#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 0.71 0.08 12.58 2.01 -1.26 -1.28 115.64 128.47 3d29 s THR 2 Ca 0.00 -0.57 0.08 0.00 0.31 0.00 0.00 61.69 61.51 3d29 s THR 2 Cb 0.00 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 3d29 s THR 2 CO 0.00 -0.09 -0.20 0.27 -0.69 0.00 0.00 174.62 173.90 3d29 s ILE 3 N 1.79 1.64 0.16 1.82 -0.00 -0.93 -1.92 121.20 123.75 3d29 s ILE 3 Ca -0.01 -1.39 -0.01 0.00 -0.00 0.00 0.00 60.65 59.24 3d29 s ILE 3 Cb -0.16 -1.47 -0.04 0.00 -0.00 0.00 0.00 42.46 40.79 3d29 s ILE 3 CO -0.07 0.02 0.10 0.68 -0.00 0.00 0.00 174.94 175.67 3d29 s VAL 4 N -1.03 0.06 -0.01 8.37 -7.23 -0.54 -1.51 120.40 118.51 3d29 s VAL 4 Ca 0.06 -1.92 -0.01 0.00 -1.81 0.00 0.00 61.98 58.30 3d29 s VAL 4 Cb -0.09 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.63 3d29 s VAL 4 CO 0.03 -0.27 0.03 -0.83 -0.31 0.00 0.00 175.10 173.74 3d29 s GLY 5 N -3.09 -0.01 -0.14 2.32 0.00 0.52 -2.08 107.32 104.85 3d29 s GLY 5 Ca 0.29 0.04 -0.06 0.00 0.00 0.00 0.00 44.72 45.00 3d29 s GLY 5 CO 0.06 0.02 0.29 0.14 0.00 0.00 0.00 173.10 173.62 3d29 s VAL 6 N -0.09 -0.33 0.23 1.40 1.01 0.48 -1.48 120.40 121.62 3d29 s VAL 6 Ca -0.01 0.22 -0.17 0.00 0.00 0.00 0.00 61.98 62.02 3d29 s VAL 6 Cb -0.01 -0.48 -0.08 0.00 0.00 0.00 0.00 36.38 35.81 3d29 s VAL 6 CO -0.00 0.09 0.68 -0.54 0.00 0.00 0.00 175.10 175.34 3d29 s LYS 7 N 2.10 4.11 0.33 2.72 -0.14 0.03 -0.54 119.74 128.36 3d29 s LYS 7 Ca -0.02 0.72 0.03 0.00 -1.36 0.00 0.00 55.97 55.33 3d29 s LYS 7 Cb -0.11 -2.76 -0.04 0.00 -1.68 0.00 0.00 37.83 33.23 3d29 s LYS 7 CO -0.10 0.35 0.11 -0.59 -0.76 0.00 0.00 175.35 174.36 3d29 s PHE 8 N -1.64 1.74 0.46 3.18 -0.12 -0.38 -4.70 117.98 116.51 3d29 s PHE 8 Ca 0.45 -1.20 0.33 0.00 -0.05 0.00 0.00 56.93 56.46 3d29 s PHE 8 Cb -0.14 -1.07 1.48 0.00 -0.63 0.00 0.00 43.02 42.65 3d29 s PHE 8 CO 0.20 -0.28 1.62 -2.95 -0.05 0.00 0.00 175.22 173.76 3d29 h ASN 9 N 2.10 0.20 0.00 1.98 7.08 -0.82 -2.63 115.58 123.49 3d29 h ASN 9 Ca -0.37 0.12 -0.02 0.00 -3.08 0.00 0.00 56.30 52.95 3d29 h ASN 9 Cb 1.25 0.11 -0.05 0.00 -2.08 0.00 0.00 38.32 37.55 3d29 h ASN 9 CO 0.60 -0.17 -0.39 -3.20 -2.08 0.00 0.00 177.43 172.19 3d29 n ASN 10 N -4.60 1.23 0.00 6.14 5.15 -1.26 -5.05 115.26 116.86 3d29 n ASN 10 Ca 0.38 -2.66 0.00 0.00 -0.60 0.00 0.00 54.58 51.70 3d29 n ASN 10 Cb 1.52 -0.34 0.00 0.00 -0.53 0.00 0.00 39.78 40.42 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 -0.61 -0.63 3.12 8.20 0.00 -0.99 -0.79 105.19 113.49 3d29 n GLY 11 Ca 0.09 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.43 0.05 0.02 1.61 0.11 -0.10 -1.25 120.40 117.42 3d29 s VAL 12 Ca 0.00 -0.44 0.04 0.00 -2.93 0.00 0.00 61.98 58.64 3d29 s VAL 12 Cb 0.00 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 3d29 s VAL 12 CO 0.00 -0.24 -0.11 0.54 -3.33 0.00 0.00 175.10 171.96 3d29 s VAL 13 N -0.91 0.85 0.12 2.04 0.11 0.30 -1.03 120.40 121.88 3d29 s VAL 13 Ca -0.10 -0.80 0.07 0.00 -2.93 0.00 0.00 61.98 58.22 3d29 s VAL 13 Cb -0.05 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 3d29 s VAL 13 CO 0.02 -0.00 -0.16 0.27 -3.33 0.00 0.00 175.10 171.89 3d29 s ILE 14 N -0.73 1.46 0.16 7.04 -4.36 -0.90 -0.38 121.20 123.50 3d29 s ILE 14 Ca 0.00 -1.69 -0.05 0.00 -0.26 0.00 0.00 60.65 58.65 3d29 s ILE 14 Cb -0.07 -1.55 -0.02 0.00 1.25 0.00 0.00 42.46 42.07 3d29 s ILE 14 CO 0.01 -0.32 0.20 0.00 0.24 0.00 0.00 174.94 175.06 3d29 s ALA 15 N -1.89 0.43 0.06 2.27 0.00 -0.88 -1.68 121.76 120.07 3d29 s ALA 15 Ca 0.09 -1.19 -0.26 0.00 0.00 0.00 0.00 51.96 50.59 3d29 s ALA 15 Cb -0.06 0.95 0.08 0.00 0.00 0.00 0.00 23.12 24.09 3d29 s ALA 15 CO 0.04 -0.60 0.71 0.00 0.00 0.00 0.00 175.76 175.91 3d29 s ALA 16 N -4.02 -1.71 0.80 0.00 0.00 -0.64 -1.47 121.76 114.72 3d29 s ALA 16 Ca 0.23 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 52.99 3d29 s ALA 16 Cb 0.05 0.49 0.12 0.00 0.00 0.00 0.00 23.12 23.77 3d29 s ALA 16 CO 0.03 -0.64 0.75 -0.40 0.00 0.00 0.00 175.76 175.50 3d29 n ASP 17 N -0.01 0.47 -0.34 0.00 5.75 -0.81 -0.77 116.55 120.84 3d29 n ASP 17 Ca -0.15 -1.52 0.06 0.00 -0.01 0.00 0.00 54.79 53.17 3d29 n ASP 17 Cb 0.62 -0.54 0.10 0.00 -1.03 0.00 0.00 41.12 40.27 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 -2.76 1.23 -3.49 2.12 -2.24 -1.07 -4.54 114.28 103.53 3d29 n THR 18 Ca 0.11 -1.60 -0.38 0.00 -2.27 0.00 0.00 64.05 59.91 3d29 n THR 18 Cb 0.38 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.61 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 -1.87 3.97 -0.02 -0.78 3.52 -1.23 -1.48 118.95 121.06 3d29 s ARG 19 Ca 0.23 0.38 0.07 0.00 -0.13 0.00 0.00 55.73 56.28 3d29 s ARG 19 Cb 0.21 -3.25 -0.02 0.00 -1.56 0.00 0.00 34.95 30.33 3d29 s ARG 19 CO -0.00 0.61 -0.23 0.45 -0.81 0.00 0.00 175.30 175.32 3d29 s SER 20 N -0.81 2.71 0.08 -2.12 0.15 -0.26 -4.64 113.70 108.81 3d29 s SER 20 Ca 0.23 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.48 3d29 s SER 20 Cb -0.16 -0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 63.81 3d29 s SER 20 CO 0.12 0.28 -0.07 0.42 1.20 0.00 0.00 173.24 175.20 3d29 s THR 21 N -0.54 0.65 -0.31 6.45 -4.23 -1.26 0.16 115.64 116.57 3d29 s THR 21 Ca 0.09 -1.73 -0.02 0.00 -1.18 0.00 0.00 61.69 58.85 3d29 s THR 21 Cb -0.09 -1.42 0.10 0.00 1.34 0.00 0.00 72.50 72.44 3d29 s THR 21 CO -0.01 -0.75 0.13 -1.10 -0.54 0.00 0.00 174.62 172.35 3d29 s GLN 22 N -3.28 0.49 7.18 3.99 -0.21 -0.49 -4.79 119.66 122.55 3d29 s GLN 22 Ca 0.06 -0.90 0.00 0.00 0.02 0.00 0.00 55.36 54.55 3d29 s GLN 22 Cb 0.02 -1.58 0.00 0.00 1.00 0.00 0.00 33.01 32.45 3d29 s GLN 22 CO -0.04 -1.03 0.00 0.41 -2.12 0.00 0.00 175.29 172.52 3d29 n GLY 23 N 4.90 2.28 0.85 3.09 0.00 -1.26 -2.19 105.19 112.86 3d29 n GLY 23 Ca -0.02 -0.34 0.10 0.00 0.00 0.00 0.00 46.02 45.76 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 13.20 2.10 -3.90 1.61 -0.04 -1.26 -4.90 135.00 141.80 3d29 n PRO 24 Ca 0.00 -1.67 -0.36 0.00 -0.04 0.00 0.00 63.50 61.44 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 -1.57 5.20 -0.23 0.52 1.09 -0.93 -5.05 121.20 120.24 3d29 s ILE 25 Ca 0.35 0.11 -0.29 0.00 -1.10 0.00 0.00 60.65 59.71 3d29 s ILE 25 Cb 0.19 -3.32 -0.01 0.00 -1.06 0.00 0.00 42.46 38.26 3d29 s ILE 25 CO 0.27 0.52 1.34 -0.69 -0.10 0.00 0.00 174.94 176.27 3d29 s VAL 26 N -0.20 4.12 0.02 2.92 1.01 -1.26 -1.40 120.40 125.62 3d29 s VAL 26 Ca 0.10 1.31 -0.17 0.00 0.00 0.00 0.00 61.98 63.22 3d29 s VAL 26 Cb -0.12 -4.01 -0.33 0.00 0.00 0.00 0.00 36.38 31.92 3d29 s VAL 26 CO 0.01 -0.30 1.01 0.00 0.00 0.00 0.00 175.10 175.82 3d29 h ALA 27 N 9.03 -0.11 -3.15 5.51 0.00 -0.59 -3.45 119.26 126.49 3d29 h ALA 27 Ca -0.28 -0.81 -0.27 0.00 0.00 0.00 0.00 54.91 53.55 3d29 h ALA 27 Cb 1.11 0.15 -0.34 0.00 0.00 0.00 0.00 17.79 18.71 3d29 h ALA 27 CO 1.00 0.64 -0.62 0.34 0.00 0.00 0.00 179.25 180.61 3d29 s ASP 28 N -7.45 0.41 0.00 0.00 3.68 -1.18 -4.99 116.67 107.14 3d29 s ASP 28 Ca -0.10 0.32 0.28 0.00 2.13 0.00 0.00 52.55 55.18 3d29 s ASP 28 Cb 0.04 0.25 1.04 0.00 -1.45 0.00 0.00 42.92 42.79 3d29 s ASP 28 CO 0.93 -0.21 1.77 0.29 0.13 0.00 0.00 175.17 178.08 3d29 n LYS 29 N 4.89 0.23 -2.93 4.34 5.02 -1.26 -1.10 118.16 127.35 3d29 n LYS 29 Ca -0.13 -0.07 -0.13 0.00 -2.02 0.00 0.00 58.31 55.95 3d29 n LYS 29 Cb 0.51 -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 -1.32 -1.02 -4.93 4.39 4.05 -1.07 -4.50 115.26 110.86 3d29 n ASN 30 Ca 0.09 -3.38 -0.25 0.00 0.45 0.00 0.00 54.58 51.50 3d29 n ASN 30 Cb 0.32 0.82 0.03 0.00 1.23 0.00 0.00 39.78 42.18 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 -2.84 3.25 -2.29 0.00 0.00 -1.26 -4.55 121.76 114.06 3d29 s ALA 32 Ca 0.53 -1.50 0.20 0.00 0.00 0.00 0.00 51.96 51.19 3d29 s ALA 32 Cb -0.10 -2.42 0.61 0.00 0.00 0.00 0.00 23.12 21.21 3d29 s ALA 32 CO 0.42 -1.06 1.48 1.63 0.00 0.00 0.00 175.76 178.23 3d29 n LYS 33 N 4.97 1.96 -3.67 0.00 5.02 -1.26 -4.81 118.16 120.37 3d29 n LYS 33 Ca -0.13 -1.45 -0.38 0.00 -2.02 0.00 0.00 58.31 54.33 3d29 n LYS 33 Cb 0.48 -1.42 -0.12 0.00 -0.02 0.00 0.00 35.03 33.96 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 -1.47 3.80 0.04 -0.35 1.02 -1.26 -1.13 118.68 119.33 3d29 s LEU 34 Ca 0.33 -0.22 0.07 0.00 0.02 0.00 0.00 54.13 54.33 3d29 s LEU 34 Cb 0.18 -2.01 -0.03 0.00 0.02 0.00 0.00 46.19 44.35 3d29 s LEU 34 CO 0.27 -0.08 -0.20 -1.00 0.02 0.00 0.00 176.35 175.36 3d29 s HIS 35 N 1.66 2.52 -0.30 0.29 3.76 0.16 -4.95 115.29 118.44 3d29 s HIS 35 Ca 0.06 -0.28 -0.15 0.00 -0.15 0.00 0.00 55.06 54.54 3d29 s HIS 35 Cb -0.16 -1.46 -0.03 0.00 1.11 0.00 0.00 32.58 32.05 3d29 s HIS 35 CO 0.07 0.22 0.35 0.50 -0.85 0.00 0.00 174.74 175.03 3d29 s ARG 36 N -1.37 3.86 -0.02 1.40 3.52 -1.26 0.50 118.95 125.58 3d29 s ARG 36 Ca 0.14 -0.15 0.06 0.00 -0.13 0.00 0.00 55.73 55.65 3d29 s ARG 36 Cb -0.10 -3.71 -0.24 0.00 -1.56 0.00 0.00 34.95 29.34 3d29 s ARG 36 CO 0.04 -0.35 0.76 0.82 -0.81 0.00 0.00 175.30 175.76 3d29 h ILE 37 N 5.44 1.02 -3.19 4.11 2.04 -1.11 -3.47 117.51 122.35 3d29 h ILE 37 Ca -0.31 -2.79 0.02 0.00 1.00 0.00 0.00 64.86 62.77 3d29 h ILE 37 Cb 1.16 2.56 -0.08 0.00 -0.74 0.00 0.00 36.82 39.72 3d29 h ILE 37 CO 0.65 0.68 0.12 -0.94 0.00 0.00 0.00 178.15 178.66 3d29 s SER 38 N -6.48 -0.26 0.35 1.72 1.04 -1.04 -4.50 113.70 104.52 3d29 s SER 38 Ca -0.07 -0.57 0.16 0.00 0.48 0.00 0.00 55.95 55.95 3d29 s SER 38 Cb 0.08 0.66 1.14 0.00 0.10 0.00 0.00 66.02 67.99 3d29 s SER 38 CO 0.82 -1.20 1.65 -0.65 0.98 0.00 0.00 173.24 174.84 3d29 h PRO 39 N 2.09 0.25 0.00 4.02 0.11 -2.01 -2.26 132.00 134.20 3d29 h PRO 39 Ca -0.24 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.85 3d29 h PRO 39 Cb 1.26 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3d29 h PRO 39 CO 0.30 0.17 -0.20 1.63 -0.21 0.00 0.00 178.00 179.69 3d29 n LYS 40 N -5.09 1.34 -3.87 1.05 5.02 -1.26 -4.50 118.16 110.85 3d29 n LYS 40 Ca 0.33 -2.80 -0.30 0.00 -2.02 0.00 0.00 58.31 53.53 3d29 n LYS 40 Cb 1.04 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 34.39 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 -2.90 1.27 0.18 -0.18 -1.09 -0.85 -2.06 121.20 115.56 3d29 s ILE 41 Ca 0.33 -1.17 0.09 0.00 -2.23 0.00 0.00 60.65 57.67 3d29 s ILE 41 Cb 0.31 -1.67 -0.04 0.00 -1.58 0.00 0.00 42.46 39.48 3d29 s ILE 41 CO -0.01 -0.24 -0.09 0.26 -1.23 0.00 0.00 174.94 173.63 3d29 s TRP 42 N 1.50 2.64 -0.04 3.97 0.52 -0.42 -0.48 118.94 126.63 3d29 s TRP 42 Ca -0.02 -0.22 0.02 0.00 0.02 0.00 0.00 56.10 55.91 3d29 s TRP 42 Cb -0.18 -1.29 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 3d29 s TRP 42 CO -0.09 0.51 -0.08 0.00 0.02 0.00 0.00 176.95 177.31 3d29 s ALA 44 N 0.61 3.50 -0.06 0.00 0.00 -0.10 0.40 121.76 126.12 3d29 s ALA 44 Ca -0.10 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 50.92 3d29 s ALA 44 Cb -0.13 -2.31 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 3d29 s ALA 44 CO 0.01 -0.33 -0.15 0.20 0.00 0.00 0.00 175.76 175.50 3d29 s GLY 45 N 1.32 1.52 0.21 0.00 0.00 -0.28 -1.15 107.32 108.94 3d29 s GLY 45 Ca 0.07 -0.98 0.04 0.00 0.00 0.00 0.00 44.72 43.85 3d29 s GLY 45 CO 0.06 -0.71 -0.04 0.00 0.00 0.00 0.00 173.10 172.41 3d29 s ALA 46 N -0.60 1.74 0.00 3.20 0.00 0.38 -4.87 121.76 121.61 3d29 s ALA 46 Ca 0.09 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.36 3d29 s ALA 46 Cb -0.11 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.31 3d29 s ALA 46 CO 0.01 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.01 3d29 n GLY 47 N -0.36 0.87 3.58 0.00 0.00 -1.26 -1.65 105.19 106.37 3d29 n GLY 47 Ca -0.07 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 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 3.88 0.06 2.61 2.01 0.27 -4.93 115.64 119.54 3d29 s THR 48 Ca 0.00 0.78 -0.11 0.00 0.31 0.00 0.00 61.69 62.67 3d29 s THR 48 Cb 0.00 -4.53 -0.03 0.00 0.01 0.00 0.00 72.50 67.96 3d29 s THR 48 CO 0.00 -1.20 0.88 0.00 -0.69 0.00 0.00 174.62 173.62 3d29 n ALA 49 N 9.08 -0.23 -0.13 7.40 0.00 -1.26 -0.41 120.51 134.97 3d29 n ALA 49 Ca 0.11 0.30 0.12 0.00 0.00 0.00 0.00 53.44 53.98 3d29 n ALA 49 Cb 0.49 0.12 0.47 0.00 0.00 0.00 0.00 19.45 20.53 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 -0.15 1.98 -0.23 0.00 0.00 -1.97 -1.59 119.26 117.30 3d29 h ALA 50 Ca 0.06 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3d29 h ALA 50 Cb 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3d29 h ALA 50 CO -0.34 -0.13 -0.13 -0.44 0.00 0.00 0.00 179.25 178.21 3d29 h ASP 51 N 0.48 0.51 -0.62 0.00 3.45 -1.07 -0.21 116.42 118.96 3d29 h ASP 51 Ca 0.31 -0.42 -0.03 0.00 0.43 0.00 0.00 57.03 57.32 3d29 h ASP 51 Cb 0.58 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 39.18 3d29 h ASP 51 CO -0.10 0.82 0.27 0.71 -1.57 0.00 0.00 179.24 179.37 3d29 h THR 52 N 0.20 1.23 0.38 0.35 1.35 -0.69 -1.79 112.91 113.94 3d29 h THR 52 Ca 0.05 -0.68 -0.02 0.00 -0.55 0.00 0.00 66.41 65.21 3d29 h THR 52 Cb 0.64 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 3d29 h THR 52 CO 0.04 0.27 -0.18 -0.08 -0.25 0.00 0.00 175.52 175.32 3d29 h GLU 53 N 0.86 -0.50 -0.21 4.72 4.57 -1.24 -1.35 114.58 121.44 3d29 h GLU 53 Ca 0.21 0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.44 3d29 h GLU 53 Cb 0.17 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 3d29 h GLU 53 CO -0.02 -0.28 0.11 0.00 -1.18 0.00 0.00 179.01 177.64 3d29 h ALA 54 N -0.01 0.26 -0.21 2.92 0.00 -0.99 -0.26 119.26 120.97 3d29 h ALA 54 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3d29 h ALA 54 Cb 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3d29 h ALA 54 CO 0.09 -0.30 -0.24 -0.24 0.00 0.00 0.00 179.25 178.55 3d29 h VAL 55 N 0.23 1.26 -0.48 0.00 3.04 -1.37 -0.72 116.25 118.21 3d29 h VAL 55 Ca 0.09 -1.20 -0.12 0.00 -1.01 0.00 0.00 66.70 64.46 3d29 h VAL 55 Cb 0.02 1.36 -0.02 0.00 -2.01 0.00 0.00 31.29 30.64 3d29 h VAL 55 CO -0.06 0.38 -0.16 0.74 -1.01 0.00 0.00 177.57 177.46 3d29 h THR 56 N 0.35 1.27 -0.12 3.17 2.02 -0.79 -2.02 112.91 116.80 3d29 h THR 56 Ca 0.05 -1.30 -0.16 0.00 0.77 0.00 0.00 66.41 65.78 3d29 h THR 56 Cb 0.62 1.07 0.01 0.00 -1.74 0.00 0.00 68.15 68.11 3d29 h THR 56 CO 0.04 0.45 -0.56 1.56 0.37 0.00 0.00 175.52 177.38 3d29 h GLN 57 N 0.82 0.59 0.19 6.66 4.20 -0.76 -1.75 115.11 125.05 3d29 h GLN 57 Ca 0.12 -0.48 0.01 0.00 0.06 0.00 0.00 58.65 58.36 3d29 h GLN 57 Cb 0.70 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 3d29 h GLN 57 CO 0.05 1.10 -0.21 1.25 -0.67 0.00 0.00 178.83 180.35 3d29 h LEU 58 N 0.23 -0.58 -0.82 1.46 5.85 -1.06 0.22 115.31 120.60 3d29 h LEU 58 Ca -0.04 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 3d29 h LEU 58 Cb 1.20 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.42 3d29 h LEU 58 CO 0.12 -0.31 -0.10 0.40 -0.34 0.00 0.00 178.44 178.21 3d29 h ILE 59 N -0.45 1.26 -0.56 4.05 5.03 -1.46 -1.26 117.51 124.12 3d29 h ILE 59 Ca 0.01 -1.15 0.01 0.00 -0.12 0.00 0.00 64.86 63.60 3d29 h ILE 59 Cb 0.43 1.03 -0.03 0.00 -3.03 0.00 0.00 36.82 35.22 3d29 h ILE 59 CO -0.07 0.40 0.37 1.23 -0.68 0.00 0.00 178.15 179.39 3d29 h GLY 60 N 0.97 0.79 0.94 5.37 0.00 -0.92 0.19 103.07 110.42 3d29 h GLY 60 Ca 0.12 -0.29 0.01 0.00 0.00 0.00 0.00 47.33 47.18 3d29 h GLY 60 CO 0.04 0.27 0.19 0.23 0.00 0.00 0.00 176.54 177.27 3d29 h SER 61 N 0.74 0.31 0.33 0.19 0.87 -0.24 -1.30 113.55 114.45 3d29 h SER 61 Ca 0.21 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 3d29 h SER 61 Cb -0.06 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3d29 h SER 61 CO -0.06 0.22 -0.34 0.78 -0.53 0.00 0.00 176.83 176.90 3d29 h ASN 62 N 0.38 0.03 -0.41 6.23 2.35 -0.63 -1.80 115.58 121.73 3d29 h ASN 62 Ca 0.12 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.77 3d29 h ASN 62 Cb -0.01 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 3d29 h ASN 62 CO -0.05 0.37 -0.11 0.40 -1.65 0.00 0.00 177.43 176.39 3d29 h ILE 63 N 0.03 1.28 -0.03 2.81 1.08 -0.18 -0.36 117.51 122.13 3d29 h ILE 63 Ca 0.00 -1.20 -0.00 0.00 -0.39 0.00 0.00 64.86 63.27 3d29 h ILE 63 Cb 0.62 1.21 -0.00 0.00 -3.07 0.00 0.00 36.82 35.58 3d29 h ILE 63 CO 0.05 0.40 0.02 -0.08 -0.69 0.00 0.00 178.15 177.85 3d29 h GLU 64 N 0.61 0.04 -0.75 2.37 4.81 -0.83 0.21 114.58 121.04 3d29 h GLU 64 Ca 0.10 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 3d29 h GLU 64 Cb 0.64 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.96 3d29 h GLU 64 CO 0.04 0.06 0.48 -0.07 -0.73 0.00 0.00 179.01 178.79 3d29 h LEU 65 N 0.02 0.80 -0.50 1.64 3.38 -1.23 -1.05 115.31 118.37 3d29 h LEU 65 Ca 0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3d29 h LEU 65 Cb 0.03 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3d29 h LEU 65 CO -0.00 0.56 0.19 -0.74 0.09 0.00 0.00 178.44 178.54 3d29 h HIS 66 N 0.95 0.77 -0.28 1.13 2.76 -0.67 -0.89 115.15 118.91 3d29 h HIS 66 Ca 0.29 -0.06 0.02 0.00 -2.20 0.00 0.00 60.37 58.43 3d29 h HIS 66 Cb -0.02 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 28.69 3d29 h HIS 66 CO -0.03 0.64 0.12 1.03 -1.30 0.00 0.00 177.93 178.40 3d29 h SER 67 N 0.67 0.17 -0.78 3.26 0.87 -0.12 0.51 113.55 118.12 3d29 h SER 67 Ca 0.17 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 3d29 h SER 67 Cb 0.21 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 3d29 h SER 67 CO -0.01 0.13 0.34 -0.07 -0.53 0.00 0.00 176.83 176.69 3d29 h LEU 68 N 0.27 1.06 -0.66 2.23 4.07 -1.00 0.16 115.31 121.44 3d29 h LEU 68 Ca 0.12 -0.15 -0.13 0.00 0.08 0.00 0.00 57.88 57.80 3d29 h LEU 68 Cb 0.06 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.51 3d29 h LEU 68 CO -0.10 0.92 -0.40 0.22 -1.08 0.00 0.00 178.44 178.01 3d29 h TYR 69 N 1.13 0.70 -0.00 1.13 5.03 -0.60 -3.23 116.97 121.14 3d29 h TYR 69 Ca 0.27 -0.20 0.00 0.00 2.58 0.00 0.00 58.73 61.37 3d29 h TYR 69 Cb 0.17 -0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.30 3d29 h TYR 69 CO 0.02 0.90 -0.70 0.25 -1.32 0.00 0.00 178.16 177.30 3d29 n THR 70 N -4.03 0.00 -2.84 1.81 -2.24 0.12 -4.96 114.28 102.13 3d29 n THR 70 Ca -0.02 -0.07 -0.22 0.00 -2.27 0.00 0.00 64.05 61.48 3d29 n THR 70 Cb 0.51 0.82 0.02 0.00 -2.10 0.00 0.00 70.33 69.58 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 -1.11 -5.77 -4.29 3.42 7.64 0.56 -4.98 113.62 109.10 3d29 n SER 71 Ca 0.06 -0.19 -0.18 0.00 1.01 0.00 0.00 58.87 59.57 3d29 n SER 71 Cb 0.36 -4.72 -0.11 0.00 -1.01 0.00 0.00 64.21 58.74 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 -5.51 1.16 0.28 1.43 0.52 -1.13 -5.06 118.95 110.63 3d29 s ARG 72 Ca 0.21 -1.41 -0.29 0.00 -0.52 0.00 0.00 55.73 53.71 3d29 s ARG 72 Cb -0.10 -0.96 -0.10 0.00 0.52 0.00 0.00 34.95 34.31 3d29 s ARG 72 CO 0.26 0.17 1.19 -1.21 0.02 0.00 0.00 175.30 175.73 3d29 s GLU 73 N -3.21 4.51 0.60 3.54 0.41 -1.26 -4.59 118.70 118.70 3d29 s GLU 73 Ca 0.16 1.97 -0.19 0.00 -0.41 0.00 0.00 54.97 56.50 3d29 s GLU 73 Cb -0.02 -3.15 -0.03 0.00 -1.78 0.00 0.00 34.13 29.15 3d29 s GLU 73 CO 0.04 0.02 1.26 -2.14 -0.49 0.00 0.00 175.26 173.94 3d29 s PRO 74 N -1.36 2.85 0.03 0.39 0.02 -1.26 -4.83 135.00 130.83 3d29 s PRO 74 Ca 0.48 1.97 0.03 0.00 0.02 0.00 0.00 61.00 63.49 3d29 s PRO 74 Cb -0.35 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.19 3d29 s PRO 74 CO 0.45 -1.34 -0.04 1.03 -0.33 0.00 0.00 177.00 176.77 3d29 s ARG 75 N -3.28 2.58 0.33 5.54 0.52 -1.26 -4.73 118.95 118.65 3d29 s ARG 75 Ca 0.78 -0.74 0.02 0.00 -0.52 0.00 0.00 55.73 55.28 3d29 s ARG 75 Cb -0.34 -2.54 0.59 0.00 0.52 0.00 0.00 34.95 33.18 3d29 s ARG 75 CO 0.37 0.59 1.95 0.28 0.02 0.00 0.00 175.30 178.52 3d29 h VAL 76 N 3.49 1.10 -0.40 3.52 2.07 -1.91 -1.56 116.25 122.56 3d29 h VAL 76 Ca -0.48 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 3d29 h VAL 76 Cb 1.17 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 3d29 h VAL 76 CO 0.56 0.17 0.22 -0.37 0.02 0.00 0.00 177.57 178.16 3d29 h VAL 77 N 0.94 1.13 -0.54 2.57 -1.51 -1.98 -1.32 116.25 115.54 3d29 h VAL 77 Ca 0.32 -0.33 -0.04 0.00 -1.23 0.00 0.00 66.70 65.42 3d29 h VAL 77 Cb 0.09 0.59 -0.02 0.00 -2.13 0.00 0.00 31.29 29.82 3d29 h VAL 77 CO -0.10 0.14 0.16 0.28 -1.23 0.00 0.00 177.57 176.82 3d29 h SER 78 N 0.55 0.78 -0.65 4.19 0.02 -1.70 -0.33 113.55 116.42 3d29 h SER 78 Ca 0.14 -0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 3d29 h SER 78 Cb 0.02 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 3d29 h SER 78 CO -0.02 0.79 0.20 0.00 -1.14 0.00 0.00 176.83 176.65 3d29 h ALA 79 N 1.03 0.85 -0.63 3.77 0.00 -1.35 -1.22 119.26 121.71 3d29 h ALA 79 Ca 0.17 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3d29 h ALA 79 Cb 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3d29 h ALA 79 CO -0.00 0.53 0.38 1.25 0.00 0.00 0.00 179.25 181.41 3d29 h LEU 80 N 0.95 0.75 -0.16 0.00 5.85 -0.87 -0.76 115.31 121.07 3d29 h LEU 80 Ca 0.21 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.72 3d29 h LEU 80 Cb 0.30 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.15 3d29 h LEU 80 CO -0.01 0.59 -0.50 -0.61 -0.34 0.00 0.00 178.44 177.57 3d29 h GLN 81 N 0.85 0.62 -0.60 1.25 5.75 -0.90 -1.68 115.11 120.39 3d29 h GLN 81 Ca 0.23 -0.45 -0.05 0.00 -0.15 0.00 0.00 58.65 58.22 3d29 h GLN 81 Cb -0.03 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 3d29 h GLN 81 CO -0.04 1.07 0.18 0.52 -2.65 0.00 0.00 178.83 177.90 3d29 h MET 82 N 0.28 0.95 0.46 1.69 2.86 -1.14 -1.77 114.93 118.26 3d29 h MET 82 Ca -0.02 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 3d29 h MET 82 Cb 1.12 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.65 3d29 h MET 82 CO 0.11 0.85 -0.22 -0.07 1.06 0.00 0.00 176.91 178.64 3d29 h LEU 83 N 0.87 -0.52 -0.66 1.22 3.38 -1.16 -2.61 115.31 115.82 3d29 h LEU 83 Ca 0.19 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3d29 h LEU 83 Cb 0.31 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 3d29 h LEU 83 CO -0.00 -0.19 0.36 0.07 0.09 0.00 0.00 178.44 178.77 3d29 h LYS 84 N -0.87 0.64 -0.10 1.13 2.10 -1.30 0.83 116.57 119.01 3d29 h LYS 84 Ca -0.06 -0.04 -0.06 0.00 -2.00 0.00 0.00 60.65 58.49 3d29 h LYS 84 Cb 0.57 -0.15 -0.01 0.00 -0.90 0.00 0.00 32.23 31.75 3d29 h LYS 84 CO 0.10 0.43 -0.19 1.96 -2.00 0.00 0.00 179.45 179.75 3d29 h GLN 85 N 0.66 0.16 0.20 0.07 4.20 -1.37 0.13 115.11 119.16 3d29 h GLN 85 Ca 0.30 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.96 3d29 h GLN 85 Cb 0.21 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.97 3d29 h GLN 85 CO -0.19 0.35 -0.10 1.25 -0.67 0.00 0.00 178.83 179.47 3d29 h HIS 86 N 0.15 -0.25 -0.76 2.96 2.76 -0.88 -1.75 115.15 117.38 3d29 h HIS 86 Ca 0.03 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.26 3d29 h HIS 86 Cb 0.43 0.08 -0.05 0.00 1.55 0.00 0.00 27.41 29.43 3d29 h HIS 86 CO 0.00 0.15 0.50 -0.07 -1.30 0.00 0.00 177.93 177.21 3d29 h LEU 87 N -0.79 0.70 -0.38 0.26 3.38 -0.66 -1.94 115.31 115.88 3d29 h LEU 87 Ca -0.03 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 3d29 h LEU 87 Cb 0.51 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3d29 h LEU 87 CO 0.05 0.45 -0.41 0.15 0.09 0.00 0.00 178.44 178.76 3d29 h PHE 88 N 0.79 1.12 -0.36 1.13 3.57 -0.74 -2.60 116.94 119.87 3d29 h PHE 88 Ca 0.33 -0.35 0.10 0.00 3.53 0.00 0.00 57.97 61.59 3d29 h PHE 88 Cb 0.28 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 3d29 h PHE 88 CO -0.00 1.18 0.29 -0.22 -2.23 0.00 0.00 178.31 177.33 3d29 h LYS 89 N 0.75 0.00 -0.65 1.11 3.64 -0.53 -0.83 116.57 120.07 3d29 h LYS 89 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3d29 h LYS 89 Cb 1.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3d29 h LYS 89 CO 0.10 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.94 3d29 n TYR 90 N -4.19 1.47 -4.33 1.91 4.01 -0.99 -4.96 117.16 110.10 3d29 n TYR 90 Ca 0.06 -0.57 -0.38 0.00 -0.16 0.00 0.00 57.90 56.84 3d29 n TYR 90 Cb 0.46 -0.26 -0.06 0.00 -0.31 0.00 0.00 39.34 39.16 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 -1.30 -0.98 -0.72 6.02 -0.32 0.27 117.38 121.36 3d29 n GLN 91 Ca 0.24 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 3d29 n GLN 91 Cb 0.88 -4.77 0.00 0.00 1.02 0.00 0.00 30.24 27.37 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 -1.07 0.65 0.25 1.08 0.00 -1.22 -4.90 105.19 99.97 3d29 n GLY 93 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.72 1.61 3.86 -0.47 -3.37 115.15 114.06 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 0.06 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 28.36 3d29 h HIS 94 CO 0.04 0.10 0.44 0.42 0.86 0.00 0.00 177.93 179.79 3d29 s ILE 95 N -3.62 4.58 -0.15 2.45 1.01 -1.26 -4.93 121.20 119.29 3d29 s ILE 95 Ca 0.01 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 3d29 s ILE 95 Cb 0.09 -4.63 -0.02 0.00 0.01 0.00 0.00 42.46 37.90 3d29 s ILE 95 CO 0.59 -1.35 1.16 0.61 0.00 0.00 0.00 174.94 175.96 3d29 n GLY 96 N 5.31 1.75 3.59 6.18 0.00 -1.26 -4.74 105.19 116.01 3d29 n GLY 96 Ca -0.01 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 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 3.83 3.11 -0.10 4.61 0.00 -1.26 -0.57 121.76 131.38 3d29 s ALA 97 Ca 0.10 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 3d29 s ALA 97 Cb 0.04 -1.46 0.03 0.00 0.00 0.00 0.00 23.12 21.72 3d29 s ALA 97 CO -0.01 0.43 -0.04 0.71 0.00 0.00 0.00 175.76 176.85 3d29 s TYR 98 N -0.35 1.15 0.08 0.00 2.02 -0.66 -1.29 117.35 118.31 3d29 s TYR 98 Ca 0.06 -0.52 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 3d29 s TYR 98 Cb -0.12 -1.06 -0.04 0.00 -0.40 0.00 0.00 41.96 40.34 3d29 s TYR 98 CO 0.02 -0.44 -0.08 -0.51 -1.57 0.00 0.00 175.55 172.97 3d29 s LEU 99 N 1.82 2.42 -0.23 -1.29 1.43 0.15 -0.47 118.68 122.50 3d29 s LEU 99 Ca 0.05 -0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 52.30 3d29 s LEU 99 Cb -0.13 -0.16 0.02 0.00 0.03 0.00 0.00 46.19 45.96 3d29 s LEU 99 CO -0.07 -0.34 -0.09 -0.63 0.23 0.00 0.00 176.35 175.44 3d29 s ILE 100 N -2.74 2.70 -0.14 -0.59 1.01 -0.30 0.92 121.20 122.07 3d29 s ILE 100 Ca 0.05 -1.01 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 3d29 s ILE 100 Cb -0.01 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.11 3d29 s ILE 100 CO -0.02 0.27 -0.10 0.54 0.00 0.00 0.00 174.94 175.62 3d29 s VAL 101 N 1.31 3.26 0.21 2.92 0.11 -0.46 -0.93 120.40 126.84 3d29 s VAL 101 Ca 0.01 -0.58 -0.00 0.00 -2.93 0.00 0.00 61.98 58.47 3d29 s VAL 101 Cb -0.16 -2.39 -0.04 0.00 -1.53 0.00 0.00 36.38 32.26 3d29 s VAL 101 CO -0.06 0.51 0.11 0.00 -3.33 0.00 0.00 175.10 172.33 3d29 s ALA 102 N 0.41 1.36 0.00 1.54 0.00 -0.47 -1.04 121.76 123.56 3d29 s ALA 102 Ca -0.08 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.13 3d29 s ALA 102 Cb -0.15 1.19 0.00 0.00 0.00 0.00 0.00 23.12 24.16 3d29 s ALA 102 CO 0.05 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 175.69 3d29 n GLY 103 N -0.33 0.83 3.24 0.00 0.00 -0.97 -1.30 105.19 106.66 3d29 n GLY 103 Ca 0.00 -1.22 -0.27 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.99 1.70 0.28 1.61 -7.23 -0.87 -0.48 120.40 113.42 3d29 s VAL 104 Ca 0.00 -0.97 -0.02 0.00 -1.81 0.00 0.00 61.98 59.19 3d29 s VAL 104 Cb 0.00 -1.42 0.01 0.00 0.56 0.00 0.00 36.38 35.52 3d29 s VAL 104 CO 0.00 0.44 0.39 -0.90 -0.31 0.00 0.00 175.10 174.72 3d29 n ASP 105 N 2.43 -1.09 0.26 4.85 3.85 -0.03 -4.75 116.55 122.07 3d29 n ASP 105 Ca -0.16 -2.50 0.11 0.00 -0.71 0.00 0.00 54.79 51.53 3d29 n ASP 105 Cb 0.53 2.03 0.57 0.00 -1.35 0.00 0.00 41.12 42.90 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 -0.04 132.00 130.28 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 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3d29 h PRO 10 CO 0.29 0.00 -0.21 0.25 -0.21 0.00 0.00 178.00 178.12 3d29 n THR 106 N -2.49 0.00 0.00 -1.15 -2.24 -1.26 -5.08 114.28 102.06 3d29 n THR 106 Ca -0.01 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 3d29 n THR 106 Cb 0.38 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 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 0.63 3.78 3.38 0.00 -0.03 -5.06 105.19 109.25 3d29 n GLY 107 Ca 0.12 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 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 5.65 0.01 1.61 1.04 -1.26 -0.85 113.70 115.90 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 -1.61 -0.01 0.00 0.10 0.00 0.00 66.02 64.50 3d29 s SER 108 CO 0.00 0.26 -0.03 -1.00 0.98 0.00 0.00 173.24 173.45 3d29 s HIS 109 N -1.22 0.24 -0.16 5.02 3.76 0.37 -5.00 115.29 118.30 3d29 s HIS 109 Ca 0.24 -0.23 -0.02 0.00 -0.15 0.00 0.00 55.06 54.89 3d29 s HIS 109 Cb -0.12 -0.16 0.05 0.00 1.11 0.00 0.00 32.58 33.46 3d29 s HIS 109 CO 0.15 -0.07 0.02 -1.17 -0.85 0.00 0.00 174.74 172.82 3d29 s LEU 110 N -0.65 1.13 0.30 0.89 2.96 -1.26 -2.30 118.68 119.75 3d29 s LEU 110 Ca -0.06 -0.65 0.02 0.00 -0.22 0.00 0.00 54.13 53.23 3d29 s LEU 110 Cb -0.05 -0.61 -0.05 0.00 0.50 0.00 0.00 46.19 45.98 3d29 s LEU 110 CO -0.00 -0.26 0.10 -0.36 -1.32 0.00 0.00 176.35 174.50 3d29 s PHE 111 N 1.85 1.70 0.01 5.38 0.08 -0.21 -2.79 117.98 124.01 3d29 s PHE 111 Ca 0.00 -1.14 -0.02 0.00 0.12 0.00 0.00 56.93 55.89 3d29 s PHE 111 Cb -0.16 -1.04 -0.01 0.00 -0.57 0.00 0.00 43.02 41.24 3d29 s PHE 111 CO -0.07 -0.25 0.04 -1.54 -0.10 0.00 0.00 175.22 173.30 3d29 s SER 112 N -3.40 0.12 -0.02 1.36 1.04 -0.90 -1.35 113.70 110.55 3d29 s SER 112 Ca 0.36 -0.30 0.03 0.00 0.48 0.00 0.00 55.95 56.52 3d29 s SER 112 Cb 0.07 0.13 -0.00 0.00 0.10 0.00 0.00 66.02 66.33 3d29 s SER 112 CO 0.15 -0.27 -0.09 -0.63 0.98 0.00 0.00 173.24 173.38 3d29 s ILE 113 N -1.15 0.73 0.17 -1.02 1.01 0.26 -1.65 121.20 119.55 3d29 s ILE 113 Ca -0.13 -0.36 0.06 0.00 0.00 0.00 0.00 60.65 60.22 3d29 s ILE 113 Cb -0.07 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 3d29 s ILE 113 CO -0.00 0.22 0.11 -1.00 0.00 0.00 0.00 174.94 174.27 3d29 s HIS 114 N -0.00 3.09 0.36 3.97 3.76 -0.56 -0.67 115.29 125.23 3d29 s HIS 114 Ca 0.00 -0.05 0.18 0.00 -0.15 0.00 0.00 55.06 55.05 3d29 s HIS 114 Cb -0.06 -1.48 1.18 0.00 1.11 0.00 0.00 32.58 33.34 3d29 s HIS 114 CO -0.00 0.52 1.65 0.00 -0.85 0.00 0.00 174.74 176.06 3d29 h ALA 115 N 2.39 2.13 0.00 -1.40 0.00 -1.48 0.34 119.26 121.24 3d29 h ALA 115 Ca -0.48 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3d29 h ALA 115 Cb 1.20 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3d29 h ALA 115 CO 0.62 -0.76 0.00 0.72 0.00 0.00 0.00 179.25 179.83 3d29 n HIS 116 N -5.00 0.86 0.00 0.00 8.25 -1.26 -3.72 115.22 114.35 3d29 n HIS 116 Ca 0.33 0.28 0.00 0.00 -0.26 0.00 0.00 57.72 58.07 3d29 n HIS 116 Cb 1.09 -0.96 0.00 0.00 1.12 0.00 0.00 29.99 31.25 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 0.84 0.90 3.81 -1.41 0.00 0.12 -3.97 105.19 105.48 3d29 n GLY 117 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.83 7.06 0.22 1.61 1.04 -1.25 -4.79 113.70 116.76 3d29 s SER 118 Ca 0.00 1.52 0.11 0.00 0.48 0.00 0.00 55.95 58.06 3d29 s SER 118 Cb 0.00 -2.46 -0.05 0.00 0.10 0.00 0.00 66.02 63.61 3d29 s SER 118 CO 0.00 -0.07 -0.22 0.42 0.98 0.00 0.00 173.24 174.35 3d29 s THR 119 N -1.69 2.32 0.08 2.02 -4.23 -1.26 -1.50 115.64 111.38 3d29 s THR 119 Ca 0.48 -2.17 0.01 0.00 -1.18 0.00 0.00 61.69 58.83 3d29 s THR 119 Cb -0.15 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.49 3d29 s THR 119 CO 0.20 -0.26 -0.05 -1.81 -0.54 0.00 0.00 174.62 172.16 3d29 s ASP 120 N -3.01 0.91 0.03 3.99 1.01 -0.66 -4.97 116.67 113.97 3d29 s ASP 120 Ca 0.24 -1.01 0.05 0.00 0.71 0.00 0.00 52.55 52.54 3d29 s ASP 120 Cb -0.06 0.13 -0.02 0.00 1.01 0.00 0.00 42.92 43.98 3d29 s ASP 120 CO 0.11 -0.52 -0.14 0.54 0.21 0.00 0.00 175.17 175.37 3d29 s VAL 121 N -3.73 1.13 0.09 -1.27 0.11 -1.26 -2.12 120.40 113.34 3d29 s VAL 121 Ca 0.11 -0.96 -0.25 0.00 -2.93 0.00 0.00 61.98 57.95 3d29 s VAL 121 Cb 0.06 -1.01 0.09 0.00 -1.53 0.00 0.00 36.38 33.99 3d29 s VAL 121 CO -0.06 0.05 1.16 -0.83 -3.33 0.00 0.00 175.10 172.09 3d29 s GLY 122 N -1.04 0.01 0.06 6.54 0.00 -1.12 -5.01 107.32 106.76 3d29 s GLY 122 Ca 0.02 -0.17 0.22 0.00 0.00 0.00 0.00 44.72 44.79 3d29 s GLY 122 CO 0.01 4.09 0.85 -1.72 0.00 0.00 0.00 173.10 176.33 3d29 n TYR 123 N -0.81 0.36 -3.69 1.90 4.02 -1.26 -4.55 117.16 113.13 3d29 n TYR 123 Ca 0.00 0.10 -0.10 0.00 -0.01 0.00 0.00 57.90 57.89 3d29 n TYR 123 Cb 0.59 -0.57 -0.10 0.00 -0.02 0.00 0.00 39.34 39.24 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 -3.33 -0.69 0.04 -0.72 1.13 -1.26 -0.79 117.35 111.73 3d29 s TYR 124 Ca -0.01 1.48 -0.06 0.00 -1.41 0.00 0.00 57.07 57.08 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 -0.36 0.10 -0.51 -2.51 0.00 0.00 175.55 173.10 3d29 s LEU 125 N 1.18 1.78 -0.06 -3.49 1.43 -0.55 -4.96 118.68 114.01 3d29 s LEU 125 Ca -0.07 -0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 52.40 3d29 s LEU 125 Cb -0.07 0.62 0.02 0.00 0.03 0.00 0.00 46.19 46.79 3d29 s LEU 125 CO -0.11 -0.51 0.24 -0.94 0.23 0.00 0.00 176.35 175.25 3d29 s SER 126 N -2.13 -0.20 0.18 2.29 1.04 -1.26 -0.35 113.70 113.27 3d29 s SER 126 Ca -0.05 0.30 -0.00 0.00 0.48 0.00 0.00 55.95 56.68 3d29 s SER 126 Cb -0.01 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.49 3d29 s SER 126 CO -0.05 -0.19 0.08 -0.76 0.98 0.00 0.00 173.24 173.30 3d29 s LEU 127 N -0.38 1.57 0.00 2.42 1.43 -0.57 -4.90 118.68 118.26 3d29 s LEU 127 Ca -0.05 -1.30 0.00 0.00 -1.03 0.00 0.00 54.13 51.76 3d29 s LEU 127 Cb -0.03 0.24 0.00 0.00 0.03 0.00 0.00 46.19 46.43 3d29 s LEU 127 CO 0.01 -0.75 0.00 0.61 0.23 0.00 0.00 176.35 176.45 3d29 n GLY 128 N -0.23 0.67 0.26 -3.19 0.00 -1.26 -2.20 105.19 99.24 3d29 n GLY 128 Ca -0.02 -2.07 0.11 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.60 113.55 117.29 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 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 3d29 n GLY 130 N -0.96 0.24 0.33 -0.77 0.00 -0.41 -4.42 105.19 99.21 3d29 n GLY 130 Ca -0.02 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.66 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 1.97 -0.85 -0.27 1.61 0.87 -1.25 -1.44 113.55 114.19 3d29 h SER 131 Ca 0.00 0.27 -0.17 0.00 -1.23 0.00 0.00 61.79 60.66 3d29 h SER 131 Cb 0.44 0.56 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 3d29 h SER 131 CO 0.00 -0.30 -0.49 -0.07 -0.53 0.00 0.00 176.83 175.44 3d29 h LEU 132 N -0.00 0.91 -0.36 2.23 4.07 -1.82 -1.04 115.31 119.30 3d29 h LEU 132 Ca 0.43 -0.53 0.00 0.00 0.08 0.00 0.00 57.88 57.86 3d29 h LEU 132 Cb 0.66 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 3d29 h LEU 132 CO -0.93 1.26 0.23 0.00 -1.08 0.00 0.00 178.44 177.92 3d29 h ALA 133 N 0.67 0.45 0.09 1.53 0.00 -1.70 -1.56 119.26 118.74 3d29 h ALA 133 Ca 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3d29 h ALA 133 Cb 1.10 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3d29 h ALA 133 CO 0.11 -0.07 -0.05 0.00 0.00 0.00 0.00 179.25 179.24 3d29 h ALA 134 N 1.11 -0.13 -0.39 0.00 0.00 -1.27 -3.01 119.26 115.58 3d29 h ALA 134 Ca 0.13 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3d29 h ALA 134 Cb -0.03 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3d29 h ALA 134 CO -0.03 -0.52 0.26 1.98 0.00 0.00 0.00 179.25 180.95 3d29 h MET 135 N -0.24 0.33 -0.27 0.00 -1.53 -1.06 -0.70 114.93 111.47 3d29 h MET 135 Ca -0.01 -0.02 -0.06 0.00 -3.44 0.00 0.00 59.70 56.16 3d29 h MET 135 Cb 0.20 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.16 3d29 h MET 135 CO 0.02 0.22 -0.11 0.00 0.14 0.00 0.00 176.91 177.18 3d29 h ALA 136 N 1.79 1.31 -0.01 0.39 0.00 -1.15 0.46 119.26 122.06 3d29 h ALA 136 Ca 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3d29 h ALA 136 Cb 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3d29 h ALA 136 CO -0.04 0.46 -0.03 0.28 0.00 0.00 0.00 179.25 179.92 3d29 h VAL 137 N 0.41 1.50 -0.26 0.00 2.07 -1.13 -2.33 116.25 116.51 3d29 h VAL 137 Ca 0.08 -1.52 0.04 0.00 0.82 0.00 0.00 66.70 66.13 3d29 h VAL 137 Cb 0.45 2.50 -0.04 0.00 -1.52 0.00 0.00 31.29 32.69 3d29 h VAL 137 CO 0.03 0.40 0.00 -0.07 0.02 0.00 0.00 177.57 177.95 3d29 h LEU 138 N -0.59 -0.10 -2.01 2.57 3.38 -0.98 0.27 115.31 117.87 3d29 h LEU 138 Ca -0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3d29 h LEU 138 Cb 0.67 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3d29 h LEU 138 CO 0.01 -0.02 0.00 -0.33 0.09 0.00 0.00 178.44 178.19 3d29 h GLU 139 N 0.08 0.00 0.00 1.13 4.39 -0.12 -0.85 114.58 119.21 3d29 h GLU 139 Ca 0.12 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.55 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 -0.21 0.00 -1.87 0.43 -1.16 0.00 0.00 179.01 176.20 3d29 n SER 140 N -2.75 0.54 0.00 1.42 7.64 0.68 -4.67 113.62 116.48 3d29 n SER 140 Ca -0.01 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.12 3d29 n SER 140 Cb 0.12 0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 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 -2.64 1.43 8.25 0.42 -5.05 115.22 114.75 3d29 n HIS 141 Ca -0.19 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.88 3d29 n HIS 141 Cb 1.01 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 32.06 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 -0.00 3.71 0.05 4.41 -0.00 -0.35 -5.04 118.94 121.72 3d29 s TRP 142 Ca 0.00 1.79 -0.05 0.00 -0.00 0.00 0.00 56.10 57.84 3d29 s TRP 142 Cb 0.00 -3.08 -0.01 0.00 -0.00 0.00 0.00 33.47 30.38 3d29 s TRP 142 CO 0.00 -0.04 0.09 -1.59 -0.00 0.00 0.00 176.95 175.41 3d29 s LYS 143 N -1.61 0.64 0.36 5.86 -2.85 -1.26 -5.00 119.74 115.88 3d29 s LYS 143 Ca 0.46 -0.88 -0.26 0.00 -1.00 0.00 0.00 55.97 54.29 3d29 s LYS 143 Cb -0.26 0.25 -0.09 0.00 -2.06 0.00 0.00 37.83 35.67 3d29 s LYS 143 CO 0.33 -0.17 1.13 -1.14 0.10 0.00 0.00 175.35 175.60 3d29 s GLN 144 N -3.09 4.26 -0.42 1.78 0.74 -1.26 -4.26 119.66 117.41 3d29 s GLN 144 Ca -0.01 1.78 -0.00 0.00 0.05 0.00 0.00 55.36 57.18 3d29 s GLN 144 Cb 0.02 -2.82 -0.01 0.00 1.10 0.00 0.00 33.01 31.30 3d29 s GLN 144 CO -0.07 -0.12 0.39 -0.25 -0.55 0.00 0.00 175.29 174.69 3d29 n ASP 145 N 0.41 -5.02 -4.94 6.67 10.43 -1.26 -5.06 116.55 117.78 3d29 n ASP 145 Ca 0.03 -0.08 -0.26 0.00 2.57 0.00 0.00 54.79 57.04 3d29 n ASP 145 Cb 0.46 -3.27 -0.03 0.00 1.84 0.00 0.00 41.12 40.12 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 -3.23 4.31 0.41 0.64 1.43 -1.26 -4.81 118.68 116.16 3d29 s LEU 146 Ca 0.03 0.23 -0.03 0.00 -1.03 0.00 0.00 54.13 53.33 3d29 s LEU 146 Cb -0.00 -2.98 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 3d29 s LEU 146 CO 0.40 0.02 0.67 0.42 0.23 0.00 0.00 176.35 178.08 3d29 s THR 147 N -1.79 5.00 0.29 5.49 -4.23 -1.26 -0.10 115.64 119.04 3d29 s THR 147 Ca 0.36 -0.09 0.04 0.00 -1.18 0.00 0.00 61.69 60.82 3d29 s THR 147 Cb -0.11 -3.85 0.30 0.00 1.34 0.00 0.00 72.50 70.18 3d29 s THR 147 CO 0.29 -0.68 1.67 0.50 -0.54 0.00 0.00 174.62 175.85 3d29 h LYS 148 N 0.57 0.29 -0.48 3.99 3.64 -1.99 0.16 116.57 122.75 3d29 h LYS 148 Ca -0.48 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 58.75 3d29 h LYS 148 Cb 1.21 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 3d29 h LYS 148 CO 0.62 0.19 -0.21 0.93 -2.27 0.00 0.00 179.45 178.70 3d29 h GLU 149 N 0.29 0.99 -0.24 1.90 3.07 -2.00 -2.32 114.58 116.27 3d29 h GLU 149 Ca 0.57 -0.42 -0.03 0.00 -0.50 0.00 0.00 59.36 58.98 3d29 h GLU 149 Cb 1.14 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.01 3d29 h GLU 149 CO -0.60 1.10 0.03 0.93 -1.40 0.00 0.00 179.01 179.07 3d29 h GLU 150 N 0.86 0.41 -0.51 2.33 5.08 -1.30 -2.50 114.58 118.94 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 0.79 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 3d29 h GLU 150 CO 0.07 0.55 0.25 0.00 -1.00 0.00 0.00 179.01 178.88 3d29 h ALA 151 N 0.84 0.65 -0.70 3.43 0.00 -0.74 -0.26 119.26 122.49 3d29 h ALA 151 Ca 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3d29 h ALA 151 Cb 0.34 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3d29 h ALA 151 CO 0.01 -0.09 0.34 0.82 0.00 0.00 0.00 179.25 180.32 3d29 h ILE 152 N 0.50 1.22 -0.06 0.00 2.04 -1.34 0.22 117.51 120.08 3d29 h ILE 152 Ca 0.22 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3d29 h ILE 152 Cb 0.14 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 3d29 h ILE 152 CO -0.16 0.26 -0.00 0.50 0.00 0.00 0.00 178.15 178.75 3d29 h LYS 153 N 0.99 0.11 0.21 2.37 3.11 -0.93 -0.19 116.57 122.24 3d29 h LYS 153 Ca 0.24 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 58.04 3d29 h LYS 153 Cb 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.31 3d29 h LYS 153 CO -0.03 0.41 -0.16 1.25 -2.81 0.00 0.00 179.45 178.11 3d29 h LEU 154 N -0.19 -0.41 -0.20 5.20 5.85 -0.76 0.24 115.31 125.02 3d29 h LEU 154 Ca 0.02 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.81 3d29 h LEU 154 Cb 0.36 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 3d29 h LEU 154 CO 0.00 -0.25 -0.04 0.00 -0.34 0.00 0.00 178.44 177.81 3d29 h ALA 155 N 0.39 0.14 -0.95 1.25 0.00 -0.97 -0.61 119.26 118.51 3d29 h ALA 155 Ca -0.01 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3d29 h ALA 155 Cb 0.33 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 3d29 h ALA 155 CO -0.01 -0.47 0.63 1.03 0.00 0.00 0.00 179.25 180.43 3d29 h SER 156 N 0.01 1.08 -0.59 0.00 0.87 -0.78 -1.28 113.55 112.85 3d29 h SER 156 Ca 0.10 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.53 3d29 h SER 156 Cb 0.15 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 3d29 h SER 156 CO -0.20 0.78 -0.01 0.44 -0.53 0.00 0.00 176.83 177.30 3d29 h ASP 157 N 1.28 1.04 -0.36 6.23 3.45 0.04 -2.03 116.42 126.08 3d29 h ASP 157 Ca 0.35 -0.30 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 3d29 h ASP 157 Cb -0.14 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.33 3d29 h ASP 157 CO -0.08 1.10 0.21 0.00 -1.57 0.00 0.00 179.24 178.90 3d29 h ALA 158 N 1.00 0.46 -0.72 3.45 0.00 -0.44 -1.16 119.26 121.87 3d29 h ALA 158 Ca 0.17 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3d29 h ALA 158 Cb 0.57 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3d29 h ALA 158 CO 0.03 -0.03 0.47 0.82 0.00 0.00 0.00 179.25 180.54 3d29 h ILE 159 N 0.47 1.17 -0.67 0.00 1.08 -1.10 -1.94 117.51 116.52 3d29 h ILE 159 Ca 0.13 -0.33 -0.01 0.00 -0.39 0.00 0.00 64.86 64.26 3d29 h ILE 159 Cb 0.02 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 33.87 3d29 h ILE 159 CO -0.02 0.17 0.37 1.56 -0.69 0.00 0.00 178.15 179.54 3d29 h GLN 160 N 0.96 0.92 -1.00 2.37 4.20 -0.91 -0.02 115.11 121.63 3d29 h GLN 160 Ca 0.27 -0.10 0.11 0.00 0.06 0.00 0.00 58.65 58.99 3d29 h GLN 160 Cb -0.10 -0.19 -0.08 0.00 0.30 0.00 0.00 27.48 27.42 3d29 h GLN 160 CO -0.06 0.67 0.63 0.00 -0.67 0.00 0.00 178.83 179.40 3d29 h ALA 161 N 1.48 1.49 -0.06 3.87 0.00 -0.42 0.11 119.26 125.73 3d29 h ALA 161 Ca 0.24 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 3d29 h ALA 161 Cb 0.02 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3d29 h ALA 161 CO -0.04 0.26 -0.54 0.78 0.00 0.00 0.00 179.25 179.70 3d29 h GLY 162 N 1.02 0.52 0.52 0.00 0.00 -1.08 -2.12 103.07 101.93 3d29 h GLY 162 Ca 0.49 -0.80 0.10 0.00 0.00 0.00 0.00 47.33 47.12 3d29 h GLY 162 CO -0.25 0.71 0.59 -2.22 0.00 0.00 0.00 176.54 175.36 3d29 h ILE 163 N 0.02 0.94 0.06 2.60 2.04 -0.23 0.22 117.51 123.15 3d29 h ILE 163 Ca -0.05 -0.33 -0.27 0.00 1.00 0.00 0.00 64.86 65.20 3d29 h ILE 163 Cb 1.22 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3d29 h ILE 163 CO 0.11 0.18 -1.39 -0.50 0.00 0.00 0.00 178.15 176.55 3d29 h TRP 164 N 0.96 0.24 0.00 1.37 -0.00 -1.06 -3.38 115.95 114.08 3d29 h TRP 164 Ca 0.46 -0.18 0.00 0.00 -0.00 0.00 0.00 58.89 59.17 3d29 h TRP 164 Cb 0.40 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 29.55 3d29 h TRP 164 CO -0.02 1.19 -0.80 0.09 -0.00 0.00 0.00 178.44 178.90 3d29 n ASN 165 N -3.35 0.85 -4.31 -3.49 4.13 -0.80 -4.93 115.26 103.36 3d29 n ASN 165 Ca -0.11 -0.67 -0.36 0.00 1.68 0.00 0.00 54.58 55.12 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 4.74 0.65 6.41 2.15 0.74 -4.97 116.67 123.90 3d29 s ASP 166 Ca 0.03 -0.64 0.41 0.00 0.43 0.00 0.00 52.55 52.78 3d29 s ASP 166 Cb 0.10 -1.80 2.27 0.00 -0.30 0.00 0.00 42.92 43.19 3d29 s ASP 166 CO 0.55 -0.12 2.33 -0.07 -0.17 0.00 0.00 175.17 177.69 3d29 h LEU 167 N 8.15 0.00 -0.36 -1.34 3.38 -1.90 0.20 115.31 123.44 3d29 h LEU 167 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3d29 h LEU 167 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 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 -1.15 -0.72 3.35 0.83 0.00 -1.26 -4.86 105.19 101.38 3d29 n GLY 168 Ca -0.03 -0.30 -0.19 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.25 2.64 0.00 1.61 0.01 0.69 -0.81 113.70 115.60 3d29 s SER 169 Ca 0.36 -0.98 0.00 0.00 1.31 0.00 0.00 55.95 56.64 3d29 s SER 169 Cb 0.21 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.29 3d29 s SER 169 CO 0.42 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.55 3d29 n GLY 170 N -0.21 -1.31 7.00 3.44 0.00 -1.26 -4.63 105.19 108.21 3d29 n GLY 170 Ca -0.09 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 2.00 0.00 -4.92 1.61 7.64 -1.26 -2.58 113.62 116.10 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 4.97 -0.17 6.43 0.02 -1.26 -4.28 114.94 116.65 3d29 s ASN 172 Ca 0.00 -0.90 0.01 0.00 -1.02 0.00 0.00 52.86 50.95 3d29 s ASN 172 Cb 0.00 -0.11 0.01 0.00 0.02 0.00 0.00 41.25 41.18 3d29 s ASN 172 CO 0.00 -0.93 -0.19 -0.69 0.02 0.00 0.00 177.10 175.31 3d29 s VAL 173 N -2.59 2.24 0.01 1.60 1.01 -0.54 -2.73 120.40 119.41 3d29 s VAL 173 Ca 0.47 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.56 3d29 s VAL 173 Cb -0.04 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 3d29 s VAL 173 CO 0.28 0.53 0.08 -1.81 0.00 0.00 0.00 175.10 174.18 3d29 s ASP 174 N 1.13 5.65 0.04 3.32 1.01 0.05 -0.50 116.67 127.37 3d29 s ASP 174 Ca 0.01 0.12 -0.02 0.00 0.71 0.00 0.00 52.55 53.37 3d29 s ASP 174 Cb -0.14 -1.61 -0.03 0.00 1.01 0.00 0.00 42.92 42.15 3d29 s ASP 174 CO -0.08 0.25 -0.00 -0.69 0.21 0.00 0.00 175.17 174.86 3d29 s VAL 175 N -1.23 0.18 -0.09 -1.27 1.01 -0.91 -1.62 120.40 116.47 3d29 s VAL 175 Ca 0.24 -1.49 -0.04 0.00 0.00 0.00 0.00 61.98 60.69 3d29 s VAL 175 Cb -0.12 -1.16 0.05 0.00 0.00 0.00 0.00 36.38 35.15 3d29 s VAL 175 CO 0.16 -0.83 0.20 0.00 0.00 0.00 0.00 175.10 174.63 3d29 s VAL 177 N 1.53 4.01 -0.32 0.00 1.01 0.16 -2.11 120.40 124.67 3d29 s VAL 177 Ca -0.06 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.64 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 -0.07 0.48 0.03 -0.04 0.00 0.00 0.00 175.10 175.50 3d29 s MET 178 N 0.43 1.50 -0.15 2.72 -1.94 -0.20 -0.27 119.30 121.39 3d29 s MET 178 Ca -0.03 -1.70 -0.06 0.00 -1.71 0.00 0.00 55.69 52.19 3d29 s MET 178 Cb -0.14 -3.03 -0.04 0.00 2.01 0.00 0.00 34.83 33.63 3d29 s MET 178 CO 0.02 -0.89 0.05 -2.00 -0.01 0.00 0.00 175.02 172.20 3d29 s GLU 179 N 1.01 3.69 0.34 2.03 2.12 -1.26 -0.92 118.70 125.70 3d29 s GLU 179 Ca 0.08 -0.35 0.23 0.00 0.36 0.00 0.00 54.97 55.29 3d29 s GLU 179 Cb -0.19 -3.10 1.17 0.00 0.26 0.00 0.00 34.13 32.27 3d29 s GLU 179 CO -0.09 0.42 1.27 -0.89 -0.54 0.00 0.00 175.26 175.43 3d29 n ILE 180 N 3.07 -0.25 0.28 -3.70 5.41 0.03 -1.69 119.36 122.49 3d29 n ILE 180 Ca -0.17 1.53 0.05 0.00 1.00 0.00 0.00 62.75 65.15 3d29 n ILE 180 Cb 0.53 -2.50 0.06 0.00 -0.71 0.00 0.00 39.64 37.01 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 -1.34 0.18 3.00 7.39 0.00 -1.26 -4.93 105.19 108.22 3d29 n GLY 181 Ca 0.32 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 0.49 0.98 -2.56 1.61 5.02 -0.68 -5.12 118.16 117.90 3d29 n LYS 182 Ca 0.06 -3.04 -0.34 0.00 -2.02 0.00 0.00 58.31 52.97 3d29 n LYS 182 Cb 0.27 0.79 -0.04 0.00 -0.02 0.00 0.00 35.03 36.03 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 -3.32 6.38 0.32 4.39 -0.00 -1.26 -4.66 116.67 118.52 3d29 s ASP 183 Ca 0.01 1.91 -0.28 0.00 -0.00 0.00 0.00 52.55 54.19 3d29 s ASP 183 Cb -0.00 -2.56 -0.10 0.00 -0.00 0.00 0.00 42.92 40.26 3d29 s ASP 183 CO 0.01 -0.75 1.17 0.00 -0.00 0.00 0.00 175.17 175.60 3d29 s ALA 184 N -1.99 3.37 -0.24 5.23 0.00 -1.26 -4.68 121.76 122.19 3d29 s ALA 184 Ca 0.67 1.01 -0.01 0.00 0.00 0.00 0.00 51.96 53.63 3d29 s ALA 184 Cb -0.16 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.61 3d29 s ALA 184 CO 0.19 -0.37 -0.08 -1.83 0.00 0.00 0.00 175.76 173.67 3d29 s GLU 185 N -1.76 2.78 -0.28 0.00 -1.05 0.63 -4.95 118.70 114.07 3d29 s GLU 185 Ca 0.49 -1.01 -0.20 0.00 -0.15 0.00 0.00 54.97 54.11 3d29 s GLU 185 Cb -0.33 -2.92 -0.02 0.00 -0.44 0.00 0.00 34.13 30.42 3d29 s GLU 185 CO 0.43 -0.40 0.59 -0.47 0.95 0.00 0.00 175.26 176.37 3d29 s TYR 186 N 1.29 3.24 -0.91 4.83 5.04 -1.26 0.36 117.35 129.94 3d29 s TYR 186 Ca -0.00 0.63 -0.03 0.00 -2.44 0.00 0.00 57.07 55.23 3d29 s TYR 186 Cb -0.17 -2.88 0.23 0.00 0.35 0.00 0.00 41.96 39.49 3d29 s TYR 186 CO -0.06 -0.39 0.81 -0.51 -1.34 0.00 0.00 175.55 174.06 3d29 s LEU 187 N 2.50 5.67 0.14 6.97 1.43 0.24 -4.98 118.68 130.66 3d29 s LEU 187 Ca 0.24 -3.64 -0.31 0.00 -1.03 0.00 0.00 54.13 49.39 3d29 s LEU 187 Cb -0.15 -1.96 -0.10 0.00 0.03 0.00 0.00 46.19 44.01 3d29 s LEU 187 CO 0.10 -0.21 1.63 -0.60 0.23 0.00 0.00 176.35 177.50 3d29 s ARG 189 N -1.24 4.19 -1.30 1.70 6.06 -1.26 -2.13 118.95 124.97 3d29 s ARG 189 Ca 0.27 2.40 -0.01 0.00 -2.50 0.00 0.00 55.73 55.89 3d29 s ARG 189 Cb -0.08 -3.29 0.01 0.00 0.06 0.00 0.00 34.95 31.64 3d29 s ARG 189 CO -0.11 -0.67 0.79 0.09 -2.50 0.00 0.00 175.30 172.89 3d29 n ASN 190 N 4.52 -1.69 -0.10 -2.12 4.13 -1.25 -4.85 115.26 113.89 3d29 n ASN 190 Ca 0.15 -0.77 0.11 0.00 1.68 0.00 0.00 54.58 55.75 3d29 n ASN 190 Cb 0.39 -4.30 0.47 0.00 -1.54 0.00 0.00 39.78 34.80 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 -1.91 0.50 -3.71 3.10 -0.00 -0.54 -3.40 116.97 111.01 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 1.36 -0.16 -0.32 0.00 -0.00 0.00 0.00 36.73 37.61 3d29 h TYR 191 CO 0.47 0.25 -0.79 -0.51 -0.00 0.00 0.00 178.16 177.57 3d29 s LEU 192 N -9.42 1.70 -0.51 2.82 1.43 -0.96 -4.99 118.68 108.75 3d29 s LEU 192 Ca -0.08 -0.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.89 3d29 s LEU 192 Cb 0.19 -0.58 0.24 0.00 0.03 0.00 0.00 46.19 46.08 3d29 s LEU 192 CO 0.75 0.04 0.60 0.35 0.23 0.00 0.00 176.35 178.32 3d29 n THR 193 N 3.48 0.63 1.00 5.49 -2.24 -1.26 -1.46 114.28 119.91 3d29 n THR 193 Ca -0.20 -4.50 0.03 0.00 -2.27 0.00 0.00 64.05 57.10 3d29 n THR 193 Cb 0.53 -2.01 0.10 0.00 -2.10 0.00 0.00 70.33 66.85 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 1.32 1.70 -2.60 -0.78 -0.04 -1.26 -4.19 135.00 129.14 3d29 n PRO 194 Ca 0.25 -0.76 -0.09 0.00 -0.04 0.00 0.00 63.50 62.87 3d29 n PRO 194 Cb 0.47 -1.39 0.04 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.11 2.50 -4.72 3.54 3.02 -1.26 -5.07 115.26 113.38 3d29 n ASN 195 Ca 0.07 -2.64 -0.42 0.00 -0.03 0.00 0.00 54.58 51.56 3d29 n ASN 195 Cb 0.31 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.99 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 -3.99 3.23 0.22 2.41 1.01 -1.26 -4.96 120.40 117.07 3d29 s VAL 196 Ca 0.34 0.93 -0.30 0.00 0.00 0.00 0.00 61.98 62.95 3d29 s VAL 196 Cb 0.37 -3.60 -0.09 0.00 0.00 0.00 0.00 36.38 33.06 3d29 s VAL 196 CO -0.02 0.10 1.36 -0.60 0.00 0.00 0.00 175.10 175.94 3d29 s ARG 197 N 0.63 4.34 0.81 2.72 3.00 -1.26 -4.99 118.95 124.21 3d29 s ARG 197 Ca 0.62 2.15 -0.11 0.00 -1.00 0.00 0.00 55.73 57.39 3d29 s ARG 197 Cb -0.37 -3.16 0.08 0.00 0.00 0.00 0.00 34.95 31.50 3d29 s ARG 197 CO 0.33 -0.31 1.11 -1.83 0.00 0.00 0.00 175.30 174.60 3d29 s GLU 198 N -0.24 1.91 0.26 5.12 -1.05 -1.26 -4.92 118.70 118.52 3d29 s GLU 198 Ca 0.57 1.31 -0.31 0.00 -0.15 0.00 0.00 54.97 56.40 3d29 s GLU 198 Cb -0.39 -1.85 -0.12 0.00 -0.44 0.00 0.00 34.13 31.34 3d29 s GLU 198 CO 0.40 -1.92 1.60 -1.91 0.95 0.00 0.00 175.26 174.38 3d29 n GLU 199 N -3.65 2.60 -1.42 -4.83 2.13 -1.26 -4.94 120.64 109.26 3d29 n GLU 199 Ca 0.10 0.93 -0.33 0.00 0.66 0.00 0.00 57.16 58.52 3d29 n GLU 199 Cb 0.53 -2.71 0.09 0.00 0.27 0.00 0.00 31.44 29.61 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 -0.02 2.21 0.31 5.31 1.02 -1.26 -4.94 119.74 122.36 3d29 s LYS 200 Ca 0.68 1.57 0.13 0.00 0.02 0.00 0.00 55.97 58.37 3d29 s LYS 200 Cb -0.53 -1.86 0.46 0.00 -0.52 0.00 0.00 37.83 35.38 3d29 s LYS 200 CO 0.44 -1.74 1.65 0.37 -0.92 0.00 0.00 175.35 175.15 3d29 h GLN 201 N -0.46 0.00 -3.88 1.68 5.75 -2.05 -3.46 115.11 112.68 3d29 h GLN 201 Ca -0.46 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 57.93 3d29 h GLN 201 Cb 1.27 0.00 -0.11 0.00 1.07 0.00 0.00 27.48 29.71 3d29 h GLN 201 CO 0.50 0.54 -0.27 0.21 -2.65 0.00 0.00 178.83 177.15 3d29 s LYS 202 N -3.61 1.32 -0.12 1.69 2.20 -1.26 -5.15 119.74 114.81 3d29 s LYS 202 Ca -0.01 -1.26 -0.04 0.00 -0.36 0.00 0.00 55.97 54.31 3d29 s LYS 202 Cb 0.12 0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 36.81 3d29 s LYS 202 CO 0.74 -0.51 0.01 0.45 -0.36 0.00 0.00 175.35 175.68 3d29 s SER 203 N -3.01 5.30 -0.08 1.43 0.15 -1.26 -4.99 113.70 111.24 3d29 s SER 203 Ca 0.22 0.10 0.17 0.00 0.70 0.00 0.00 55.95 57.14 3d29 s SER 203 Cb 0.02 -1.66 0.61 0.00 -1.71 0.00 0.00 66.02 63.28 3d29 s SER 203 CO 0.05 0.30 1.52 -1.22 1.20 0.00 0.00 173.24 175.09 3d29 n TYR 204 N 2.67 1.14 -1.69 3.44 4.01 -1.26 -4.96 117.16 120.51 3d29 n TYR 204 Ca -0.18 -0.60 -0.55 0.00 -0.16 0.00 0.00 57.90 56.41 3d29 n TYR 204 Cb 0.53 -0.16 -0.07 0.00 -0.31 0.00 0.00 39.34 39.33 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 0.93 1.38 -3.18 -0.72 4.81 -1.26 -4.92 118.16 115.19 3d29 n LYS 205 Ca 0.22 0.50 -0.31 0.00 -0.87 0.00 0.00 58.31 57.85 3d29 n LYS 205 Cb 0.75 -2.22 -0.05 0.00 0.02 0.00 0.00 35.03 33.54 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 3.26 3.42 0.13 5.64 0.08 -1.26 -5.04 117.98 124.22 3d29 s PHE 206 Ca 0.95 1.01 -0.30 0.00 0.12 0.00 0.00 56.93 58.70 3d29 s PHE 206 Cb -0.98 -2.38 -0.07 0.00 -0.57 0.00 0.00 43.02 39.02 3d29 s PHE 206 CO 0.60 0.11 1.25 -1.25 -0.10 0.00 0.00 175.22 175.83 3d29 s PRO 207 N -3.21 4.42 0.31 0.24 0.04 -1.26 -4.93 135.00 130.61 3d29 s PRO 207 Ca 0.50 1.90 -0.29 0.00 0.04 0.00 0.00 61.00 63.16 3d29 s PRO 207 Cb -0.11 -3.27 -0.13 0.00 0.04 0.00 0.00 34.50 31.04 3d29 s PRO 207 CO 0.23 -0.24 1.28 0.54 0.04 0.00 0.00 177.00 178.86 3d29 n ARG 208 N 3.31 2.02 0.00 4.56 1.74 -1.26 -2.00 116.66 125.02 3d29 n ARG 208 Ca 0.08 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 3d29 n ARG 208 Cb 0.44 -2.28 0.00 0.00 -1.02 0.00 0.00 32.46 29.60 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 1.13 0.13 0.35 -0.13 0.00 -1.26 -4.96 105.19 100.45 3d29 n GLY 209 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.14 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 1.05 -3.32 2.61 2.02 -1.78 -3.42 112.91 110.07 3d29 h THR 210 Ca 0.00 -0.26 -0.57 0.00 0.77 0.00 0.00 66.41 66.35 3d29 h THR 210 Cb 0.00 0.22 -0.07 0.00 -1.74 0.00 0.00 68.15 66.57 3d29 h THR 210 CO 0.00 0.14 -0.06 -0.89 0.37 0.00 0.00 175.52 175.08 3d29 s THR 211 N -5.67 5.10 -0.26 3.16 2.01 -1.26 -5.04 115.64 113.67 3d29 s THR 211 Ca -0.10 1.13 -0.28 0.00 0.31 0.00 0.00 61.69 62.75 3d29 s THR 211 Cb 0.19 -3.89 0.01 0.00 0.01 0.00 0.00 72.50 68.82 3d29 s THR 211 CO 0.77 0.33 1.01 0.00 -0.69 0.00 0.00 174.62 176.04 3d29 s ALA 212 N 0.46 3.62 -0.07 7.40 0.00 -1.26 -5.03 121.76 126.87 3d29 s ALA 212 Ca 0.30 0.04 -0.04 0.00 0.00 0.00 0.00 51.96 52.26 3d29 s ALA 212 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3d29 s ALA 212 CO 0.14 -1.17 0.11 0.08 0.00 0.00 0.00 175.76 174.92 3d29 s VAL 213 N 3.27 5.13 -0.19 0.00 1.01 -1.26 -5.03 120.40 123.33 3d29 s VAL 213 Ca 0.43 -0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.40 3d29 s VAL 213 Cb -0.14 -3.27 -0.21 0.00 0.00 0.00 0.00 36.38 32.75 3d29 s VAL 213 CO 0.09 0.52 0.06 0.18 0.00 0.00 0.00 175.10 175.94 3d29 n LEU 214 N 1.69 2.03 -3.46 3.92 4.77 -1.26 -5.04 117.00 119.64 3d29 n LEU 214 Ca -0.17 0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.71 3d29 n LEU 214 Cb 0.54 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 3d29 n LEU 214 CO 0.34 0.77 0.38 -0.75 -1.33 0.00 0.00 177.39 176.80 3d29 s LYS 215 N -2.53 1.22 0.09 3.23 2.20 -1.26 -5.19 119.74 117.50 3d29 s LYS 215 Ca -0.24 -0.38 -0.05 0.00 -0.36 0.00 0.00 55.97 54.94 3d29 s LYS 215 Cb 0.08 0.56 -0.02 0.00 -1.51 0.00 0.00 37.83 36.94 3d29 s LYS 215 CO 0.71 -0.51 0.11 -2.00 -0.36 0.00 0.00 175.35 173.30 3d29 s GLU 216 N -3.35 0.81 -0.14 4.03 2.12 -1.26 -5.17 118.70 115.73 3d29 s GLU 216 Ca -0.01 -1.12 -0.34 0.00 0.36 0.00 0.00 54.97 53.86 3d29 s GLU 216 Cb -0.01 0.29 0.14 0.00 0.26 0.00 0.00 34.13 34.81 3d29 s GLU 216 CO -0.09 -0.23 1.31 -1.54 -0.54 0.00 0.00 175.26 174.17 3d29 s SER 217 N -2.91 -0.06 0.18 -1.70 1.04 -1.26 -5.16 113.70 103.82 3d29 s SER 217 Ca 0.09 -0.04 -0.03 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 -0.17 0.40 -0.63 0.98 0.00 0.00 173.24 173.74 3d29 s ILE 218 N -2.27 5.17 -0.08 -1.02 -1.09 -1.26 -5.10 121.20 115.56 3d29 s ILE 218 Ca 0.12 -0.15 0.02 0.00 -2.23 0.00 0.00 60.65 58.41 3d29 s ILE 218 Cb 0.02 -3.68 -0.02 0.00 -1.58 0.00 0.00 42.46 37.20 3d29 s ILE 218 CO -0.04 -0.09 -0.13 -0.69 -1.23 0.00 0.00 174.94 172.75 3d29 s VAL 219 N -1.80 3.11 -0.24 2.92 1.01 -1.26 -5.09 120.40 119.06 3d29 s VAL 219 Ca 0.40 -0.68 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 3d29 s VAL 219 Cb -0.11 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 3d29 s VAL 219 CO 0.27 0.57 0.82 0.21 0.00 0.00 0.00 175.10 176.97 3d29 s ASN 220 N -0.38 6.82 -0.18 3.32 2.47 -1.26 -4.90 114.94 120.83 3d29 s ASN 220 Ca 0.04 1.02 0.05 0.00 0.42 0.00 0.00 52.86 54.39 3d29 s ASN 220 Cb -0.12 -2.43 -0.15 0.00 -1.45 0.00 0.00 41.25 37.10 3d29 s ASN 220 CO 0.02 -0.50 -0.11 -0.38 -3.72 0.00 0.00 177.10 172.41 3d29 n ILE 221 N 5.24 1.10 -2.10 -5.21 2.08 -1.26 -5.00 119.36 114.22 3d29 n ILE 221 Ca 0.05 -0.50 -0.41 0.00 0.56 0.00 0.00 62.75 62.46 3d29 n ILE 221 Cb 0.48 -1.01 -0.02 0.00 -0.75 0.00 0.00 39.64 38.33 3d29 n ILE 221 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11