#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ht0 s VAL 2 N 0.00 4.92 -0.11 12.58 1.01 -1.26 -0.59 120.40 136.95 3ht0 s VAL 2 Ca 0.00 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.20 3ht0 s VAL 2 Cb 0.00 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 3ht0 s VAL 2 CO 0.00 -0.38 0.16 0.00 0.00 0.00 0.00 175.10 174.88 3ht0 s ALA 3 N 2.61 3.86 -0.22 5.51 0.00 0.55 -0.77 121.76 133.30 3ht0 s ALA 3 Ca 0.21 -0.61 -0.05 0.00 0.00 0.00 0.00 51.96 51.51 3ht0 s ALA 3 Cb -0.15 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 3ht0 s ALA 3 CO 0.16 0.58 0.00 0.71 0.00 0.00 0.00 175.76 177.21 3ht0 s TYR 4 N -0.96 3.02 -0.13 0.00 2.02 -0.13 -0.27 117.35 120.91 3ht0 s TYR 4 Ca 0.15 -0.58 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 3ht0 s TYR 4 Cb -0.12 -2.12 -0.02 0.00 -0.40 0.00 0.00 41.96 39.30 3ht0 s TYR 4 CO 0.04 -0.35 -0.10 0.42 -1.57 0.00 0.00 175.55 174.00 3ht0 s ILE 5 N 1.25 3.33 -0.06 2.71 1.01 -0.07 -0.23 121.20 129.15 3ht0 s ILE 5 Ca 0.04 -0.56 -0.22 0.00 0.00 0.00 0.00 60.65 59.90 3ht0 s ILE 5 Cb -0.15 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 3ht0 s ILE 5 CO 0.01 0.52 0.63 0.00 0.00 0.00 0.00 174.94 176.10 3ht0 s ALA 6 N 0.28 3.40 -0.17 9.38 0.00 0.67 -0.79 121.76 134.52 3ht0 s ALA 6 Ca -0.07 0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.94 3ht0 s ALA 6 Cb -0.15 -2.84 0.02 0.00 0.00 0.00 0.00 23.12 20.15 3ht0 s ALA 6 CO 0.05 -0.01 -0.18 -1.50 0.00 0.00 0.00 175.76 174.11 3ht0 s ILE 7 N 0.51 1.93 0.03 0.00 2.07 -0.33 -1.59 121.20 123.82 3ht0 s ILE 7 Ca 0.34 -0.87 0.07 0.00 -1.41 0.00 0.00 60.65 58.77 3ht0 s ILE 7 Cb -0.17 -1.76 -0.02 0.00 0.13 0.00 0.00 42.46 40.63 3ht0 s ILE 7 CO 0.16 0.50 -0.19 -0.83 -1.91 0.00 0.00 174.94 172.67 3ht0 s GLY 8 N 1.34 1.03 -0.04 1.50 0.00 -0.43 -0.88 107.32 109.84 3ht0 s GLY 8 Ca 0.05 -0.98 -0.03 0.00 0.00 0.00 0.00 44.72 43.75 3ht0 s GLY 8 CO -0.12 -0.91 0.11 -0.45 0.00 0.00 0.00 173.10 171.73 3ht0 s SER 9 N -1.07 -0.10 -0.22 1.64 0.15 -0.40 -0.69 113.70 113.01 3ht0 s SER 9 Ca 0.06 0.22 0.13 0.00 0.70 0.00 0.00 55.95 57.07 3ht0 s SER 9 Cb -0.08 0.19 0.45 0.00 -1.71 0.00 0.00 66.02 64.87 3ht0 s SER 9 CO 0.01 -0.07 1.34 -0.46 1.20 0.00 0.00 173.24 175.26 3ht0 n ASN 10 N 3.37 2.58 -4.76 5.45 2.04 -1.09 -0.68 115.26 122.17 3ht0 n ASN 10 Ca -0.16 -3.50 -0.37 0.00 -0.44 0.00 0.00 54.58 50.10 3ht0 n ASN 10 Cb 0.57 -0.55 0.02 0.00 -2.53 0.00 0.00 39.78 37.29 3ht0 n ASN 10 CO 0.00 0.00 0.00 -0.22 -0.44 0.00 0.00 177.26 176.60 3ht0 s LEU 11 N -3.08 3.90 0.27 -4.53 2.96 -1.26 -4.57 118.68 112.37 3ht0 s LEU 11 Ca 0.40 2.49 -0.01 0.00 -0.22 0.00 0.00 54.13 56.79 3ht0 s LEU 11 Cb 0.36 -4.31 0.47 0.00 0.50 0.00 0.00 46.19 43.21 3ht0 s LEU 11 CO 0.01 -1.27 1.85 0.00 -1.32 0.00 0.00 176.35 175.62 3ht0 h ALA 12 N 1.65 1.42 -3.01 5.97 0.00 -1.95 -3.25 119.26 120.08 3ht0 h ALA 12 Ca -0.50 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 3ht0 h ALA 12 Cb 1.27 -0.24 -0.40 0.00 0.00 0.00 0.00 17.79 18.42 3ht0 h ALA 12 CO 0.58 0.30 -0.71 0.45 0.00 0.00 0.00 179.25 179.88 3ht0 s SER 13 N -5.77 3.78 0.00 0.00 0.15 -1.26 -4.95 113.70 105.66 3ht0 s SER 13 Ca -0.12 -3.03 0.27 0.00 0.70 0.00 0.00 55.95 53.77 3ht0 s SER 13 Cb 0.21 -1.22 0.91 0.00 -1.71 0.00 0.00 66.02 64.22 3ht0 s SER 13 CO 0.81 -0.21 1.66 -0.81 1.20 0.00 0.00 173.24 175.89 3ht0 n PRO 14 N 3.03 0.84 -0.25 5.44 -0.04 -1.23 -4.44 135.00 138.36 3ht0 n PRO 14 Ca 0.13 -0.44 -0.05 0.00 -0.04 0.00 0.00 63.50 63.09 3ht0 n PRO 14 Cb 0.36 -1.49 0.05 0.00 -0.04 0.00 0.00 33.50 32.38 3ht0 n PRO 14 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3ht0 h LEU 15 N 1.08 0.81 -0.62 1.53 3.38 -1.94 -1.02 115.31 118.52 3ht0 h LEU 15 Ca 0.00 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 3ht0 h LEU 15 Cb 0.46 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3ht0 h LEU 15 CO 0.00 0.61 -0.10 -0.33 0.09 0.00 0.00 178.44 178.71 3ht0 h GLU 16 N 0.93 0.98 -0.52 1.13 4.39 -2.00 -1.08 114.58 118.42 3ht0 h GLU 16 Ca 0.25 -0.35 -0.06 0.00 0.34 0.00 0.00 59.36 59.54 3ht0 h GLU 16 Cb -0.07 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 3ht0 h GLU 16 CO -0.05 1.03 0.09 0.37 -1.16 0.00 0.00 179.01 179.29 3ht0 h GLN 17 N 0.88 0.85 -0.65 2.33 4.15 -1.75 -1.25 115.11 119.67 3ht0 h GLN 17 Ca 0.14 -0.23 -0.05 0.00 0.77 0.00 0.00 58.65 59.29 3ht0 h GLN 17 Cb 0.65 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.21 3ht0 h GLN 17 CO 0.05 0.84 0.21 0.28 -1.93 0.00 0.00 178.83 178.27 3ht0 h VAL 18 N 0.74 1.25 0.00 2.39 2.07 -1.03 -1.04 116.25 120.63 3ht0 h VAL 18 Ca 0.16 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.75 3ht0 h VAL 18 Cb 0.39 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3ht0 h VAL 18 CO 0.01 0.32 -0.42 0.78 0.02 0.00 0.00 177.57 178.28 3ht0 h ASN 19 N 0.93 0.00 -0.34 0.57 2.35 -1.08 0.05 115.58 118.06 3ht0 h ASN 19 Ca 0.21 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.82 3ht0 h ASN 19 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3ht0 h ASN 19 CO -0.01 0.42 -0.33 0.00 -1.65 0.00 0.00 177.43 175.87 3ht0 h ALA 20 N 1.58 0.49 -0.51 -0.83 0.00 -0.99 -2.14 119.26 116.87 3ht0 h ALA 20 Ca -0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 3ht0 h ALA 20 Cb 0.96 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3ht0 h ALA 20 CO 0.05 0.54 0.13 0.00 0.00 0.00 0.00 179.25 179.98 3ht0 h ALA 21 N 0.74 0.67 -0.46 0.00 0.00 -0.88 -1.65 119.26 117.68 3ht0 h ALA 21 Ca 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3ht0 h ALA 21 Cb 0.91 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3ht0 h ALA 21 CO 0.08 0.36 0.26 -0.07 0.00 0.00 0.00 179.25 179.87 3ht0 h LEU 22 N 0.70 0.57 -0.50 0.00 3.38 -1.00 0.21 115.31 118.66 3ht0 h LEU 22 Ca 0.16 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3ht0 h LEU 22 Cb 0.33 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3ht0 h LEU 22 CO 0.00 0.48 0.32 0.50 0.09 0.00 0.00 178.44 179.83 3ht0 h LYS 23 N 0.60 0.62 -0.75 1.13 3.64 -1.30 -2.30 116.57 118.22 3ht0 h LYS 23 Ca 0.16 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 3ht0 h LYS 23 Cb 0.04 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 3ht0 h LYS 23 CO -0.03 0.41 0.39 0.00 -2.27 0.00 0.00 179.45 177.95 3ht0 h ALA 24 N 1.20 1.27 -1.00 5.00 0.00 -0.93 -2.01 119.26 122.79 3ht0 h ALA 24 Ca 0.19 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3ht0 h ALA 24 Cb -0.03 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 3ht0 h ALA 24 CO -0.06 0.58 0.66 -0.07 0.00 0.00 0.00 179.25 180.36 3ht0 h LEU 25 N 1.05 1.12 -1.22 0.00 3.38 -0.56 -1.54 115.31 117.54 3ht0 h LEU 25 Ca 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3ht0 h LEU 25 Cb 0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.55 3ht0 h LEU 25 CO -0.04 0.79 0.00 1.23 0.09 0.00 0.00 178.44 180.51 3ht0 h GLY 26 N 1.31 0.00 -0.47 0.83 0.00 -0.82 -2.60 103.07 101.31 3ht0 h GLY 26 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 3ht0 h GLY 26 CO -0.11 0.00 -0.22 1.22 0.00 0.00 0.00 176.54 177.43 3ht0 n ASP 27 N -2.63 1.60 -4.75 0.19 8.00 -0.59 -4.76 116.55 113.62 3ht0 n ASP 27 Ca 0.01 -1.31 -0.41 0.00 0.71 0.00 0.00 54.79 53.79 3ht0 n ASP 27 Cb 0.23 0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.48 3ht0 n ASP 27 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ht0 s ILE 28 N -2.32 2.32 0.66 0.53 1.01 -0.98 -4.95 121.20 117.47 3ht0 s ILE 28 Ca 0.26 0.27 -0.17 0.00 0.00 0.00 0.00 60.65 61.01 3ht0 s ILE 28 Cb 0.19 -3.17 -0.00 0.00 0.01 0.00 0.00 42.46 39.49 3ht0 s ILE 28 CO 0.47 0.04 1.25 -2.65 0.00 0.00 0.00 174.94 174.05 3ht0 n PRO 29 N 2.36 0.99 -2.21 2.79 -0.02 -1.26 -3.03 135.00 134.62 3ht0 n PRO 29 Ca 0.08 0.39 -0.15 0.00 -2.02 0.00 0.00 63.50 61.80 3ht0 n PRO 29 Cb 0.38 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.35 3ht0 n PRO 29 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3ht0 n GLU 30 N -1.99 -1.89 -3.87 -0.52 1.02 -1.26 -4.80 120.64 107.33 3ht0 n GLU 30 Ca 0.16 0.77 -0.09 0.00 -0.02 0.00 0.00 57.16 57.97 3ht0 n GLU 30 Cb 0.48 -5.31 -0.07 0.00 -0.02 0.00 0.00 31.44 26.52 3ht0 n GLU 30 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3ht0 s SER 31 N -2.09 0.13 -0.08 1.62 0.01 -1.17 -1.14 113.70 110.99 3ht0 s SER 31 Ca 0.00 -0.68 -0.29 0.00 1.31 0.00 0.00 55.95 56.29 3ht0 s SER 31 Cb 0.00 0.34 0.07 0.00 0.21 0.00 0.00 66.02 66.64 3ht0 s SER 31 CO 0.00 -0.73 0.67 -1.38 0.41 0.00 0.00 173.24 172.21 3ht0 s HIS 32 N -3.87 -0.66 0.17 2.43 -3.43 0.03 -4.77 115.29 105.18 3ht0 s HIS 32 Ca 0.06 1.20 -0.31 0.00 -0.80 0.00 0.00 55.06 55.22 3ht0 s HIS 32 Cb 0.05 0.38 -0.08 0.00 -1.43 0.00 0.00 32.58 31.49 3ht0 s HIS 32 CO -0.10 -0.57 1.34 0.42 -2.00 0.00 0.00 174.74 173.83 3ht0 s ILE 33 N -0.98 3.24 -0.21 -5.38 1.01 -1.26 -0.96 121.20 116.66 3ht0 s ILE 33 Ca -0.10 0.96 -0.07 0.00 0.00 0.00 0.00 60.65 61.45 3ht0 s ILE 33 Cb -0.01 -3.62 -0.19 0.00 0.01 0.00 0.00 42.46 38.65 3ht0 s ILE 33 CO 0.09 0.12 -0.00 0.18 0.00 0.00 0.00 174.94 175.32 3ht0 n LEU 34 N 3.14 2.52 -3.50 2.97 4.77 0.66 -4.88 117.00 122.68 3ht0 n LEU 34 Ca 0.08 0.14 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 3ht0 n LEU 34 Cb 0.43 -0.97 -0.04 0.00 -2.33 0.00 0.00 43.42 40.51 3ht0 n LEU 34 CO 0.58 0.75 0.50 -0.89 -1.33 0.00 0.00 177.39 177.00 3ht0 s THR 35 N -2.51 0.00 -0.04 -5.08 2.01 -1.19 -5.01 115.64 103.83 3ht0 s THR 35 Ca -0.31 0.00 0.04 0.00 0.31 0.00 0.00 61.69 61.73 3ht0 s THR 35 Cb 0.09 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.60 3ht0 s THR 35 CO 0.63 0.00 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.72 3ht0 s VAL 36 N -2.13 1.23 0.93 3.82 1.01 -1.26 -1.05 120.40 122.96 3ht0 s VAL 36 Ca -0.05 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 3ht0 s VAL 36 Cb -0.00 -1.07 0.15 0.00 0.00 0.00 0.00 36.38 35.45 3ht0 s VAL 36 CO 0.00 0.36 1.14 -0.94 0.00 0.00 0.00 175.10 175.67 3ht0 s SER 37 N 0.14 3.32 1.09 3.32 1.04 -0.11 -5.02 113.70 117.49 3ht0 s SER 37 Ca -0.05 0.93 -0.13 0.00 0.48 0.00 0.00 55.95 57.19 3ht0 s SER 37 Cb -0.11 -1.48 0.24 0.00 0.10 0.00 0.00 66.02 64.77 3ht0 s SER 37 CO 0.02 -2.66 1.06 -0.44 0.98 0.00 0.00 173.24 172.19 3ht0 s SER 38 N -4.02 1.69 -0.16 7.02 0.01 -1.26 -4.75 113.70 112.22 3ht0 s SER 38 Ca 0.65 1.39 -0.13 0.00 1.31 0.00 0.00 55.95 59.16 3ht0 s SER 38 Cb -0.14 -2.12 -0.05 0.00 0.21 0.00 0.00 66.02 63.92 3ht0 s SER 38 CO 0.54 -3.74 0.26 -0.36 0.41 0.00 0.00 173.24 170.35 3ht0 s PHE 39 N -2.68 3.47 -0.01 2.43 0.08 -1.26 -4.59 117.98 115.42 3ht0 s PHE 39 Ca 0.67 0.56 0.06 0.00 0.12 0.00 0.00 56.93 58.34 3ht0 s PHE 39 Cb -0.22 -2.29 -0.03 0.00 -0.57 0.00 0.00 43.02 39.91 3ht0 s PHE 39 CO 0.61 0.28 -0.20 0.71 -0.10 0.00 0.00 175.22 176.53 3ht0 s TYR 40 N 0.34 2.52 -0.19 0.36 2.02 -0.00 0.03 117.35 122.44 3ht0 s TYR 40 Ca 0.15 -0.29 -0.09 0.00 -0.37 0.00 0.00 57.07 56.48 3ht0 s TYR 40 Cb -0.13 -1.52 -0.05 0.00 -0.40 0.00 0.00 41.96 39.87 3ht0 s TYR 40 CO 0.03 0.14 0.10 0.50 -1.57 0.00 0.00 175.55 174.76 3ht0 s ARG 41 N -0.96 4.06 -0.07 -0.62 3.52 0.24 -0.62 118.95 124.50 3ht0 s ARG 41 Ca 0.12 -0.26 0.01 0.00 -0.13 0.00 0.00 55.73 55.47 3ht0 s ARG 41 Cb -0.10 -3.32 0.02 0.00 -1.56 0.00 0.00 34.95 29.98 3ht0 s ARG 41 CO 0.02 0.32 -0.09 0.95 -0.81 0.00 0.00 175.30 175.68 3ht0 s THR 42 N 0.27 0.97 0.77 4.11 -4.23 -0.69 -4.22 115.64 112.62 3ht0 s THR 42 Ca 0.07 -0.35 -0.15 0.00 -1.18 0.00 0.00 61.69 60.07 3ht0 s THR 42 Cb -0.12 -0.93 0.01 0.00 1.34 0.00 0.00 72.50 72.81 3ht0 s THR 42 CO -0.01 0.33 0.81 -2.65 -0.54 0.00 0.00 174.62 172.56 3ht0 n PRO 43 N 4.13 0.28 -0.79 3.99 -0.02 -1.26 -0.29 135.00 141.03 3ht0 n PRO 43 Ca -0.21 0.15 -0.31 0.00 -2.02 0.00 0.00 63.50 61.12 3ht0 n PRO 43 Cb 0.51 -2.10 0.16 0.00 -0.02 0.00 0.00 33.50 32.06 3ht0 n PRO 43 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3ht0 s PRO 44 N -3.35 1.00 0.23 0.52 0.04 -1.26 -4.66 135.00 127.52 3ht0 s PRO 44 Ca 0.69 1.38 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 3ht0 s PRO 44 Cb -0.32 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.40 3ht0 s PRO 44 CO 0.55 -2.59 0.90 -0.51 0.04 0.00 0.00 177.00 175.39 3ht0 s LEU 45 N -6.55 4.62 0.00 -3.56 1.43 -1.26 -4.85 118.68 108.51 3ht0 s LEU 45 Ca 0.66 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 3ht0 s LEU 45 Cb -0.22 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.44 3ht0 s LEU 45 CO 0.58 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.93 3ht0 n GLY 46 N 1.45 1.38 3.63 -3.19 0.00 -1.26 -4.69 105.19 102.51 3ht0 n GLY 46 Ca -0.03 0.48 -0.46 0.00 0.00 0.00 0.00 46.02 46.01 3ht0 n GLY 46 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ht0 n PRO 47 N 0.00 1.69 0.00 1.61 -0.02 -1.26 -4.87 135.00 132.14 3ht0 n PRO 47 Ca 0.00 0.60 0.15 0.00 -2.02 0.00 0.00 63.50 62.23 3ht0 n PRO 47 Cb 0.00 -2.19 0.83 0.00 -0.02 0.00 0.00 33.50 32.12 3ht0 n PRO 47 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3ht0 n GLN 48 N 1.89 0.71 -0.24 -0.52 6.02 -1.26 -3.82 117.38 120.15 3ht0 n GLN 48 Ca 0.13 0.01 -0.06 0.00 -0.01 0.00 0.00 57.00 57.07 3ht0 n GLN 48 Cb 0.29 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.10 3ht0 n GLN 48 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 3ht0 h ASP 49 N 0.00 0.80 -4.17 1.08 3.32 -1.93 -3.44 116.42 112.09 3ht0 h ASP 49 Ca 0.00 -0.06 -0.52 0.00 0.02 0.00 0.00 57.03 56.46 3ht0 h ASP 49 Cb 0.13 -0.20 0.13 0.00 0.22 0.00 0.00 39.33 39.60 3ht0 h ASP 49 CO 0.00 0.63 0.40 -1.10 -1.72 0.00 0.00 179.24 177.45 3ht0 s GLN 50 N -5.97 2.55 0.83 3.56 -0.21 -1.25 -5.01 119.66 114.15 3ht0 s GLN 50 Ca -0.13 1.64 -0.11 0.00 0.02 0.00 0.00 55.36 56.78 3ht0 s GLN 50 Cb 0.14 -1.90 0.09 0.00 1.00 0.00 0.00 33.01 32.34 3ht0 s GLN 50 CO 0.78 -1.49 1.10 -2.14 -2.12 0.00 0.00 175.29 171.41 3ht0 s PRO 51 N -3.85 1.79 0.71 2.91 0.02 -1.26 -4.59 135.00 130.73 3ht0 s PRO 51 Ca 0.72 1.15 -0.15 0.00 0.02 0.00 0.00 61.00 62.75 3ht0 s PRO 51 Cb -0.26 -1.84 0.03 0.00 0.02 0.00 0.00 34.50 32.44 3ht0 s PRO 51 CO 0.41 -1.97 1.16 -0.51 -0.33 0.00 0.00 177.00 175.77 3ht0 s ASP 52 N -3.26 4.50 0.19 2.53 1.01 -1.26 -4.10 116.67 116.27 3ht0 s ASP 52 Ca 0.63 2.20 -0.18 0.00 0.71 0.00 0.00 52.55 55.90 3ht0 s ASP 52 Cb -0.18 -2.57 -0.08 0.00 1.01 0.00 0.00 42.92 41.10 3ht0 s ASP 52 CO 0.57 -2.05 0.66 -0.31 0.21 0.00 0.00 175.17 174.25 3ht0 s TYR 53 N -2.17 3.66 -0.23 4.23 2.02 0.60 -4.58 117.35 120.88 3ht0 s TYR 53 Ca 0.71 1.29 -0.08 0.00 -0.37 0.00 0.00 57.07 58.62 3ht0 s TYR 53 Cb -0.25 -2.54 -0.04 0.00 -0.40 0.00 0.00 41.96 38.73 3ht0 s TYR 53 CO 0.44 0.39 0.09 -1.17 -1.57 0.00 0.00 175.55 173.73 3ht0 s LEU 54 N -1.87 3.66 0.01 -1.29 0.20 0.14 -1.71 118.68 117.83 3ht0 s LEU 54 Ca 0.40 -0.08 0.06 0.00 0.69 0.00 0.00 54.13 55.20 3ht0 s LEU 54 Cb -0.17 -1.97 -0.02 0.00 -0.43 0.00 0.00 46.19 43.60 3ht0 s LEU 54 CO 0.20 0.03 -0.19 0.20 -0.29 0.00 0.00 176.35 176.31 3ht0 s ASN 55 N 1.24 2.22 0.27 3.68 0.01 0.21 -1.28 114.94 121.29 3ht0 s ASN 55 Ca 0.05 -0.40 -0.08 0.00 -0.71 0.00 0.00 52.86 51.73 3ht0 s ASN 55 Cb -0.14 -0.22 -0.01 0.00 0.41 0.00 0.00 41.25 41.29 3ht0 s ASN 55 CO 0.04 0.20 0.42 0.00 -1.51 0.00 0.00 177.10 176.25 3ht0 s ALA 56 N -0.57 0.27 -0.01 0.60 0.00 -0.06 -0.82 121.76 121.18 3ht0 s ALA 56 Ca 0.07 -1.19 0.03 0.00 0.00 0.00 0.00 51.96 50.87 3ht0 s ALA 56 Cb -0.08 1.14 -0.01 0.00 0.00 0.00 0.00 23.12 24.18 3ht0 s ALA 56 CO 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 175.76 174.86 3ht0 s ALA 57 N -3.76 0.88 -0.06 0.00 0.00 -1.26 -1.18 121.76 116.38 3ht0 s ALA 57 Ca 0.27 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.80 3ht0 s ALA 57 Cb 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3ht0 s ALA 57 CO 0.13 0.21 -0.17 0.08 0.00 0.00 0.00 175.76 176.01 3ht0 s VAL 58 N -0.28 1.45 -0.28 0.00 1.01 0.03 -0.93 120.40 121.39 3ht0 s VAL 58 Ca 0.04 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 3ht0 s VAL 58 Cb -0.04 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 3ht0 s VAL 58 CO -0.00 0.42 0.42 0.00 0.00 0.00 0.00 175.10 175.94 3ht0 s ALA 59 N 0.24 3.55 -0.19 5.51 0.00 -0.21 -0.89 121.76 129.77 3ht0 s ALA 59 Ca -0.09 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.06 3ht0 s ALA 59 Cb -0.14 -2.79 0.02 0.00 0.00 0.00 0.00 23.12 20.21 3ht0 s ALA 59 CO 0.04 -0.77 -0.18 -1.17 0.00 0.00 0.00 175.76 173.67 3ht0 s LEU 60 N 2.16 2.35 -0.05 0.00 2.96 0.63 -0.25 118.68 126.49 3ht0 s LEU 60 Ca 0.17 -0.74 -0.29 0.00 -0.22 0.00 0.00 54.13 53.05 3ht0 s LEU 60 Cb -0.16 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.00 3ht0 s LEU 60 CO 0.10 -0.03 0.95 -0.70 -1.32 0.00 0.00 176.35 175.35 3ht0 s GLU 61 N 1.28 4.49 -0.05 1.98 2.56 -0.13 -0.33 118.70 128.50 3ht0 s GLU 61 Ca 0.03 1.32 -0.12 0.00 0.00 0.00 0.00 54.97 56.20 3ht0 s GLU 61 Cb -0.14 -3.49 0.02 0.00 2.00 0.00 0.00 34.13 32.52 3ht0 s GLU 61 CO -0.11 -0.13 0.28 -0.08 -0.56 0.00 0.00 175.26 174.66 3ht0 s THR 62 N 1.33 0.04 -1.93 -1.70 -1.32 0.24 -0.79 115.64 111.51 3ht0 s THR 62 Ca 0.48 -0.34 0.18 0.00 -1.21 0.00 0.00 61.69 60.81 3ht0 s THR 62 Cb -0.20 -0.52 0.35 0.00 -1.51 0.00 0.00 72.50 70.63 3ht0 s THR 62 CO 0.23 -0.19 1.28 -1.54 -2.21 0.00 0.00 174.62 172.19 3ht0 n SER 63 N 1.87 3.13 -4.78 8.08 3.41 -0.29 -1.23 113.62 123.81 3ht0 n SER 63 Ca -0.19 -1.90 -0.33 0.00 -0.26 0.00 0.00 58.87 56.19 3ht0 n SER 63 Cb 0.57 -0.22 0.03 0.00 -0.26 0.00 0.00 64.21 64.33 3ht0 n SER 63 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ht0 s LEU 64 N -1.26 3.47 0.67 1.04 1.43 -1.26 -5.02 118.68 117.75 3ht0 s LEU 64 Ca 0.32 1.99 -0.14 0.00 -1.03 0.00 0.00 54.13 55.27 3ht0 s LEU 64 Cb 0.18 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.85 3ht0 s LEU 64 CO 0.25 -1.47 1.09 0.00 0.23 0.00 0.00 176.35 176.45 3ht0 s ALA 65 N -2.26 2.53 0.21 4.21 0.00 -1.26 -4.84 121.76 120.34 3ht0 s ALA 65 Ca 0.67 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 3ht0 s ALA 65 Cb -0.20 -3.27 0.26 0.00 0.00 0.00 0.00 23.12 19.91 3ht0 s ALA 65 CO 0.38 -1.25 1.77 -1.35 0.00 0.00 0.00 175.76 175.32 3ht0 h PRO 66 N -0.21 0.51 0.00 0.00 0.11 -1.99 -0.96 132.00 129.45 3ht0 h PRO 66 Ca -0.46 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 3ht0 h PRO 66 Cb 1.23 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3ht0 h PRO 66 CO 0.55 0.34 -0.34 1.05 -0.21 0.00 0.00 178.00 179.39 3ht0 h GLU 67 N 0.53 0.00 -0.48 1.05 9.09 -1.99 -1.46 114.58 121.31 3ht0 h GLU 67 Ca 0.30 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.61 3ht0 h GLU 67 Cb 0.29 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.38 3ht0 h GLU 67 CO -0.24 0.34 -0.08 0.93 0.05 0.00 0.00 179.01 180.00 3ht0 h GLU 68 N 0.00 0.91 -0.69 1.06 5.08 -1.69 -1.36 114.58 117.89 3ht0 h GLU 68 Ca -0.00 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 3ht0 h GLU 68 Cb 0.98 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 3ht0 h GLU 68 CO 0.04 0.98 0.33 1.25 -1.00 0.00 0.00 179.01 180.62 3ht0 h LEU 69 N 0.76 0.90 -0.94 1.33 5.85 -0.84 -2.72 115.31 119.64 3ht0 h LEU 69 Ca 0.13 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3ht0 h LEU 69 Cb 0.62 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 3ht0 h LEU 69 CO 0.04 0.77 0.55 0.25 -0.34 0.00 0.00 178.44 179.71 3ht0 h LEU 70 N 0.95 1.14 -0.73 2.25 5.85 -1.11 -0.69 115.31 122.97 3ht0 h LEU 70 Ca 0.24 -0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.98 3ht0 h LEU 70 Cb 0.11 -0.29 -0.08 0.00 0.37 0.00 0.00 40.66 40.78 3ht0 h LEU 70 CO -0.03 0.89 0.36 0.78 -0.34 0.00 0.00 178.44 180.10 3ht0 h ASN 71 N 1.30 0.45 -0.24 1.25 2.35 -0.96 0.28 115.58 120.01 3ht0 h ASN 71 Ca 0.33 0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 56.03 3ht0 h ASN 71 Cb -0.03 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.33 3ht0 h ASN 71 CO -0.06 0.24 -0.32 0.45 -1.65 0.00 0.00 177.43 176.09 3ht0 h HIS 72 N 0.59 0.78 -0.46 1.19 3.86 -1.01 -0.43 115.15 119.67 3ht0 h HIS 72 Ca 0.37 -0.25 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 3ht0 h HIS 72 Cb 0.42 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.71 3ht0 h HIS 72 CO -0.11 0.99 0.03 1.79 0.86 0.00 0.00 177.93 181.50 3ht0 h THR 73 N 0.34 1.23 -0.20 2.45 1.35 -0.89 -0.65 112.91 116.53 3ht0 h THR 73 Ca 0.03 -0.89 -0.16 0.00 -0.55 0.00 0.00 66.41 64.84 3ht0 h THR 73 Cb 0.90 0.84 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 3ht0 h THR 73 CO 0.08 0.32 -0.52 1.56 -0.25 0.00 0.00 175.52 176.70 3ht0 h GLN 74 N 0.69 0.58 -0.44 4.72 4.20 -0.86 -1.59 115.11 122.41 3ht0 h GLN 74 Ca 0.14 -0.35 0.01 0.00 0.06 0.00 0.00 58.65 58.51 3ht0 h GLN 74 Cb 0.38 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 3ht0 h GLN 74 CO 0.01 0.96 0.28 -0.09 -0.67 0.00 0.00 178.83 179.32 3ht0 h ARG 75 N 0.45 0.55 -0.77 1.46 2.43 -0.68 -1.65 114.38 116.16 3ht0 h ARG 75 Ca 0.02 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3ht0 h ARG 75 Cb 1.06 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.45 3ht0 h ARG 75 CO 0.10 0.36 0.37 0.82 -1.51 0.00 0.00 179.97 180.12 3ht0 h ILE 76 N 0.56 1.24 -0.72 1.20 2.04 -0.87 0.62 117.51 121.59 3ht0 h ILE 76 Ca 0.17 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 3ht0 h ILE 76 Cb -0.03 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 3ht0 h ILE 76 CO -0.06 0.29 0.38 -0.33 0.00 0.00 0.00 178.15 178.43 3ht0 h GLU 77 N 1.10 1.01 -0.39 2.37 5.08 -1.00 0.20 114.58 122.95 3ht0 h GLU 77 Ca 0.27 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3ht0 h GLU 77 Cb 0.11 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3ht0 h GLU 77 CO -0.03 0.76 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.57 3ht0 h LEU 78 N 0.99 0.66 0.06 1.33 3.38 -0.52 0.89 115.31 122.09 3ht0 h LEU 78 Ca 0.25 -0.18 -0.30 0.00 0.09 0.00 0.00 57.88 57.74 3ht0 h LEU 78 Cb 0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3ht0 h LEU 78 CO -0.04 0.79 -1.58 1.56 0.09 0.00 0.00 178.44 179.26 3ht0 h GLN 79 N 0.62 0.13 0.00 1.13 4.20 -0.57 -3.40 115.11 117.22 3ht0 h GLN 79 Ca 0.11 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.59 3ht0 h GLN 79 Cb 0.53 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.40 3ht0 h GLN 79 CO 0.03 0.90 0.00 1.04 -0.67 0.00 0.00 178.83 180.13 3ht0 n GLN 80 N -3.30 0.68 0.04 1.46 1.13 0.66 -4.78 117.38 113.27 3ht0 n GLN 80 Ca -0.16 -0.30 0.13 0.00 -1.94 0.00 0.00 57.00 54.73 3ht0 n GLN 80 Cb 1.03 -0.77 0.49 0.00 0.11 0.00 0.00 30.24 31.11 3ht0 n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ht0 n GLY 81 N 0.18 -1.54 3.33 1.08 0.00 0.31 -4.77 105.19 103.78 3ht0 n GLY 81 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 3ht0 n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ht0 s ARG 82 N -3.04 1.92 -0.07 1.61 0.52 -1.26 -0.66 118.95 117.97 3ht0 s ARG 82 Ca 0.12 -1.04 0.02 0.00 -0.52 0.00 0.00 55.73 54.31 3ht0 s ARG 82 Cb 0.16 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.61 3ht0 s ARG 82 CO 0.58 0.53 -0.13 0.08 0.02 0.00 0.00 175.30 176.37 3ht0 s VAL 83 N -0.73 3.11 -0.00 3.52 1.01 -1.26 -4.91 120.40 121.14 3ht0 s VAL 83 Ca 0.11 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 3ht0 s VAL 83 Cb -0.10 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 3ht0 s VAL 83 CO 0.01 0.57 1.15 -0.60 0.00 0.00 0.00 175.10 176.23 3ht0 s ARG 84 N -0.45 4.42 0.01 2.72 6.06 -1.26 -0.43 118.95 130.03 3ht0 s ARG 84 Ca 0.06 1.65 0.00 0.00 -2.50 0.00 0.00 55.73 54.94 3ht0 s ARG 84 Cb -0.12 -3.46 0.00 0.00 0.06 0.00 0.00 34.95 31.44 3ht0 s ARG 84 CO 0.02 -0.30 0.02 1.63 -2.50 0.00 0.00 175.30 174.17 3ht0 n LYS 85 N 4.45 0.82 0.00 5.12 5.02 0.19 -4.90 118.16 128.87 3ht0 n LYS 85 Ca 0.09 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3ht0 n LYS 85 Cb 0.47 -0.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 3ht0 n LYS 85 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ht0 n ALA 86 N -2.99 -0.08 -0.87 7.82 0.00 -1.26 -3.56 120.51 119.57 3ht0 n ALA 86 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3ht0 n ALA 86 Cb 0.01 0.33 0.17 0.00 0.00 0.00 0.00 19.45 19.96 3ht0 n ALA 86 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ht0 n GLU 87 N -2.23 2.12 -3.70 0.00 4.71 -1.26 -5.01 120.64 115.27 3ht0 n GLU 87 Ca 0.00 -2.51 -0.14 0.00 -0.01 0.00 0.00 57.16 54.50 3ht0 n GLU 87 Cb 0.00 -1.54 -0.08 0.00 -1.01 0.00 0.00 31.44 28.80 3ht0 n GLU 87 CO 0.00 0.00 0.00 -0.98 0.09 0.00 0.00 177.13 176.24 3ht0 s ARG 88 N -2.53 0.72 0.10 3.49 1.70 -1.23 -5.14 118.95 116.06 3ht0 s ARG 88 Ca 0.31 0.07 -0.30 0.00 -0.47 0.00 0.00 55.73 55.34 3ht0 s ARG 88 Cb 0.26 0.33 -0.06 0.00 -0.57 0.00 0.00 34.95 34.91 3ht0 s ARG 88 CO 0.05 -0.19 1.02 -1.58 -1.08 0.00 0.00 175.30 173.53 3ht0 s TRP 89 N -0.98 3.69 1.02 5.89 0.52 -1.26 0.56 118.94 128.38 3ht0 s TRP 89 Ca -0.10 1.68 -0.16 0.00 0.02 0.00 0.00 56.10 57.54 3ht0 s TRP 89 Cb -0.04 -3.16 0.20 0.00 -1.15 0.00 0.00 33.47 29.33 3ht0 s TRP 89 CO 0.05 -0.18 1.20 0.20 0.02 0.00 0.00 176.95 178.24 3ht0 s GLY 90 N 0.30 1.66 0.94 0.98 0.00 0.43 -4.87 107.32 106.75 3ht0 s GLY 90 Ca 0.50 -0.91 -0.14 0.00 0.00 0.00 0.00 44.72 44.17 3ht0 s GLY 90 CO 0.30 -0.18 1.17 -4.14 0.00 0.00 0.00 173.10 170.26 3ht0 s PRO 91 N -5.56 0.88 0.12 2.90 0.02 -1.26 -4.45 135.00 127.66 3ht0 s PRO 91 Ca 0.70 0.10 -0.31 0.00 0.02 0.00 0.00 61.00 61.51 3ht0 s PRO 91 Cb -0.09 -1.83 -0.10 0.00 0.02 0.00 0.00 34.50 32.50 3ht0 s PRO 91 CO 0.54 -2.33 1.80 0.50 -0.33 0.00 0.00 177.00 177.18 3ht0 s ARG 92 N -5.44 4.14 0.00 5.54 3.52 -1.26 -4.48 118.95 120.97 3ht0 s ARG 92 Ca 0.66 2.57 0.00 0.00 -0.13 0.00 0.00 55.73 58.83 3ht0 s ARG 92 Cb -0.12 -3.56 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 3ht0 s ARG 92 CO 0.53 -0.82 0.33 0.25 -0.81 0.00 0.00 175.30 174.77 3ht0 n THR 93 N 4.68 0.00 -4.38 4.11 -2.24 0.17 -5.00 114.28 111.61 3ht0 n THR 93 Ca 0.17 -0.50 -0.34 0.00 -2.27 0.00 0.00 64.05 61.12 3ht0 n THR 93 Cb 0.38 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.49 3ht0 n THR 93 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3ht0 s LEU 94 N -0.72 3.27 -0.14 3.22 2.96 -1.20 -2.66 118.68 123.41 3ht0 s LEU 94 Ca 0.00 -0.12 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 3ht0 s LEU 94 Cb 0.00 -1.79 0.02 0.00 0.50 0.00 0.00 46.19 44.92 3ht0 s LEU 94 CO 0.00 0.17 -0.15 -0.62 -1.32 0.00 0.00 176.35 174.43 3ht0 s ASP 95 N 0.37 2.67 -0.28 3.68 2.15 0.13 -4.92 116.67 120.47 3ht0 s ASP 95 Ca -0.04 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.46 3ht0 s ASP 95 Cb -0.14 -1.19 0.05 0.00 -0.30 0.00 0.00 42.92 41.34 3ht0 s ASP 95 CO 0.03 -0.02 -0.04 -0.76 -0.17 0.00 0.00 175.17 174.20 3ht0 s LEU 96 N 1.29 3.72 -0.02 -1.34 1.43 -1.26 -1.32 118.68 121.18 3ht0 s LEU 96 Ca 0.01 -1.33 0.05 0.00 -1.03 0.00 0.00 54.13 51.83 3ht0 s LEU 96 Cb -0.14 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 3ht0 s LEU 96 CO -0.08 -0.23 -0.17 -1.81 0.23 0.00 0.00 176.35 174.30 3ht0 s ASP 97 N 1.19 3.86 -0.43 2.29 1.01 -0.62 -4.89 116.67 119.08 3ht0 s ASP 97 Ca -0.07 -0.29 -0.25 0.00 0.71 0.00 0.00 52.55 52.66 3ht0 s ASP 97 Cb -0.20 -0.73 0.02 0.00 1.01 0.00 0.00 42.92 43.03 3ht0 s ASP 97 CO -0.03 0.32 0.88 -0.63 0.21 0.00 0.00 175.17 175.92 3ht0 s ILE 98 N -0.77 4.55 -0.09 0.77 1.01 -1.26 -0.24 121.20 125.17 3ht0 s ILE 98 Ca 0.12 0.77 -0.26 0.00 0.00 0.00 0.00 60.65 61.28 3ht0 s ILE 98 Cb -0.10 -4.37 -0.26 0.00 0.01 0.00 0.00 42.46 37.73 3ht0 s ILE 98 CO 0.02 -0.72 0.89 0.24 0.00 0.00 0.00 174.94 175.37 3ht0 h MET 99 N 8.89 0.11 -3.60 2.79 2.86 -0.96 -3.35 114.93 121.67 3ht0 h MET 99 Ca -0.24 -0.15 -0.14 0.00 -2.06 0.00 0.00 59.70 57.10 3ht0 h MET 99 Cb 1.08 0.05 -0.20 0.00 0.06 0.00 0.00 31.60 32.59 3ht0 h MET 99 CO 0.99 1.00 -0.52 -0.51 1.06 0.00 0.00 176.91 178.94 3ht0 s LEU 100 N -8.29 1.66 -0.35 1.22 1.43 -1.12 -1.47 118.68 111.75 3ht0 s LEU 100 Ca -0.17 -0.29 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 3ht0 s LEU 100 Cb -0.01 0.61 0.12 0.00 0.03 0.00 0.00 46.19 46.93 3ht0 s LEU 100 CO 0.73 -0.39 0.16 0.12 0.23 0.00 0.00 176.35 177.20 3ht0 s PHE 101 N -1.58 1.44 0.00 0.29 2.19 -1.26 -0.96 117.98 118.11 3ht0 s PHE 101 Ca -0.14 -1.79 0.00 0.00 0.33 0.00 0.00 56.93 55.33 3ht0 s PHE 101 Cb -0.07 -1.53 0.00 0.00 -1.31 0.00 0.00 43.02 40.11 3ht0 s PHE 101 CO 0.00 -0.84 0.00 0.41 1.83 0.00 0.00 175.22 176.62 3ht0 n GLY 102 N 4.42 2.95 1.20 13.12 0.00 0.06 -1.27 105.19 125.66 3ht0 n GLY 102 Ca 0.03 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.96 3ht0 n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ht0 n ASN 103 N 2.29 4.23 -4.77 1.61 0.23 -1.26 -4.89 115.26 112.69 3ht0 n ASN 103 Ca 0.00 -2.62 -0.38 0.00 -0.53 0.00 0.00 54.58 51.05 3ht0 n ASN 103 Cb 0.00 -0.51 -0.02 0.00 -2.08 0.00 0.00 39.78 37.17 3ht0 n ASN 103 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 3ht0 s GLU 104 N -2.14 3.98 -0.23 -3.83 2.02 -0.40 -4.48 118.70 113.63 3ht0 s GLU 104 Ca 0.43 1.77 -0.07 0.00 0.02 0.00 0.00 54.97 57.12 3ht0 s GLU 104 Cb 0.30 -2.57 -0.03 0.00 0.10 0.00 0.00 34.13 31.93 3ht0 s GLU 104 CO 0.16 -0.36 0.05 0.08 0.02 0.00 0.00 175.26 175.21 3ht0 s VAL 105 N -1.49 4.26 -0.08 2.63 1.01 -1.26 -4.46 120.40 121.00 3ht0 s VAL 105 Ca 0.59 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.41 3ht0 s VAL 105 Cb -0.29 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.13 3ht0 s VAL 105 CO 0.36 0.38 -0.19 -0.63 0.00 0.00 0.00 175.10 175.01 3ht0 s ILE 106 N 1.27 1.67 -0.41 2.22 -1.09 0.06 -4.99 121.20 119.94 3ht0 s ILE 106 Ca 0.04 -0.80 0.04 0.00 -2.23 0.00 0.00 60.65 57.70 3ht0 s ILE 106 Cb -0.15 -1.47 0.17 0.00 -1.58 0.00 0.00 42.46 39.44 3ht0 s ILE 106 CO 0.03 0.47 0.34 0.20 -1.23 0.00 0.00 174.94 174.75 3ht0 s ASN 107 N 0.41 1.42 0.52 3.58 -0.87 -1.23 -1.08 114.94 117.70 3ht0 s ASN 107 Ca -0.16 -3.07 0.01 0.00 -1.57 0.00 0.00 52.86 48.08 3ht0 s ASN 107 Cb -0.17 -0.44 -0.01 0.00 -0.02 0.00 0.00 41.25 40.62 3ht0 s ASN 107 CO 0.06 -0.17 0.03 0.42 -2.57 0.00 0.00 177.10 174.87 3ht0 s THR 108 N 0.06 1.14 0.37 1.60 -4.23 0.52 -4.99 115.64 110.12 3ht0 s THR 108 Ca 0.33 -1.97 0.06 0.00 -1.18 0.00 0.00 61.69 58.93 3ht0 s THR 108 Cb 0.04 -2.10 0.29 0.00 1.34 0.00 0.00 72.50 72.06 3ht0 s THR 108 CO -0.20 0.00 1.98 -0.33 -0.54 0.00 0.00 174.62 175.53 3ht0 h GLU 109 N 1.28 0.70 0.00 3.99 3.07 -2.06 -3.04 114.58 118.53 3ht0 h GLU 109 Ca -0.44 -0.04 -0.20 0.00 -0.50 0.00 0.00 59.36 58.18 3ht0 h GLU 109 Cb 1.32 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 29.03 3ht0 h GLU 109 CO 0.73 0.47 -1.74 0.54 -1.40 0.00 0.00 179.01 177.60 3ht0 n ARG 110 N -4.47 0.64 -4.17 2.33 1.74 -1.26 -4.96 116.66 106.52 3ht0 n ARG 110 Ca 0.09 0.12 -0.22 0.00 -0.77 0.00 0.00 57.85 57.07 3ht0 n ARG 110 Cb 0.18 -1.70 -0.17 0.00 -1.02 0.00 0.00 32.46 29.75 3ht0 n ARG 110 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3ht0 s LEU 111 N -5.57 1.28 -0.26 0.55 1.43 -1.15 -5.09 118.68 109.88 3ht0 s LEU 111 Ca -0.05 -0.17 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 3ht0 s LEU 111 Cb 0.09 -0.56 0.06 0.00 0.03 0.00 0.00 46.19 45.80 3ht0 s LEU 111 CO 0.83 -0.06 -0.11 -0.89 0.23 0.00 0.00 176.35 176.35 3ht0 s THR 112 N 1.08 2.19 -0.03 5.49 2.01 -1.26 -0.35 115.64 124.77 3ht0 s THR 112 Ca -0.08 -1.57 0.01 0.00 0.31 0.00 0.00 61.69 60.36 3ht0 s THR 112 Cb -0.14 -2.26 0.02 0.00 0.01 0.00 0.00 72.50 70.12 3ht0 s THR 112 CO -0.01 0.01 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.19 3ht0 s VAL 113 N 1.12 0.53 0.61 3.82 1.01 -0.24 -3.51 120.40 123.75 3ht0 s VAL 113 Ca -0.08 -0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.55 3ht0 s VAL 113 Cb -0.19 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 3ht0 s VAL 113 CO -0.05 0.20 1.01 -2.65 0.00 0.00 0.00 175.10 173.61 3ht0 n PRO 114 N 3.74 0.93 -1.57 2.72 -0.02 -1.26 -0.76 135.00 138.78 3ht0 n PRO 114 Ca -0.23 0.36 -0.49 0.00 -2.02 0.00 0.00 63.50 61.12 3ht0 n PRO 114 Cb 0.52 -2.22 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 3ht0 n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3ht0 n HIS 115 N -1.76 1.27 0.31 6.00 -0.00 -0.54 -4.81 115.22 115.68 3ht0 n HIS 115 Ca 0.14 0.69 0.17 0.00 -0.00 0.00 0.00 57.72 58.72 3ht0 n HIS 115 Cb 0.47 -2.27 0.98 0.00 -0.00 0.00 0.00 29.99 29.17 3ht0 n HIS 115 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 3ht0 h TYR 116 N 3.41 0.00 0.00 1.57 -0.00 -1.94 -2.92 116.97 117.10 3ht0 h TYR 116 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.30 3ht0 h TYR 116 Cb 1.35 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.08 3ht0 h TYR 116 CO 0.54 0.01 0.00 -3.47 -0.00 0.00 0.00 178.16 175.25 3ht0 n ASP 117 N -3.59 1.28 0.14 0.10 2.03 -1.26 -4.80 116.55 110.45 3ht0 n ASP 117 Ca -0.03 -1.48 0.09 0.00 0.52 0.00 0.00 54.79 53.88 3ht0 n ASP 117 Cb 0.10 0.00 0.58 0.00 -0.72 0.00 0.00 41.12 41.08 3ht0 n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ht0 h MET 118 N 0.00 0.17 0.00 -0.67 -0.00 -1.89 -0.87 114.93 111.67 3ht0 h MET 118 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 3ht0 h MET 118 Cb 0.40 -0.04 0.00 0.00 -0.00 0.00 0.00 31.60 31.96 3ht0 h MET 118 CO 0.00 0.11 0.00 1.63 -0.00 0.00 0.00 176.91 178.65 3ht0 n LYS 119 N -4.50 0.07 0.00 -0.10 5.02 -1.26 -1.83 118.16 115.55 3ht0 n LYS 119 Ca 0.01 0.20 0.11 0.00 -2.02 0.00 0.00 58.31 56.60 3ht0 n LYS 119 Cb 0.16 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.69 3ht0 n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3ht0 n ASN 120 N -1.43 2.24 -4.06 4.39 3.02 -0.33 -4.92 115.26 114.16 3ht0 n ASN 120 Ca 0.05 -1.62 -0.33 0.00 -0.03 0.00 0.00 54.58 52.66 3ht0 n ASN 120 Cb 0.17 0.34 -0.14 0.00 -0.61 0.00 0.00 39.78 39.53 3ht0 n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3ht0 s ARG 121 N -2.23 1.78 0.44 3.52 0.52 -0.76 -4.94 118.95 117.27 3ht0 s ARG 121 Ca 0.20 -1.74 0.17 0.00 -0.52 0.00 0.00 55.73 53.85 3ht0 s ARG 121 Cb 0.18 -3.24 1.11 0.00 0.52 0.00 0.00 34.95 33.52 3ht0 s ARG 121 CO 0.47 -0.89 1.93 0.78 0.02 0.00 0.00 175.30 177.61 3ht0 h GLY 122 N 7.76 0.58 2.00 -3.53 0.00 -1.91 0.71 103.07 108.68 3ht0 h GLY 122 Ca -0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 3ht0 h GLY 122 CO 0.55 0.05 -0.00 0.00 0.00 0.00 0.00 176.54 177.14 3ht0 h ALA 123 N 1.66 1.20 0.00 3.60 0.00 -1.94 -0.46 119.26 123.32 3ht0 h ALA 123 Ca 0.35 -0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.83 3ht0 h ALA 123 Cb 0.89 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 3ht0 h ALA 123 CO -0.10 0.00 -2.50 -1.33 0.00 0.00 0.00 179.25 175.32 3ht0 n MET 124 N -3.38 0.62 -0.13 0.00 2.81 -0.31 -4.55 117.12 112.18 3ht0 n MET 124 Ca -0.03 0.22 -0.10 0.00 -1.81 0.00 0.00 57.70 55.97 3ht0 n MET 124 Cb 0.08 -1.51 0.03 0.00 -0.71 0.00 0.00 33.22 31.11 3ht0 n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3ht0 h LEU 125 N -0.55 0.94 0.06 4.03 3.38 -0.64 -2.51 115.31 120.02 3ht0 h LEU 125 Ca -0.65 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 56.96 3ht0 h LEU 125 Cb 1.74 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.23 3ht0 h LEU 125 CO -0.27 1.14 -0.03 -0.50 0.09 0.00 0.00 178.44 178.87 3ht0 h TRP 126 N 0.78 -0.07 -0.42 1.13 -0.00 -1.33 0.15 115.95 116.20 3ht0 h TRP 126 Ca 0.10 -0.00 -0.04 0.00 -0.00 0.00 0.00 58.89 58.94 3ht0 h TRP 126 Cb 0.81 0.02 -0.02 0.00 -0.00 0.00 0.00 29.16 29.97 3ht0 h TRP 126 CO 0.05 0.22 0.08 -1.35 -0.00 0.00 0.00 178.44 177.43 3ht0 h PRO 127 N -0.36 0.63 -0.56 0.49 0.11 -1.76 -1.42 132.00 129.13 3ht0 h PRO 127 Ca -0.01 -0.12 -0.07 0.00 0.11 0.00 0.00 66.00 65.91 3ht0 h PRO 127 Cb 0.32 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 3ht0 h PRO 127 CO 0.01 0.60 0.06 1.25 -0.21 0.00 0.00 178.00 179.71 3ht0 h LEU 128 N 0.61 0.92 -1.28 2.35 5.85 -1.31 -2.84 115.31 119.62 3ht0 h LEU 128 Ca 0.14 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 3ht0 h LEU 128 Cb 0.27 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3ht0 h LEU 128 CO 0.00 0.97 -0.00 0.15 -0.34 0.00 0.00 178.44 179.21 3ht0 h PHE 129 N 0.84 0.50 -0.70 1.25 3.57 -0.31 0.21 116.94 122.30 3ht0 h PHE 129 Ca 0.17 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 3ht0 h PHE 129 Cb 0.46 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 3ht0 h PHE 129 CO 0.03 0.50 0.42 1.49 -2.23 0.00 0.00 178.31 178.52 3ht0 h GLU 130 N 0.46 0.96 0.00 1.11 4.81 -1.04 -2.62 114.58 118.27 3ht0 h GLU 130 Ca 0.10 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3ht0 h GLU 130 Cb 0.31 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.49 3ht0 h GLU 130 CO 0.01 0.69 -1.10 0.44 -0.73 0.00 0.00 179.01 178.32 3ht0 n ILE 131 N -4.53 0.09 -3.01 2.32 -5.35 -1.00 -4.63 119.36 103.26 3ht0 n ILE 131 Ca 0.06 -0.20 -0.16 0.00 -0.27 0.00 0.00 62.75 62.18 3ht0 n ILE 131 Cb 0.06 0.39 -0.00 0.00 -1.74 0.00 0.00 39.64 38.35 3ht0 n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ht0 n ALA 132 N -1.77 0.89 0.29 -1.28 0.00 0.72 -5.00 120.51 114.36 3ht0 n ALA 132 Ca 0.02 -2.61 0.15 0.00 0.00 0.00 0.00 53.44 50.99 3ht0 n ALA 132 Cb 0.42 -1.02 0.89 0.00 0.00 0.00 0.00 19.45 19.73 3ht0 n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3ht0 h PRO 133 N 3.49 0.00 -0.68 0.00 0.13 -1.66 -1.82 132.00 131.45 3ht0 h PRO 133 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3ht0 h PRO 133 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 3ht0 h PRO 133 CO 0.38 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.56 3ht0 n GLU 134 N -3.79 3.07 -1.73 0.86 -0.58 -1.26 -4.35 120.64 112.86 3ht0 n GLU 134 Ca -0.03 -2.62 -0.42 0.00 -0.42 0.00 0.00 57.16 53.67 3ht0 n GLU 134 Cb 0.11 -1.69 -0.01 0.00 -0.57 0.00 0.00 31.44 29.28 3ht0 n GLU 134 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3ht0 n LEU 135 N 1.35 4.13 -4.32 -4.62 0.00 -0.68 -4.89 117.00 107.96 3ht0 n LEU 135 Ca 0.24 1.16 -0.32 0.00 0.00 0.00 0.00 56.01 57.09 3ht0 n LEU 135 Cb 0.71 -1.56 -0.15 0.00 0.00 0.00 0.00 43.42 42.42 3ht0 n LEU 135 CO 0.19 -0.02 -0.52 -0.69 0.00 0.00 0.00 177.39 176.36 3ht0 s VAL 136 N -0.29 2.47 0.71 1.96 1.01 -1.26 -1.29 120.40 123.72 3ht0 s VAL 136 Ca 0.62 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 3ht0 s VAL 136 Cb -0.53 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 33.92 3ht0 s VAL 136 CO 0.52 0.56 1.07 -0.36 0.00 0.00 0.00 175.10 176.89 3ht0 s PHE 137 N -0.07 3.15 0.42 5.22 0.40 0.14 -4.93 117.98 122.31 3ht0 s PHE 137 Ca -0.05 1.28 0.17 0.00 -0.60 0.00 0.00 56.93 57.74 3ht0 s PHE 137 Cb -0.14 -2.94 1.08 0.00 0.51 0.00 0.00 43.02 41.53 3ht0 s PHE 137 CO 0.04 -1.27 1.87 -1.35 0.70 0.00 0.00 175.22 175.21 3ht0 h PRO 138 N -0.74 0.39 -0.04 0.24 0.11 -1.87 -0.69 132.00 129.40 3ht0 h PRO 138 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3ht0 h PRO 138 Cb 1.23 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3ht0 h PRO 138 CO 0.59 0.26 0.00 -0.40 -0.21 0.00 0.00 178.00 178.24 3ht0 n ASP 139 N -4.50 1.26 0.00 -2.05 5.75 -1.26 -4.91 116.55 110.84 3ht0 n ASP 139 Ca 0.18 -1.47 0.00 0.00 -0.01 0.00 0.00 54.79 53.49 3ht0 n ASP 139 Cb 0.67 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 3ht0 n ASP 139 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ht0 n GLY 140 N 1.13 0.16 3.77 6.12 0.00 -0.26 -5.07 105.19 111.03 3ht0 n GLY 140 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3ht0 n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ht0 s GLU 141 N -0.94 4.02 -0.07 1.61 2.02 -1.26 -4.75 118.70 119.34 3ht0 s GLU 141 Ca 0.00 2.25 -0.05 0.00 0.02 0.00 0.00 54.97 57.19 3ht0 s GLU 141 Cb 0.00 -2.83 -0.04 0.00 0.10 0.00 0.00 34.13 31.36 3ht0 s GLU 141 CO 0.00 -0.48 0.15 -1.64 0.02 0.00 0.00 175.26 173.31 3ht0 s MET 142 N -2.16 3.40 0.24 1.61 -1.94 -1.26 0.23 119.30 119.42 3ht0 s MET 142 Ca 0.55 -0.23 -0.05 0.00 -1.71 0.00 0.00 55.69 54.25 3ht0 s MET 142 Cb -0.40 -3.12 0.37 0.00 2.01 0.00 0.00 34.83 33.69 3ht0 s MET 142 CO 0.52 0.73 1.79 1.25 -0.01 0.00 0.00 175.02 179.30 3ht0 h LEU 143 N 4.48 0.58 -1.02 -0.03 5.85 -1.51 -0.97 115.31 122.68 3ht0 h LEU 143 Ca -0.52 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.28 3ht0 h LEU 143 Cb 1.21 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 3ht0 h LEU 143 CO 0.62 0.33 0.66 -0.09 -0.34 0.00 0.00 178.44 179.62 3ht0 h ARG 144 N 0.70 1.25 -0.45 1.25 2.43 -1.79 -2.07 114.38 115.69 3ht0 h ARG 144 Ca 0.38 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 3ht0 h ARG 144 Cb 0.38 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3ht0 h ARG 144 CO -0.26 0.83 0.20 0.37 -1.51 0.00 0.00 179.97 179.59 3ht0 h GLN 145 N 1.29 0.67 -0.46 0.20 4.15 -1.60 0.02 115.11 119.38 3ht0 h GLN 145 Ca 0.39 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.69 3ht0 h GLN 145 Cb -0.03 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 3ht0 h GLN 145 CO -0.11 0.59 0.25 0.82 -1.93 0.00 0.00 178.83 178.45 3ht0 h ILE 146 N 0.59 1.16 -0.59 2.39 2.04 -0.88 0.00 117.51 122.22 3ht0 h ILE 146 Ca 0.15 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 3ht0 h ILE 146 Cb 0.16 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 3ht0 h ILE 146 CO -0.02 0.17 0.02 -0.07 0.00 0.00 0.00 178.15 178.26 3ht0 h LEU 147 N 0.60 1.01 -0.73 1.44 3.38 -1.26 -2.16 115.31 117.59 3ht0 h LEU 147 Ca 0.16 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 3ht0 h LEU 147 Cb 0.05 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 3ht0 h LEU 147 CO -0.03 1.06 0.29 -0.74 0.09 0.00 0.00 178.44 179.11 3ht0 h HIS 148 N 0.93 1.12 -0.24 1.13 2.76 -0.76 0.03 115.15 120.11 3ht0 h HIS 148 Ca 0.17 -0.09 -0.07 0.00 -2.20 0.00 0.00 60.37 58.18 3ht0 h HIS 148 Cb 0.53 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 3ht0 h HIS 148 CO 0.04 0.86 -0.14 1.15 -1.30 0.00 0.00 177.93 178.54 3ht0 h THR 149 N 1.05 1.31 0.00 6.26 2.02 -0.87 -3.29 112.91 119.38 3ht0 h THR 149 Ca 0.24 -1.24 -0.17 0.00 0.77 0.00 0.00 66.41 66.01 3ht0 h THR 149 Cb 0.22 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 3ht0 h THR 149 CO -0.02 0.38 -1.11 0.03 0.37 0.00 0.00 175.52 175.17 3ht0 h ARG 150 N 0.24 0.00 -6.19 6.66 2.47 -1.38 -3.48 114.38 112.70 3ht0 h ARG 150 Ca 0.05 0.00 -0.45 0.00 -1.26 0.00 0.00 59.98 58.33 3ht0 h ARG 150 Cb 0.66 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.99 3ht0 h ARG 150 CO 0.04 0.50 -0.79 0.00 0.56 0.00 0.00 179.97 180.28 3ht0 n ALA 151 N -2.36 -1.65 -1.70 0.04 0.00 -0.01 -4.91 120.51 109.93 3ht0 n ALA 151 Ca -0.06 0.02 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 3ht0 n ALA 151 Cb 0.86 -3.25 0.02 0.00 0.00 0.00 0.00 19.45 17.08 3ht0 n ALA 151 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3ht0 n PHE 152 N -4.50 1.96 -1.86 0.00 3.72 -1.26 -4.96 117.46 110.57 3ht0 n PHE 152 Ca -0.13 0.48 -0.38 0.00 -0.05 0.00 0.00 57.45 57.36 3ht0 n PHE 152 Cb 0.60 -2.34 0.03 0.00 -0.94 0.00 0.00 39.48 36.84 3ht0 n PHE 152 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ht0 s ASP 153 N -0.72 5.51 0.50 4.37 1.01 -1.26 -4.98 116.67 121.09 3ht0 s ASP 153 Ca 0.65 2.72 -0.20 0.00 0.71 0.00 0.00 52.55 56.43 3ht0 s ASP 153 Cb -0.48 -2.63 -0.07 0.00 1.01 0.00 0.00 42.92 40.75 3ht0 s ASP 153 CO 0.54 -1.40 1.08 -0.54 0.21 0.00 0.00 175.17 175.06 3ht0 s LYS 154 N -2.79 3.64 0.02 8.23 1.02 -1.26 -4.99 119.74 123.61 3ht0 s LYS 154 Ca 0.69 1.48 -0.03 0.00 0.02 0.00 0.00 55.97 58.12 3ht0 s LYS 154 Cb -0.39 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 3ht0 s LYS 154 CO 0.47 -0.59 0.23 -0.51 -0.92 0.00 0.00 175.35 174.04 3ht0 s LEU 155 N -3.56 4.36 0.35 3.17 1.43 -1.26 -5.08 118.68 118.08 3ht0 s LEU 155 Ca 0.69 0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 53.94 3ht0 s LEU 155 Cb -0.20 -2.77 -0.09 0.00 0.03 0.00 0.00 46.19 43.16 3ht0 s LEU 155 CO 0.23 0.22 1.12 0.20 0.23 0.00 0.00 176.35 178.35 3ht0 s ASN 156 N -2.03 6.89 0.55 2.29 0.01 -1.26 -4.88 114.94 116.52 3ht0 s ASN 156 Ca 0.30 2.25 -0.19 0.00 -0.71 0.00 0.00 52.86 54.51 3ht0 s ASN 156 Cb -0.13 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.87 3ht0 s ASN 156 CO 0.20 -0.41 1.10 -0.54 -1.51 0.00 0.00 177.10 175.94 3ht0 s LYS 157 N -2.00 3.38 0.00 -0.60 1.02 -1.26 -0.59 119.74 119.69 3ht0 s LYS 157 Ca 0.52 1.47 0.00 0.00 0.02 0.00 0.00 55.97 57.98 3ht0 s LYS 157 Cb -0.29 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 3ht0 s LYS 157 CO 0.37 -0.80 0.40 1.87 -0.92 0.00 0.00 175.35 176.27