 1.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.99 3d29 n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d29 n GLY 107 N 1.37 0.62 3.77 3.38 0.00 -0.02 -5.07 105.19 109.24 3d29 n GLY 107 Ca 0.12 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 3d29 n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d29 s SER 108 N -4.00 5.61 0.02 1.61 1.04 -1.26 -0.79 113.70 115.93 3d29 s SER 108 Ca 0.00 0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.56 3d29 s SER 108 Cb 0.00 -1.59 -0.01 0.00 0.10 0.00 0.00 66.02 64.51 3d29 s SER 108 CO 0.00 0.27 -0.04 -1.00 0.98 0.00 0.00 173.24 173.45 3d29 s HIS 109 N -1.19 0.38 -0.15 5.02 3.76 0.44 -5.00 115.29 118.55 3d29 s HIS 109 Ca 0.23 -0.32 -0.03 0.00 -0.15 0.00 0.00 55.06 54.79 3d29 s HIS 109 Cb -0.12 -0.24 0.05 0.00 1.11 0.00 0.00 32.58 33.38 3d29 s HIS 109 CO 0.14 -0.08 0.03 -1.17 -0.85 0.00 0.00 174.74 172.81 3d29 s LEU 110 N -0.91 0.93 0.30 0.89 2.96 -1.26 -2.43 118.68 119.16 3d29 s LEU 110 Ca -0.07 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.29 3d29 s LEU 110 Cb -0.06 -0.52 -0.05 0.00 0.50 0.00 0.00 46.19 46.06 3d29 s LEU 110 CO -0.00 -0.27 0.09 -0.36 -1.32 0.00 0.00 176.35 174.49 3d29 s PHE 111 N 1.92 1.71 0.01 5.38 0.08 -0.26 -2.82 117.98 124.00 3d29 s PHE 111 Ca 0.01 -1.14 -0.01 0.00 0.12 0.00 0.00 56.93 55.92 3d29 s PHE 111 Cb -0.15 -1.05 -0.01 0.00 -0.57 0.00 0.00 43.02 41.23 3d29 s PHE 111 CO -0.07 -0.24 -0.00 -1.54 -0.10 0.00 0.00 175.22 173.27 3d29 s SER 112 N -3.40 0.17 -0.02 1.36 1.04 -0.87 -1.40 113.70 110.58 3d29 s SER 112 Ca 0.36 -0.37 0.03 0.00 0.48 0.00 0.00 55.95 56.45 3d29 s SER 112 Cb 0.07 0.10 -0.00 0.00 0.10 0.00 0.00 66.02 66.30 3d29 s SER 112 CO 0.15 -0.26 -0.10 -0.63 0.98 0.00 0.00 173.24 173.39 3d29 s ILE 113 N -1.18 0.81 0.16 -1.02 1.01 0.27 -1.64 121.20 119.61 3d29 s ILE 113 Ca -0.13 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.17 3d29 s ILE 113 Cb -0.08 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 3d29 s ILE 113 CO -0.01 0.24 0.13 -1.00 0.00 0.00 0.00 174.94 174.31 3d29 s HIS 114 N 0.01 3.16 0.36 3.97 3.76 -0.49 -0.63 115.29 125.43 3d29 s HIS 114 Ca -0.00 -0.01 0.18 0.00 -0.15 0.00 0.00 55.06 55.08 3d29 s HIS 114 Cb -0.07 -1.52 1.17 0.00 1.11 0.00 0.00 32.58 33.27 3d29 s HIS 114 CO 0.00 0.52 1.66 0.00 -0.85 0.00 0.00 174.74 176.07 3d29 h ALA 115 N 2.49 2.13 0.00 -1.40 0.00 -1.42 0.38 119.26 121.44 3d29 h ALA 115 Ca -0.48 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3d29 h ALA 115 Cb 1.20 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3d29 h ALA 115 CO 0.63 -0.74 0.00 0.72 0.00 0.00 0.00 179.25 179.87 3d29 n HIS 116 N -4.97 0.64 0.00 0.00 8.25 -1.26 -3.73 115.22 114.15 3d29 n HIS 116 Ca 0.33 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 58.00 3d29 n HIS 116 Cb 1.07 -0.85 0.00 0.00 1.12 0.00 0.00 29.99 31.34 3d29 n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3d29 n GLY 117 N 0.78 0.89 3.82 -1.41 0.00 0.13 -3.98 105.19 105.43 3d29 n GLY 117 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3d29 n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d29 s SER 118 N -1.10 7.01 0.22 1.61 1.04 -1.25 -4.80 113.70 116.42 3d29 s SER 118 Ca 0.00 1.48 0.11 0.00 0.48 0.00 0.00 55.95 58.02 3d29 s SER 118 Cb 0.00 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 3d29 s SER 118 CO 0.00 -0.10 -0.21 0.42 0.98 0.00 0.00 173.24 174.33 3d29 s THR 119 N -1.75 2.30 0.08 2.02 -4.23 -1.26 -1.40 115.64 111.40 3d29 s THR 119 Ca 0.50 -2.16 0.01 0.00 -1.18 0.00 0.00 61.69 58.86 3d29 s THR 119 Cb -0.14 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 71.51 3d29 s THR 119 CO 0.19 -0.26 -0.06 -1.81 -0.54 0.00 0.00 174.62 172.15 3d29 s ASP 120 N -2.99 0.95 0.03 3.99 1.01 -0.65 -4.97 116.67 114.04 3d29 s ASP 120 Ca 0.23 -0.97 0.05 0.00 0.71 0.00 0.00 52.55 52.58 3d29 s ASP 120 Cb -0.06 0.12 -0.02 0.00 1.01 0.00 0.00 42.92 43.96 3d29 s ASP 120 CO 0.11 -0.48 -0.16 0.54 0.21 0.00 0.00 175.17 175.39 3d29 s VAL 121 N -3.53 1.26 0.09 -1.27 0.11 -1.26 -2.05 120.40 113.75 3d29 s VAL 121 Ca 0.09 -0.99 -0.25 0.00 -2.93 0.00 0.00 61.98 57.90 3d29 s VAL 121 Cb 0.05 -1.11 0.08 0.00 -1.53 0.00 0.00 36.38 33.87 3d29 s VAL 121 CO -0.06 0.10 1.15 -0.83 -3.33 0.00 0.00 175.10 172.14 3d29 s GLY 122 N -1.02 0.03 0.05 6.54 0.00 -1.13 -5.01 107.32 106.78 3d29 s GLY 122 Ca 0.04 -0.21 0.22 0.00 0.00 0.00 0.00 44.72 44.77 3d29 s GLY 122 CO 0.01 4.22 0.81 -1.72 0.00 0.00 0.00 173.10 176.42 3d29 n TYR 123 N -0.82 0.32 -3.69 1.90 4.02 -1.26 -4.55 117.16 113.09 3d29 n TYR 123 Ca 0.01 0.09 -0.10 0.00 -0.01 0.00 0.00 57.90 57.89 3d29 n TYR 123 Cb 0.59 -0.56 -0.10 0.00 -0.02 0.00 0.00 39.34 39.25 3d29 n TYR 123 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 3d29 s TYR 124 N -3.35 -0.69 0.03 -0.72 1.13 -1.26 -0.66 117.35 111.84 3d29 s TYR 124 Ca -0.02 1.46 -0.04 0.00 -1.41 0.00 0.00 57.07 57.07 3d29 s TYR 124 Cb 0.13 0.33 -0.01 0.00 -1.10 0.00 0.00 41.96 41.31 3d29 s TYR 124 CO 0.84 -0.37 0.06 -0.51 -2.51 0.00 0.00 175.55 173.07 3d29 s LEU 125 N 1.27 1.94 -0.05 -3.49 1.43 -0.35 -4.96 118.68 114.48 3d29 s LEU 125 Ca -0.08 -0.55 -0.08 0.00 -1.03 0.00 0.00 54.13 52.39 3d29 s LEU 125 Cb -0.07 0.47 0.01 0.00 0.03 0.00 0.00 46.19 46.63 3d29 s LEU 125 CO -0.12 -0.47 0.19 -0.94 0.23 0.00 0.00 176.35 175.24 3d29 s SER 126 N -2.02 -0.14 0.15 2.29 1.04 -1.26 -0.33 113.70 113.42 3d29 s SER 126 Ca -0.07 0.20 -0.01 0.00 0.48 0.00 0.00 55.95 56.55 3d29 s SER 126 Cb -0.02 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.40 3d29 s SER 126 CO -0.04 -0.19 0.06 -0.76 0.98 0.00 0.00 173.24 173.29 3d29 s LEU 127 N -0.46 1.75 0.00 2.42 1.43 -0.63 -4.90 118.68 118.29 3d29 s LEU 127 Ca -0.06 -1.23 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 3d29 s LEU 127 Cb -0.04 0.26 0.00 0.00 0.03 0.00 0.00 46.19 46.44 3d29 s LEU 127 CO 0.01 -0.72 0.00 0.61 0.23 0.00 0.00 176.35 176.48 3d29 n GLY 128 N -0.14 0.78 0.26 -3.19 0.00 -1.26 -2.09 105.19 99.55 3d29 n GLY 128 Ca -0.05 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 43.99 3d29 n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d29 h SER 129 N 0.00 0.00 -0.19 1.61 4.64 -1.71 -0.71 113.55 117.19 3d29 h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d29 h SER 129 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3d29 h SER 129 CO 0.00 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 3d29 n GLY 130 N -0.84 0.24 0.33 -0.77 0.00 -0.32 -4.44 105.19 99.38 3d29 n GLY 130 Ca -0.02 -0.38 0.05 0.00 0.00 0.00 0.00 46.02 45.68 3d29 n GLY 130 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3d29 h SER 131 N 1.96 -0.78 -0.19 1.61 0.87 -1.27 -1.47 113.55 114.26 3d29 h SER 131 Ca 0.00 0.27 -0.20 0.00 -1.23 0.00 0.00 61.79 60.63 3d29 h SER 131 Cb 0.43 0.54 0.01 0.00 -0.44 0.00 0.00 62.40 62.94 3d29 h SER 131 CO 0.00 -0.30 -0.65 -0.07 -0.53 0.00 0.00 176.83 175.29 3d29 h LEU 132 N 0.01 0.90 -0.38 2.23 4.07 -1.82 -1.11 115.31 119.21 3d29 h LEU 132 Ca 0.45 -0.59 0.00 0.00 0.08 0.00 0.00 57.88 57.82 3d29 h LEU 132 Cb 0.72 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.18 3d29 h LEU 132 CO -0.92 1.34 0.25 0.00 -1.08 0.00 0.00 178.44 178.03 3d29 h ALA 133 N 0.58 0.49 0.15 1.53 0.00 -1.71 -1.52 119.26 118.78 3d29 h ALA 133 Ca -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3d29 h ALA 133 Cb 1.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3d29 h ALA 133 CO 0.14 -0.05 -0.07 0.00 0.00 0.00 0.00 179.25 179.27 3d29 h ALA 134 N 1.13 -0.20 -0.39 0.00 0.00 -1.29 -3.01 119.26 115.50 3d29 h ALA 134 Ca 0.14 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.01 3d29 h ALA 134 Cb -0.05 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3d29 h ALA 134 CO -0.03 -0.55 0.27 1.98 0.00 0.00 0.00 179.25 180.92 3d29 h MET 135 N -0.32 0.29 -0.32 0.00 -1.53 -1.07 -0.61 114.93 111.38 3d29 h MET 135 Ca -0.02 -0.02 -0.07 0.00 -3.44 0.00 0.00 59.70 56.15 3d29 h MET 135 Cb 0.25 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.22 3d29 h MET 135 CO 0.03 0.19 -0.10 0.00 0.14 0.00 0.00 176.91 177.18 3d29 h ALA 136 N 1.79 1.24 -0.01 0.39 0.00 -1.14 0.49 119.26 122.01 3d29 h ALA 136 Ca 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3d29 h ALA 136 Cb 0.30 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3d29 h ALA 136 CO -0.04 0.50 -0.03 0.28 0.00 0.00 0.00 179.25 179.96 3d29 h VAL 137 N 0.50 1.45 -0.32 0.00 2.07 -1.11 -2.17 116.25 116.67 3d29 h VAL 137 Ca 0.09 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.28 3d29 h VAL 137 Cb 0.47 2.35 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 3d29 h VAL 137 CO 0.03 0.36 0.06 -0.07 0.02 0.00 0.00 177.57 177.97 3d29 h LEU 138 N -0.52 0.01 -1.87 2.57 3.38 -1.01 0.20 115.31 118.07 3d29 h LEU 138 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3d29 h LEU 138 Cb 0.61 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3d29 h LEU 138 CO 0.01 0.04 0.00 -0.33 0.09 0.00 0.00 178.44 178.25 3d29 h GLU 139 N 0.18 0.00 0.00 1.13 4.39 -0.04 -1.07 114.58 119.17 3d29 h GLU 139 Ca 0.15 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.57 3d29 h GLU 139 Cb 0.16 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.76 3d29 h GLU 139 CO -0.20 0.00 -1.91 0.43 -1.16 0.00 0.00 179.01 176.17 3d29 n SER 140 N -2.73 0.52 0.00 1.42 7.64 0.42 -4.68 113.62 116.21 3d29 n SER 140 Ca -0.01 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.11 3d29 n SER 140 Cb 0.14 0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 3d29 n SER 140 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3d29 n HIS 141 N -2.87 0.00 -2.70 1.43 8.25 0.42 -5.05 115.22 114.70 3d29 n HIS 141 Ca -0.21 -0.03 -0.39 0.00 -0.26 0.00 0.00 57.72 56.84 3d29 n HIS 141 Cb 1.03 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 32.08 3d29 n HIS 141 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 3d29 s TRP 142 N -0.06 3.78 0.05 4.41 -0.00 -0.42 -5.04 118.94 121.66 3d29 s TRP 142 Ca 0.00 1.82 -0.05 0.00 -0.00 0.00 0.00 56.10 57.87 3d29 s TRP 142 Cb 0.00 -3.03 -0.02 0.00 -0.00 0.00 0.00 33.47 30.43 3d29 s TRP 142 CO 0.00 0.14 0.09 -1.59 -0.00 0.00 0.00 176.95 175.59 3d29 s LYS 143 N -1.57 0.65 0.35 5.86 -2.85 -1.26 -5.01 119.74 115.90 3d29 s LYS 143 Ca 0.45 -0.89 -0.27 0.00 -1.00 0.00 0.00 55.97 54.26 3d29 s LYS 143 Cb -0.25 0.25 -0.09 0.00 -2.06 0.00 0.00 37.83 35.68 3d29 s LYS 143 CO 0.31 -0.16 1.13 -1.14 0.10 0.00 0.00 175.35 175.58 3d29 s GLN 144 N -3.14 4.34 -0.41 1.78 0.74 -1.26 -4.26 119.66 117.44 3d29 s GLN 144 Ca -0.00 1.79 -0.00 0.00 0.05 0.00 0.00 55.36 57.20 3d29 s GLN 144 Cb 0.02 -2.89 -0.00 0.00 1.10 0.00 0.00 33.01 31.24 3d29 s GLN 144 CO -0.07 -0.06 0.38 -0.25 -0.55 0.00 0.00 175.29 174.74 3d29 n ASP 145 N 0.56 -4.96 -4.94 6.67 10.43 -1.26 -5.06 116.55 117.99 3d29 n ASP 145 Ca 0.02 -0.08 -0.26 0.00 2.57 0.00 0.00 54.79 57.04 3d29 n ASP 145 Cb 0.46 -3.22 -0.03 0.00 1.84 0.00 0.00 41.12 40.17 3d29 n ASP 145 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3d29 s LEU 146 N -3.21 4.31 0.41 0.64 1.43 -1.26 -4.81 118.68 116.19 3d29 s LEU 146 Ca 0.03 0.22 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 3d29 s LEU 146 Cb -0.00 -2.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.21 3d29 s LEU 146 CO 0.39 0.02 0.68 0.42 0.23 0.00 0.00 176.35 178.09 3d29 s THR 147 N -1.78 4.98 0.30 5.49 -4.23 -1.26 -0.07 115.64 119.07 3d29 s THR 147 Ca 0.35 -0.01 0.06 0.00 -1.18 0.00 0.00 61.69 60.91 3d29 s THR 147 Cb -0.11 -3.84 0.31 0.00 1.34 0.00 0.00 72.50 70.20 3d29 s THR 147 CO 0.29 -0.66 1.67 0.50 -0.54 0.00 0.00 174.62 175.88 3d29 h LYS 148 N 0.66 0.32 -0.47 3.99 3.64 -1.99 0.13 116.57 122.86 3d29 h LYS 148 Ca -0.48 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.76 3d29 h LYS 148 Cb 1.21 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 3d29 h LYS 148 CO 0.62 0.21 -0.19 0.93 -2.27 0.00 0.00 179.45 178.76 3d29 h GLU 149 N 0.33 0.95 -0.28 1.90 3.07 -2.00 -2.26 114.58 116.30 3d29 h GLU 149 Ca 0.60 -0.40 -0.03 0.00 -0.50 0.00 0.00 59.36 59.03 3d29 h GLU 149 Cb 1.21 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.08 3d29 h GLU 149 CO -0.58 1.07 0.07 0.93 -1.40 0.00 0.00 179.01 179.09 3d29 h GLU 150 N 0.80 0.44 -0.42 2.33 5.08 -1.30 -2.45 114.58 119.06 3d29 h GLU 150 Ca 0.11 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3d29 h GLU 150 Cb 0.76 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 3d29 h GLU 150 CO 0.06 0.53 0.20 0.00 -1.00 0.00 0.00 179.01 178.80 3d29 h ALA 151 N 0.89 0.52 -0.80 3.43 0.00 -0.79 -0.15 119.26 122.37 3d29 h ALA 151 Ca 0.09 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3d29 h ALA 151 Cb 0.29 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3d29 h ALA 151 CO 0.00 -0.17 0.49 0.82 0.00 0.00 0.00 179.25 180.39 3d29 h ILE 152 N 0.40 1.22 -0.06 0.00 2.04 -1.32 0.02 117.51 119.80 3d29 h ILE 152 Ca 0.19 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 3d29 h ILE 152 Cb 0.11 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.28 3d29 h ILE 152 CO -0.15 0.23 -0.02 0.50 0.00 0.00 0.00 178.15 178.72 3d29 h LYS 153 N 1.09 0.12 0.22 2.37 3.11 -0.89 -0.20 116.57 122.40 3d29 h LYS 153 Ca 0.29 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 58.08 3d29 h LYS 153 Cb -0.06 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.15 3d29 h LYS 153 CO -0.06 0.46 -0.19 1.25 -2.81 0.00 0.00 179.45 178.10 3d29 h LEU 154 N -0.22 -0.50 -0.12 5.20 5.85 -0.74 0.19 115.31 124.98 3d29 h LEU 154 Ca 0.02 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.82 3d29 h LEU 154 Cb 0.41 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 3d29 h LEU 154 CO 0.01 -0.29 -0.13 0.00 -0.34 0.00 0.00 178.44 177.68 3d29 h ALA 155 N 0.30 -0.05 -0.75 1.25 0.00 -1.01 -0.46 119.26 118.54 3d29 h ALA 155 Ca -0.01 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3d29 h ALA 155 Cb 0.39 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 3d29 h ALA 155 CO -0.03 -0.58 0.49 1.03 0.00 0.00 0.00 179.25 180.16 3d29 h SER 156 N -0.16 0.80 -0.38 0.00 0.87 -0.83 -1.38 113.55 112.47 3d29 h SER 156 Ca 0.09 -0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.50 3d29 h SER 156 Cb 0.29 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 3d29 h SER 156 CO -0.21 0.56 -0.29 0.44 -0.53 0.00 0.00 176.83 176.80 3d29 h ASP 157 N 0.93 0.94 -0.34 6.23 3.45 0.04 -2.17 116.42 125.51 3d29 h ASP 157 Ca 0.29 -0.38 -0.01 0.00 0.43 0.00 0.00 57.03 57.36 3d29 h ASP 157 Cb 0.02 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.51 3d29 h ASP 157 CO -0.08 1.16 0.19 0.00 -1.57 0.00 0.00 179.24 178.94 3d29 h ALA 158 N 0.90 0.44 -0.77 3.45 0.00 -0.32 -1.32 119.26 121.63 3d29 h ALA 158 Ca 0.09 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3d29 h ALA 158 Cb 0.85 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3d29 h ALA 158 CO 0.08 -0.04 0.50 0.82 0.00 0.00 0.00 179.25 180.60 3d29 h ILE 159 N 0.43 1.16 -0.56 0.00 1.08 -1.18 -1.71 117.51 116.72 3d29 h ILE 159 Ca 0.12 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 64.23 3d29 h ILE 159 Cb 0.05 0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 33.83 3d29 h ILE 159 CO -0.02 0.18 0.27 1.56 -0.69 0.00 0.00 178.15 179.45 3d29 h GLN 160 N 1.00 0.79 -0.98 2.37 4.20 -0.93 -0.06 115.11 121.51 3d29 h GLN 160 Ca 0.30 -0.10 0.09 0.00 0.06 0.00 0.00 58.65 59.00 3d29 h GLN 160 Cb -0.05 -0.15 -0.07 0.00 0.30 0.00 0.00 27.48 27.50 3d29 h GLN 160 CO -0.09 0.61 0.63 0.00 -0.67 0.00 0.00 178.83 179.31 3d29 h ALA 161 N 1.51 1.50 -0.04 3.87 0.00 -0.31 -0.09 119.26 125.70 3d29 h ALA 161 Ca 0.20 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 3d29 h ALA 161 Cb 0.08 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.63 3d29 h ALA 161 CO -0.03 0.31 -0.53 0.78 0.00 0.00 0.00 179.25 179.79 3d29 h GLY 162 N 1.05 0.47 0.48 0.00 0.00 -1.07 -2.00 103.07 102.00 3d29 h GLY 162 Ca 0.45 -0.75 0.11 0.00 0.00 0.00 0.00 47.33 47.14 3d29 h GLY 162 CO -0.20 0.67 0.59 -2.22 0.00 0.00 0.00 176.54 175.37 3d29 h ILE 163 N -0.06 0.92 0.05 2.60 2.04 -0.28 0.24 117.51 123.01 3d29 h ILE 163 Ca -0.06 -0.32 -0.27 0.00 1.00 0.00 0.00 64.86 65.22 3d29 h ILE 163 Cb 1.22 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3d29 h ILE 163 CO 0.11 0.17 -1.38 -0.50 0.00 0.00 0.00 178.15 176.54 3d29 h TRP 164 N 0.94 0.18 0.00 1.37 -0.00 -1.10 -3.39 115.95 113.95 3d29 h TRP 164 Ca 0.47 -0.13 0.00 0.00 -0.00 0.00 0.00 58.89 59.23 3d29 h TRP 164 Cb 0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 29.61 3d29 h TRP 164 CO -0.02 1.15 -0.81 0.09 -0.00 0.00 0.00 178.44 178.85 3d29 n ASN 165 N -3.31 0.85 -4.31 -3.49 4.13 -0.75 -4.93 115.26 103.44 3d29 n ASN 165 Ca -0.11 -0.67 -0.36 0.00 1.68 0.00 0.00 54.58 55.13 3d29 n ASN 165 Cb 1.01 1.11 -0.13 0.00 -1.54 0.00 0.00 39.78 40.23 3d29 n ASN 165 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3d29 s ASP 166 N -2.49 4.64 0.63 6.41 2.15 0.84 -4.97 116.67 123.87 3d29 s ASP 166 Ca 0.03 -0.59 0.38 0.00 0.43 0.00 0.00 52.55 52.80 3d29 s ASP 166 Cb 0.10 -1.78 2.16 0.00 -0.30 0.00 0.00 42.92 43.10 3d29 s ASP 166 CO 0.55 -0.10 2.32 -0.07 -0.17 0.00 0.00 175.17 177.70 3d29 h LEU 167 N 8.14 0.00 -0.19 -1.34 3.38 -1.90 0.17 115.31 123.58 3d29 h LEU 167 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3d29 h LEU 167 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3d29 h LEU 167 CO 0.59 0.00 -0.06 0.61 0.09 0.00 0.00 178.44 179.67 3d29 n GLY 168 N -1.19 -0.97 3.34 0.83 0.00 -1.26 -4.85 105.19 101.10 3d29 n GLY 168 Ca -0.03 -0.24 -0.19 0.00 0.00 0.00 0.00 46.02 45.56 3d29 n GLY 168 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d29 s SER 169 N -2.38 2.62 0.00 1.61 0.01 0.60 -0.83 113.70 115.33 3d29 s SER 169 Ca 0.33 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.62 3d29 s SER 169 Cb 0.20 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.29 3d29 s SER 169 CO 0.44 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.58 3d29 n GLY 170 N -0.18 -1.29 7.00 3.44 0.00 -1.26 -4.63 105.19 108.27 3d29 n GLY 170 Ca -0.09 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.86 3d29 n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d29 n SER 171 N 1.82 0.00 -4.93 1.61 7.64 -1.26 -2.62 113.62 115.87 3d29 n SER 171 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 3d29 n SER 171 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3d29 n SER 171 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3d29 s ASN 172 N -4.00 4.95 -0.16 6.43 0.02 -1.26 -4.27 114.94 116.65 3d29 s ASN 172 Ca 0.00 -0.92 0.02 0.00 -1.02 0.00 0.00 52.86 50.93 3d29 s ASN 172 Cb 0.00 -0.03 0.02 0.00 0.02 0.00 0.00 41.25 41.25 3d29 s ASN 172 CO 0.00 -0.98 -0.21 -0.69 0.02 0.00 0.00 177.10 175.25 3d29 s VAL 173 N -2.61 2.07 0.02 1.60 1.01 -0.54 -2.77 120.40 119.17 3d29 s VAL 173 Ca 0.47 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3d29 s VAL 173 Cb -0.04 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 3d29 s VAL 173 CO 0.28 0.54 0.08 -1.81 0.00 0.00 0.00 175.10 174.19 3d29 s ASP 174 N 1.08 5.60 0.04 3.32 1.01 0.02 -0.57 116.67 127.17 3d29 s ASP 174 Ca -0.00 0.10 -0.02 0.00 0.71 0.00 0.00 52.55 53.33 3d29 s ASP 174 Cb -0.14 -1.57 -0.03 0.00 1.01 0.00 0.00 42.92 42.19 3d29 s ASP 174 CO -0.08 0.25 0.01 -0.69 0.21 0.00 0.00 175.17 174.86 3d29 s VAL 175 N -1.24 0.16 -0.08 -1.27 1.01 -0.87 -1.70 120.40 116.41 3d29 s VAL 175 Ca 0.24 -1.34 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 3d29 s VAL 175 Cb -0.12 -0.97 0.04 0.00 0.00 0.00 0.00 36.38 35.33 3d29 s VAL 175 CO 0.16 -0.74 0.17 0.00 0.00 0.00 0.00 175.10 174.69 3d29 s VAL 177 N 1.37 3.99 -0.31 0.00 1.01 0.17 -2.03 120.40 124.60 3d29 s VAL 177 Ca -0.07 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.62 3d29 s VAL 177 Cb -0.11 -2.77 0.09 0.00 0.00 0.00 0.00 36.38 33.59 3d29 s VAL 177 CO -0.06 0.48 0.02 -0.04 0.00 0.00 0.00 175.10 175.49 3d29 s MET 178 N 0.47 1.54 -0.16 2.72 -1.94 -0.18 -0.28 119.30 121.47 3d29 s MET 178 Ca -0.02 -1.63 -0.06 0.00 -1.71 0.00 0.00 55.69 52.27 3d29 s MET 178 Cb -0.14 -2.98 -0.04 0.00 2.01 0.00 0.00 34.83 33.69 3d29 s MET 178 CO 0.02 -0.85 0.03 -2.00 -0.01 0.00 0.00 175.02 172.21 3d29 s GLU 179 N 1.05 3.75 0.31 2.03 2.12 -1.26 -0.88 118.70 125.82 3d29 s GLU 179 Ca 0.06 -0.39 0.21 0.00 0.36 0.00 0.00 54.97 55.21 3d29 s GLU 179 Cb -0.19 -3.08 1.07 0.00 0.26 0.00 0.00 34.13 32.19 3d29 s GLU 179 CO -0.09 0.34 1.16 -0.89 -0.54 0.00 0.00 175.26 175.24 3d29 n ILE 180 N 3.28 -0.23 0.24 -3.70 5.41 0.02 -1.50 119.36 122.88 3d29 n ILE 180 Ca -0.17 1.39 0.04 0.00 1.00 0.00 0.00 62.75 65.02 3d29 n ILE 180 Cb 0.53 -2.28 0.06 0.00 -0.71 0.00 0.00 39.64 37.24 3d29 n ILE 180 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d29 n GLY 181 N -1.31 0.27 3.30 7.39 0.00 -1.26 -4.93 105.19 108.64 3d29 n GLY 181 Ca 0.29 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3d29 n GLY 181 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d29 n LYS 182 N 0.45 0.88 -2.50 1.61 5.02 -0.56 -5.12 118.16 117.94 3d29 n LYS 182 Ca 0.06 -3.36 -0.34 0.00 -2.02 0.00 0.00 58.31 52.65 3d29 n LYS 182 Cb 0.26 0.91 -0.03 0.00 -0.02 0.00 0.00 35.03 36.15 3d29 n LYS 182 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d29 s ASP 183 N -3.53 6.26 0.33 4.39 -0.00 -1.26 -4.65 116.67 118.20 3d29 s ASP 183 Ca 0.00 1.97 -0.28 0.00 -0.00 0.00 0.00 52.55 54.25 3d29 s ASP 183 Cb 0.00 -2.56 -0.09 0.00 -0.00 0.00 0.00 42.92 40.26 3d29 s ASP 183 CO 0.00 -0.84 1.16 0.00 -0.00 0.00 0.00 175.17 175.49 3d29 s ALA 184 N -1.93 3.35 -0.24 5.23 0.00 -1.26 -4.68 121.76 122.23 3d29 s ALA 184 Ca 0.68 0.98 -0.01 0.00 0.00 0.00 0.00 51.96 53.61 3d29 s ALA 184 Cb -0.18 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.60 3d29 s ALA 184 CO 0.21 -0.35 -0.08 -1.83 0.00 0.00 0.00 175.76 173.70 3d29 s GLU 185 N -1.78 2.85 -0.28 0.00 -1.05 0.61 -4.95 118.70 114.10 3d29 s GLU 185 Ca 0.49 -0.96 -0.19 0.00 -0.15 0.00 0.00 54.97 54.16 3d29 s GLU 185 Cb -0.33 -2.92 -0.02 0.00 -0.44 0.00 0.00 34.13 30.43 3d29 s GLU 185 CO 0.42 -0.37 0.57 -0.47 0.95 0.00 0.00 175.26 176.37 3d29 s TYR 186 N 1.31 3.24 -0.90 4.83 5.04 -1.26 0.43 117.35 130.05 3d29 s TYR 186 Ca 0.01 0.60 -0.03 0.00 -2.44 0.00 0.00 57.07 55.21 3d29 s TYR 186 Cb -0.16 -2.86 0.22 0.00 0.35 0.00 0.00 41.96 39.52 3d29 s TYR 186 CO -0.06 -0.38 0.79 -0.51 -1.34 0.00 0.00 175.55 174.05 3d29 s LEU 187 N 2.46 5.68 0.12 6.97 1.43 0.23 -4.98 118.68 130.59 3d29 s LEU 187 Ca 0.23 -3.58 -0.31 0.00 -1.03 0.00 0.00 54.13 49.44 3d29 s LEU 187 Cb -0.15 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 44.02 3d29 s LEU 187 CO 0.10 -0.23 1.61 -0.60 0.23 0.00 0.00 176.35 177.46 3d29 s ARG 189 N -1.15 4.21 -1.29 1.70 6.06 -1.26 -2.06 118.95 125.15 3d29 s ARG 189 Ca 0.26 2.36 -0.01 0.00 -2.50 0.00 0.00 55.73 55.84 3d29 s ARG 189 Cb -0.09 -3.35 0.01 0.00 0.06 0.00 0.00 34.95 31.57 3d29 s ARG 189 CO -0.11 -0.67 0.82 0.09 -2.50 0.00 0.00 175.30 172.93 3d29 n ASN 190 N 4.70 -1.81 -0.12 -2.12 4.13 -1.25 -4.86 115.26 113.93 3d29 n ASN 190 Ca 0.15 -0.75 0.11 0.00 1.68 0.00 0.00 54.58 55.76 3d29 n ASN 190 Cb 0.39 -4.38 0.46 0.00 -1.54 0.00 0.00 39.78 34.72 3d29 n ASN 190 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 3d29 h TYR 191 N -1.92 0.54 -3.74 3.10 -0.00 -0.61 -3.40 116.97 110.93 3d29 h TYR 191 Ca -0.60 0.01 -0.44 0.00 -0.00 0.00 0.00 58.73 57.70 3d29 h TYR 191 Cb 1.35 -0.18 -0.31 0.00 -0.00 0.00 0.00 36.73 37.60 3d29 h TYR 191 CO 0.47 0.26 -0.79 -0.51 -0.00 0.00 0.00 178.16 177.58 3d29 s LEU 192 N -9.46 1.73 -0.50 2.82 1.43 -0.95 -4.99 118.68 108.76 3d29 s LEU 192 Ca -0.08 -0.20 0.07 0.00 -1.03 0.00 0.00 54.13 52.89 3d29 s LEU 192 Cb 0.20 -0.59 0.25 0.00 0.03 0.00 0.00 46.19 46.07 3d29 s LEU 192 CO 0.76 0.06 0.62 0.35 0.23 0.00 0.00 176.35 178.37 3d29 n THR 193 N 3.41 0.67 1.10 5.49 -2.24 -1.26 -1.47 114.28 119.98 3d29 n THR 193 Ca -0.19 -4.55 0.02 0.00 -2.27 0.00 0.00 64.05 57.05 3d29 n THR 193 Cb 0.54 -2.01 0.07 0.00 -2.10 0.00 0.00 70.33 66.82 3d29 n THR 193 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3d29 n PRO 194 N 1.15 1.54 -2.61 -0.78 -0.04 -1.26 -4.16 135.00 128.83 3d29 n PRO 194 Ca 0.25 -0.56 -0.08 0.00 -0.04 0.00 0.00 63.50 63.07 3d29 n PRO 194 Cb 0.48 -1.37 0.04 0.00 -0.04 0.00 0.00 33.50 32.60 3d29 n PRO 194 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3d29 n ASN 195 N 0.02 2.47 -4.73 3.54 3.02 -1.26 -5.07 115.26 113.25 3d29 n ASN 195 Ca 0.05 -2.60 -0.42 0.00 -0.03 0.00 0.00 54.58 51.58 3d29 n ASN 195 Cb 0.27 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.96 3d29 n ASN 195 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d29 s VAL 196 N -3.98 3.26 0.21 2.41 1.01 -1.26 -4.95 120.40 117.10 3d29 s VAL 196 Ca 0.33 0.96 -0.30 0.00 0.00 0.00 0.00 61.98 62.98 3d29 s VAL 196 Cb 0.37 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.04 3d29 s VAL 196 CO -0.02 0.11 1.32 -0.60 0.00 0.00 0.00 175.10 175.91 3d29 s ARG 197 N 0.54 4.37 0.81 2.72 3.00 -1.26 -4.99 118.95 124.15 3d29 s ARG 197 Ca 0.61 2.09 -0.11 0.00 -1.00 0.00 0.00 55.73 57.32 3d29 s ARG 197 Cb -0.37 -3.18 0.08 0.00 0.00 0.00 0.00 34.95 31.49 3d29 s ARG 197 CO 0.34 -0.26 1.12 -1.83 0.00 0.00 0.00 175.30 174.66 3d29 s GLU 198 N -0.27 1.84 0.28 5.12 -1.05 -1.26 -4.92 118.70 118.45 3d29 s GLU 198 Ca 0.56 1.34 -0.30 0.00 -0.15 0.00 0.00 54.97 56.43 3d29 s GLU 198 Cb -0.37 -1.84 -0.12 0.00 -0.44 0.00 0.00 34.13 31.36 3d29 s GLU 198 CO 0.40 -1.98 1.60 -1.91 0.95 0.00 0.00 175.26 174.31 3d29 n GLU 199 N -3.68 2.67 -1.42 -4.83 2.13 -1.26 -4.94 120.64 109.30 3d29 n GLU 199 Ca 0.10 0.95 -0.33 0.00 0.66 0.00 0.00 57.16 58.54 3d29 n GLU 199 Cb 0.52 -2.73 0.09 0.00 0.27 0.00 0.00 31.44 29.59 3d29 n GLU 199 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3d29 s LYS 200 N -0.36 2.24 0.31 5.31 1.02 -1.26 -4.94 119.74 122.05 3d29 s LYS 200 Ca 0.65 1.52 0.14 0.00 0.02 0.00 0.00 55.97 58.30 3d29 s LYS 200 Cb -0.51 -1.87 0.47 0.00 -0.52 0.00 0.00 37.83 35.40 3d29 s LYS 200 CO 0.47 -1.71 1.65 0.37 -0.92 0.00 0.00 175.35 175.21 3d29 h GLN 201 N -0.52 0.00 -3.80 1.68 5.75 -2.05 -3.46 115.11 112.71 3d29 h GLN 201 Ca -0.46 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 57.95 3d29 h GLN 201 Cb 1.27 0.00 -0.11 0.00 1.07 0.00 0.00 27.48 29.70 3d29 h GLN 201 CO 0.50 0.52 -0.24 0.21 -2.65 0.00 0.00 178.83 177.17 3d29 s LYS 202 N -3.57 1.30 -0.13 1.69 2.20 -1.26 -5.15 119.74 114.81 3d29 s LYS 202 Ca -0.01 -1.19 -0.05 0.00 -0.36 0.00 0.00 55.97 54.37 3d29 s LYS 202 Cb 0.12 0.41 -0.04 0.00 -1.51 0.00 0.00 37.83 36.82 3d29 s LYS 202 CO 0.73 -0.50 0.03 0.45 -0.36 0.00 0.00 175.35 175.70 3d29 s SER 203 N -2.98 5.41 -0.09 1.43 0.15 -1.26 -4.99 113.70 111.36 3d29 s SER 203 Ca 0.19 0.11 0.18 0.00 0.70 0.00 0.00 55.95 57.13 3d29 s SER 203 Cb 0.02 -1.75 0.65 0.00 -1.71 0.00 0.00 66.02 63.22 3d29 s SER 203 CO 0.03 0.28 1.56 -1.22 1.20 0.00 0.00 173.24 175.09 3d29 n TYR 204 N 2.84 1.26 -1.68 3.44 4.01 -1.26 -4.95 117.16 120.82 3d29 n TYR 204 Ca -0.18 -0.61 -0.54 0.00 -0.16 0.00 0.00 57.90 56.42 3d29 n TYR 204 Cb 0.53 -0.20 -0.06 0.00 -0.31 0.00 0.00 39.34 39.30 3d29 n TYR 204 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 3d29 n LYS 205 N 0.97 1.45 -3.31 -0.72 4.81 -1.26 -4.92 118.16 115.19 3d29 n LYS 205 Ca 0.24 0.53 -0.32 0.00 -0.87 0.00 0.00 58.31 57.89 3d29 n LYS 205 Cb 0.81 -2.25 -0.05 0.00 0.02 0.00 0.00 35.03 33.56 3d29 n LYS 205 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3d29 s PHE 206 N 2.85 3.41 0.14 5.64 0.08 -1.26 -5.04 117.98 123.80 3d29 s PHE 206 Ca 0.93 0.97 -0.30 0.00 0.12 0.00 0.00 56.93 58.65 3d29 s PHE 206 Cb -0.94 -2.34 -0.08 0.00 -0.57 0.00 0.00 43.02 39.10 3d29 s PHE 206 CO 0.57 0.20 1.29 -1.25 -0.10 0.00 0.00 175.22 175.92 3d29 s PRO 207 N -2.95 4.40 0.31 0.24 0.04 -1.26 -4.93 135.00 130.85 3d29 s PRO 207 Ca 0.49 1.96 -0.29 0.00 0.04 0.00 0.00 61.00 63.20 3d29 s PRO 207 Cb -0.11 -3.25 -0.13 0.00 0.04 0.00 0.00 34.50 31.05 3d29 s PRO 207 CO 0.21 -0.28 1.32 0.54 0.04 0.00 0.00 177.00 178.83 3d29 n ARG 208 N 3.29 2.07 0.00 4.56 1.74 -1.26 -2.06 116.66 125.00 3d29 n ARG 208 Ca 0.08 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 3d29 n ARG 208 Cb 0.44 -2.33 0.00 0.00 -1.02 0.00 0.00 32.46 29.55 3d29 n ARG 208 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d29 n GLY 209 N 1.27 0.21 0.33 -0.13 0.00 -1.26 -4.96 105.19 100.65 3d29 n GLY 209 Ca 0.07 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.13 3d29 n GLY 209 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3d29 h THR 210 N 0.00 1.10 -3.34 2.61 2.02 -1.79 -3.42 112.91 110.09 3d29 h THR 210 Ca 0.00 -0.25 -0.57 0.00 0.77 0.00 0.00 66.41 66.36 3d29 h THR 210 Cb 0.00 0.32 -0.07 0.00 -1.74 0.00 0.00 68.15 66.65 3d29 h THR 210 CO 0.00 0.13 -0.08 -0.89 0.37 0.00 0.00 175.52 175.05 3d29 s THR 211 N -5.63 5.16 -0.29 3.16 2.01 -1.26 -5.04 115.64 113.74 3d29 s THR 211 Ca -0.09 1.07 -0.29 0.00 0.31 0.00 0.00 61.69 62.69 3d29 s THR 211 Cb 0.18 -3.87 0.01 0.00 0.01 0.00 0.00 72.50 68.84 3d29 s THR 211 CO 0.75 0.31 1.06 0.00 -0.69 0.00 0.00 174.62 176.05 3d29 s ALA 212 N 0.68 3.56 -0.07 7.40 0.00 -1.26 -5.03 121.76 127.03 3d29 s ALA 212 Ca 0.29 0.01 -0.04 0.00 0.00 0.00 0.00 51.96 52.22 3d29 s ALA 212 Cb -0.16 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 3d29 s ALA 212 CO 0.12 -1.34 0.12 0.08 0.00 0.00 0.00 175.76 174.73 3d29 s VAL 213 N 3.50 5.17 -0.19 0.00 1.01 -1.26 -5.03 120.40 123.60 3d29 s VAL 213 Ca 0.45 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.43 3d29 s VAL 213 Cb -0.13 -3.29 -0.21 0.00 0.00 0.00 0.00 36.38 32.74 3d29 s VAL 213 CO 0.12 0.52 0.06 0.18 0.00 0.00 0.00 175.10 175.98 3d29 n LEU 214 N 1.68 2.17 -3.47 3.92 4.77 -1.26 -5.04 117.00 119.76 3d29 n LEU 214 Ca -0.17 0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.71 3d29 n LEU 214 Cb 0.54 -0.61 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 3d29 n LEU 214 CO 0.34 0.79 0.36 -0.75 -1.33 0.00 0.00 177.39 176.80 3d29 s LYS 215 N -2.53 1.21 0.09 3.23 2.20 -1.26 -5.19 119.74 117.48 3d29 s LYS 215 Ca -0.24 -0.42 -0.05 0.00 -0.36 0.00 0.00 55.97 54.89 3d29 s LYS 215 Cb 0.08 0.55 -0.02 0.00 -1.51 0.00 0.00 37.83 36.93 3d29 s LYS 215 CO 0.71 -0.50 0.11 -2.00 -0.36 0.00 0.00 175.35 173.31 3d29 s GLU 216 N -3.41 0.81 -0.13 4.03 2.12 -1.26 -5.17 118.70 115.69 3d29 s GLU 216 Ca -0.00 -1.12 -0.34 0.00 0.36 0.00 0.00 54.97 53.87 3d29 s GLU 216 Cb -0.00 0.29 0.14 0.00 0.26 0.00 0.00 34.13 34.81 3d29 s GLU 216 CO -0.10 -0.23 1.31 -1.54 -0.54 0.00 0.00 175.26 174.16 3d29 s SER 217 N -2.91 -0.06 0.18 -1.70 1.04 -1.26 -5.17 113.70 103.82 3d29 s SER 217 Ca 0.09 -0.05 -0.02 0.00 0.48 0.00 0.00 55.95 56.45 3d29 s SER 217 Cb 0.06 0.10 -0.05 0.00 0.10 0.00 0.00 66.02 66.23 3d29 s SER 217 CO -0.08 -0.18 0.38 -0.63 0.98 0.00 0.00 173.24 173.71 3d29 s ILE 218 N -2.28 5.20 -0.07 -1.02 -1.09 -1.26 -5.10 121.20 115.58 3d29 s ILE 218 Ca 0.12 -0.23 0.02 0.00 -2.23 0.00 0.00 60.65 58.34 3d29 s ILE 218 Cb 0.03 -3.69 -0.02 0.00 -1.58 0.00 0.00 42.46 37.19 3d29 s ILE 218 CO -0.04 -0.09 -0.14 -0.69 -1.23 0.00 0.00 174.94 172.75 3d29 s VAL 219 N -1.78 3.09 -0.24 2.92 1.01 -1.26 -5.09 120.40 119.04 3d29 s VAL 219 Ca 0.39 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 3d29 s VAL 219 Cb -0.11 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 3d29 s VAL 219 CO 0.28 0.57 0.80 0.21 0.00 0.00 0.00 175.10 176.96 3d29 s ASN 220 N -0.43 6.80 -0.17 3.32 2.47 -1.26 -4.90 114.94 120.77 3d29 s ASN 220 Ca 0.05 0.99 0.06 0.00 0.42 0.00 0.00 52.86 54.38 3d29 s ASN 220 Cb -0.12 -2.42 -0.15 0.00 -1.45 0.00 0.00 41.25 37.11 3d29 s ASN 220 CO 0.02 -0.48 -0.08 -0.38 -3.72 0.00 0.00 177.10 172.46 3d29 n ILE 221 N 5.21 1.05 -2.13 -5.21 2.08 -1.26 -4.99 119.36 114.11 3d29 n ILE 221 Ca 0.04 -0.50 -0.41 0.00 0.56 0.00 0.00 62.75 62.45 3d29 n ILE 221 Cb 0.48 -0.94 -0.02 0.00 -0.75 0.00 0.00 39.64 38.41 3d29 n ILE 221 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11