#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hn0 h GLU 22 N 0.00 0.84 0.00 1.09 4.39 -2.06 -1.79 114.58 117.05 3hn0 h GLU 22 Ca 0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3hn0 h GLU 22 Cb 0.00 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.46 3hn0 h GLU 22 CO 0.00 0.56 0.00 -0.40 -1.16 0.00 0.00 179.01 178.01 3hn0 n ASP 23 N -4.65 0.00 -0.06 1.42 5.75 -1.26 -4.16 116.55 113.59 3hn0 n ASP 23 Ca 0.07 0.21 -0.12 0.00 -0.01 0.00 0.00 54.79 54.94 3hn0 n ASP 23 Cb 0.06 -0.38 -0.04 0.00 -1.03 0.00 0.00 41.12 39.73 3hn0 n ASP 23 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 3hn0 n THR 24 N -1.38 0.65 -4.13 2.12 -1.04 -1.05 -4.86 114.28 104.60 3hn0 n THR 24 Ca 0.08 -0.17 -0.09 0.00 -2.04 0.00 0.00 64.05 61.82 3hn0 n THR 24 Cb 0.19 -1.59 -0.10 0.00 -1.82 0.00 0.00 70.33 67.01 3hn0 n THR 24 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3hn0 s VAL 25 N -2.22 0.26 -0.26 12.58 -7.23 -0.70 -2.93 120.40 119.90 3hn0 s VAL 25 Ca -0.17 -1.87 -0.02 0.00 -1.81 0.00 0.00 61.98 58.12 3hn0 s VAL 25 Cb 0.06 -1.74 0.03 0.00 0.56 0.00 0.00 36.38 35.29 3hn0 s VAL 25 CO 0.21 -0.79 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.55 3hn0 s ILE 26 N -3.91 3.02 -0.26 -0.62 1.01 -0.05 -4.63 121.20 115.76 3hn0 s ILE 26 Ca 0.14 -1.01 -0.21 0.00 0.00 0.00 0.00 60.65 59.57 3hn0 s ILE 26 Cb 0.07 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 3hn0 s ILE 26 CO -0.05 0.16 0.65 -0.54 0.00 0.00 0.00 174.94 175.16 3hn0 s LYS 27 N 1.34 4.08 -0.20 2.79 1.02 -1.26 -0.52 119.74 126.99 3hn0 s LYS 27 Ca -0.00 0.54 -0.00 0.00 0.02 0.00 0.00 55.97 56.53 3hn0 s LYS 27 Cb -0.17 -3.66 0.02 0.00 -0.52 0.00 0.00 37.83 33.49 3hn0 s LYS 27 CO -0.03 -0.45 -0.15 0.08 -0.92 0.00 0.00 175.35 173.87 3hn0 s VAL 28 N 2.56 2.42 -0.13 3.17 1.01 -0.48 -0.86 120.40 128.08 3hn0 s VAL 28 Ca 0.27 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 3hn0 s VAL 28 Cb -0.15 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 3hn0 s VAL 28 CO 0.09 0.47 0.20 -0.55 0.00 0.00 0.00 175.10 175.31 3hn0 s SER 29 N 1.33 6.41 -0.05 3.32 0.15 -0.06 -0.69 113.70 124.11 3hn0 s SER 29 Ca 0.04 0.48 0.03 0.00 0.70 0.00 0.00 55.95 57.21 3hn0 s SER 29 Cb -0.14 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 3hn0 s SER 29 CO -0.10 0.28 -0.15 -0.69 1.20 0.00 0.00 173.24 173.78 3hn0 s VAL 30 N -0.38 1.28 0.10 4.45 1.01 -0.31 -0.82 120.40 125.73 3hn0 s VAL 30 Ca 0.15 -0.60 -0.31 0.00 0.00 0.00 0.00 61.98 61.21 3hn0 s VAL 30 Cb -0.13 -1.12 -0.07 0.00 0.00 0.00 0.00 36.38 35.06 3hn0 s VAL 30 CO 0.04 0.38 1.29 -0.22 0.00 0.00 0.00 175.10 176.58 3hn0 s LEU 31 N 0.29 4.38 0.10 3.92 2.96 -1.05 -0.20 118.68 129.09 3hn0 s LEU 31 Ca -0.08 2.19 -0.31 0.00 -0.22 0.00 0.00 54.13 55.71 3hn0 s LEU 31 Cb -0.13 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 42.88 3hn0 s LEU 31 CO 0.03 -0.54 1.66 -0.60 -1.32 0.00 0.00 176.35 175.57 3hn0 s ARG 32 N 0.91 4.19 0.00 1.98 3.52 0.54 -4.44 118.95 125.65 3hn0 s ARG 32 Ca 0.61 2.38 0.00 0.00 -0.13 0.00 0.00 55.73 58.59 3hn0 s ARG 32 Cb -0.33 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.58 3hn0 s ARG 32 CO 0.31 -0.72 0.00 0.41 -0.81 0.00 0.00 175.30 174.49 3hn0 n GLY 33 N 3.97 -1.20 0.29 8.12 0.00 -1.26 -4.94 105.19 110.17 3hn0 n GLY 33 Ca 0.16 -1.45 0.14 0.00 0.00 0.00 0.00 46.02 44.86 3hn0 n GLY 33 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hn0 h PRO 34 N 1.99 0.00 0.00 1.61 0.11 -1.87 -1.17 132.00 132.67 3hn0 h PRO 34 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hn0 h PRO 34 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hn0 h PRO 34 CO 0.00 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 176.69 3hn0 n SER 35 N -3.87 0.69 0.27 -2.05 3.41 -1.26 -1.58 113.62 109.22 3hn0 n SER 35 Ca -0.03 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 3hn0 n SER 35 Cb 0.11 -0.80 0.76 0.00 -0.26 0.00 0.00 64.21 64.03 3hn0 n SER 35 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3hn0 h VAL 36 N 0.00 0.63 -0.92 -3.33 2.07 -1.42 -2.04 116.25 111.24 3hn0 h VAL 36 Ca 0.00 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.28 3hn0 h VAL 36 Cb 0.44 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 3hn0 h VAL 36 CO 0.00 0.08 0.56 0.40 0.02 0.00 0.00 177.57 178.63 3hn0 h ILE 37 N 0.00 0.94 -0.33 4.57 2.04 -1.47 0.32 117.51 123.58 3hn0 h ILE 37 Ca -0.00 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3hn0 h ILE 37 Cb 0.20 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 3hn0 h ILE 37 CO 0.01 0.17 0.22 0.00 0.00 0.00 0.00 178.15 178.55 3hn0 h ALA 38 N 1.49 1.95 -0.31 1.87 0.00 -1.55 -2.19 119.26 120.52 3hn0 h ALA 38 Ca 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3hn0 h ALA 38 Cb 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hn0 h ALA 38 CO -0.24 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.20 3hn0 n PHE 39 N -4.49 0.39 -0.29 0.00 3.01 -0.45 -3.43 117.46 112.20 3hn0 n PHE 39 Ca 0.03 -0.19 0.03 0.00 1.01 0.00 0.00 57.45 58.33 3hn0 n PHE 39 Cb 0.19 0.00 0.17 0.00 -0.01 0.00 0.00 39.48 39.83 3hn0 n PHE 39 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hn0 h ALA 40 N 4.58 1.17 -0.10 4.37 0.00 -0.32 -1.43 119.26 127.53 3hn0 h ALA 40 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3hn0 h ALA 40 Cb 1.00 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3hn0 h ALA 40 CO 0.00 0.05 0.11 0.22 0.00 0.00 0.00 179.25 179.63 3hn0 h ASP 41 N 0.74 0.00 0.89 0.00 3.58 -1.83 -1.41 116.42 118.39 3hn0 h ASP 41 Ca 0.40 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.85 3hn0 h ASP 41 Cb 0.40 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.45 3hn0 h ASP 41 CO -0.27 0.00 0.00 0.79 -2.88 0.00 0.00 179.24 176.88 3hn0 n TRP 42 N -3.85 0.02 -0.10 0.28 8.01 -0.54 -0.01 117.44 121.25 3hn0 n TRP 42 Ca -0.00 0.01 -0.10 0.00 -1.31 0.00 0.00 57.50 56.10 3hn0 n TRP 42 Cb 0.21 -0.51 -0.02 0.00 -2.01 0.00 0.00 31.31 28.98 3hn0 n TRP 42 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 3hn0 h LEU 43 N 0.00 0.42 0.00 -0.99 3.38 -1.34 -3.04 115.31 113.75 3hn0 h LEU 43 Ca 0.00 -0.13 -0.36 0.00 0.09 0.00 0.00 57.88 57.48 3hn0 h LEU 43 Cb 0.44 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 3hn0 h LEU 43 CO 0.00 0.44 -2.29 -0.62 0.09 0.00 0.00 178.44 176.06 3hn0 n GLU 44 N -4.75 0.68 -3.12 1.13 1.02 -1.14 -4.75 120.64 109.71 3hn0 n GLU 44 Ca -0.02 0.06 -0.25 0.00 -0.02 0.00 0.00 57.16 56.93 3hn0 n GLU 44 Cb 0.11 -1.57 -0.05 0.00 -0.02 0.00 0.00 31.44 29.91 3hn0 n GLU 44 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3hn0 n ASN 45 N -2.86 3.44 -4.76 1.62 3.02 0.98 -5.07 115.26 111.64 3hn0 n ASN 45 Ca -0.32 -3.45 -0.41 0.00 -0.03 0.00 0.00 54.58 50.37 3hn0 n ASN 45 Cb 1.13 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 39.67 3hn0 n ASN 45 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3hn0 s PRO 46 N -2.91 4.34 0.69 3.52 0.04 -1.15 -4.32 135.00 135.22 3hn0 s PRO 46 Ca 0.44 2.22 -0.11 0.00 0.04 0.00 0.00 61.00 63.59 3hn0 s PRO 46 Cb 0.25 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.71 3hn0 s PRO 46 CO -0.10 -0.24 1.06 -1.25 0.04 0.00 0.00 177.00 176.51 3hn0 s PRO 47 N -1.35 2.99 -0.14 0.56 0.04 -1.26 -4.78 135.00 131.05 3hn0 s PRO 47 Ca 0.52 0.77 -0.02 0.00 0.04 0.00 0.00 61.00 62.31 3hn0 s PRO 47 Cb -0.40 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.11 3hn0 s PRO 47 CO 0.50 -1.01 -0.09 0.42 0.04 0.00 0.00 177.00 176.86 3hn0 s ILE 48 N -3.15 3.44 -0.08 0.56 1.01 -1.26 -1.22 121.20 120.50 3hn0 s ILE 48 Ca 0.58 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.72 3hn0 s ILE 48 Cb -0.13 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.88 3hn0 s ILE 48 CO 0.54 0.51 -0.12 -0.63 0.00 0.00 0.00 174.94 175.24 3hn0 s ILE 49 N 0.40 1.17 -1.55 2.92 1.01 -0.17 -4.79 121.20 120.19 3hn0 s ILE 49 Ca -0.07 -0.48 -0.13 0.00 0.00 0.00 0.00 60.65 59.97 3hn0 s ILE 49 Cb -0.15 -1.08 0.09 0.00 0.01 0.00 0.00 42.46 41.33 3hn0 s ILE 49 CO 0.04 0.37 0.89 -0.67 0.00 0.00 0.00 174.94 175.57 3hn0 n ASP 50 N 4.01 -3.92 -1.37 3.58 2.03 -1.26 -0.72 116.55 118.89 3hn0 n ASP 50 Ca -0.21 -0.85 -0.18 0.00 0.52 0.00 0.00 54.79 54.07 3hn0 n ASP 50 Cb 0.51 -3.58 -0.08 0.00 -0.72 0.00 0.00 41.12 37.25 3hn0 n ASP 50 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3hn0 n ASN 51 N -2.82 -5.40 -4.36 1.67 3.02 -1.26 -4.99 115.26 101.12 3hn0 n ASN 51 Ca 0.00 0.44 -0.32 0.00 -0.03 0.00 0.00 54.58 54.67 3hn0 n ASN 51 Cb 0.54 -4.48 -0.15 0.00 -0.61 0.00 0.00 39.78 35.08 3hn0 n ASN 51 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3hn0 s LYS 52 N -3.51 2.78 0.21 3.52 1.02 0.10 -4.95 119.74 118.92 3hn0 s LYS 52 Ca 0.00 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 3hn0 s LYS 52 Cb 0.00 -2.37 -0.08 0.00 -0.52 0.00 0.00 37.83 34.86 3hn0 s LYS 52 CO 0.00 0.41 0.96 0.21 -0.92 0.00 0.00 175.35 176.01 3hn0 s LYS 53 N -0.19 4.80 0.11 1.68 2.47 -1.15 -1.00 119.74 126.46 3hn0 s LYS 53 Ca -0.01 1.51 -0.30 0.00 -1.56 0.00 0.00 55.97 55.61 3hn0 s LYS 53 Cb -0.13 -3.30 -0.06 0.00 -1.46 0.00 0.00 37.83 32.88 3hn0 s LYS 53 CO 0.03 0.41 0.97 0.08 0.16 0.00 0.00 175.35 177.00 3hn0 s VAL 54 N -0.86 4.48 -0.25 4.02 1.01 -0.36 -0.87 120.40 127.57 3hn0 s VAL 54 Ca 0.43 2.05 0.01 0.00 0.00 0.00 0.00 61.98 64.47 3hn0 s VAL 54 Cb -0.26 -4.31 0.06 0.00 0.00 0.00 0.00 36.38 31.88 3hn0 s VAL 54 CO 0.32 0.31 -0.05 -1.58 0.00 0.00 0.00 175.10 174.10 3hn0 s GLN 55 N 0.03 1.67 -0.09 2.72 0.74 0.32 -4.69 119.66 120.36 3hn0 s GLN 55 Ca 0.47 -1.10 -0.20 0.00 0.05 0.00 0.00 55.36 54.58 3hn0 s GLN 55 Cb -0.24 -2.65 -0.04 0.00 1.10 0.00 0.00 33.01 31.18 3hn0 s GLN 55 CO 0.30 -0.63 0.56 0.08 -0.55 0.00 0.00 175.29 175.05 3hn0 s VAL 56 N 1.33 5.11 -0.09 1.34 1.01 -1.26 -1.39 120.40 126.45 3hn0 s VAL 56 Ca -0.05 1.14 0.02 0.00 0.00 0.00 0.00 61.98 63.09 3hn0 s VAL 56 Cb -0.19 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.31 3hn0 s VAL 56 CO -0.07 0.32 -0.15 -0.75 0.00 0.00 0.00 175.10 174.45 3hn0 s LYS 57 N 0.56 2.08 -0.09 2.72 2.20 0.14 -4.98 119.74 122.38 3hn0 s LYS 57 Ca 0.30 -0.52 -0.22 0.00 -0.36 0.00 0.00 55.97 55.16 3hn0 s LYS 57 Cb -0.16 -1.75 -0.04 0.00 -1.51 0.00 0.00 37.83 34.37 3hn0 s LYS 57 CO 0.13 -0.02 0.66 0.08 -0.36 0.00 0.00 175.35 175.84 3hn0 s VAL 58 N 0.86 5.06 0.17 4.02 1.01 -1.26 -1.16 120.40 129.11 3hn0 s VAL 58 Ca -0.10 1.34 0.08 0.00 0.00 0.00 0.00 61.98 63.30 3hn0 s VAL 58 Cb -0.15 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 3hn0 s VAL 58 CO 0.01 0.24 -0.04 0.68 0.00 0.00 0.00 175.10 175.99 3hn0 s VAL 59 N 0.93 3.52 -0.14 2.92 -7.23 0.72 -4.91 120.40 116.21 3hn0 s VAL 59 Ca 0.35 -1.47 0.17 0.00 -1.81 0.00 0.00 61.98 59.21 3hn0 s VAL 59 Cb -0.17 -2.75 -0.06 0.00 0.56 0.00 0.00 36.38 33.96 3hn0 s VAL 59 CO 0.16 -0.08 1.03 0.44 -0.31 0.00 0.00 175.10 176.33 3hn0 h ASP 60 N 2.88 0.00 -5.14 4.85 3.32 -1.94 0.15 116.42 120.55 3hn0 h ASP 60 Ca -0.47 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.44 3hn0 h ASP 60 Cb 1.20 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.58 3hn0 h ASP 60 CO 0.56 0.50 -0.65 -0.94 -1.72 0.00 0.00 179.24 177.00 3hn0 s SER 61 N -5.94 0.35 0.38 6.45 1.04 -1.26 -4.60 113.70 110.11 3hn0 s SER 61 Ca -0.01 -0.76 0.08 0.00 0.48 0.00 0.00 55.95 55.74 3hn0 s SER 61 Cb 0.08 0.18 0.82 0.00 0.10 0.00 0.00 66.02 67.21 3hn0 s SER 61 CO 0.79 -0.50 1.95 -0.65 0.98 0.00 0.00 173.24 175.81 3hn0 h PRO 62 N 3.66 0.64 -0.63 4.02 0.11 -1.97 -1.26 132.00 136.57 3hn0 h PRO 62 Ca -0.33 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 3hn0 h PRO 62 Cb 1.17 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 3hn0 h PRO 62 CO 0.56 0.43 0.24 -0.44 -0.21 0.00 0.00 178.00 178.58 3hn0 h ASP 63 N 0.66 0.88 -0.56 -2.05 3.32 -1.99 0.04 116.42 116.72 3hn0 h ASP 63 Ca 0.32 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 3hn0 h ASP 63 Cb 0.38 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3hn0 h ASP 63 CO -0.11 0.82 -0.02 -0.07 -1.72 0.00 0.00 179.24 178.14 3hn0 h LEU 64 N 0.89 0.99 -0.32 1.55 3.38 -1.84 -1.60 115.31 118.37 3hn0 h LEU 64 Ca 0.21 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3hn0 h LEU 64 Cb 0.22 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3hn0 h LEU 64 CO -0.02 1.06 0.19 0.00 0.09 0.00 0.00 178.44 179.77 3hn0 h ALA 65 N 0.96 0.40 -0.81 1.53 0.00 -0.95 -2.44 119.26 117.96 3hn0 h ALA 65 Ca 0.16 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3hn0 h ALA 65 Cb 0.57 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3hn0 h ALA 65 CO 0.03 -0.09 0.53 1.96 0.00 0.00 0.00 179.25 181.67 3hn0 h GLN 66 N 0.40 1.02 -0.45 0.00 4.20 -0.90 -2.49 115.11 116.89 3hn0 h GLN 66 Ca 0.11 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 3hn0 h GLN 66 Cb 0.02 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.55 3hn0 h GLN 66 CO -0.02 0.67 0.05 0.00 -0.67 0.00 0.00 178.83 178.87 3hn0 h ALA 67 N 1.32 1.25 -0.58 3.87 0.00 -1.00 -0.47 119.26 123.65 3hn0 h ALA 67 Ca 0.31 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hn0 h ALA 67 Cb -0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3hn0 h ALA 67 CO -0.09 0.51 0.14 -0.07 0.00 0.00 0.00 179.25 179.73 3hn0 h LEU 68 N 0.68 0.84 -0.10 0.00 3.38 -0.99 -0.43 115.31 118.68 3hn0 h LEU 68 Ca 0.14 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 3hn0 h LEU 68 Cb 0.34 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3hn0 h LEU 68 CO 0.01 0.82 -0.39 -0.07 0.09 0.00 0.00 178.44 178.90 3hn0 h LEU 69 N 0.86 0.51 -0.77 1.67 3.38 -1.19 0.27 115.31 120.03 3hn0 h LEU 69 Ca 0.19 -0.63 0.03 0.00 0.09 0.00 0.00 57.88 57.56 3hn0 h LEU 69 Cb 0.32 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3hn0 h LEU 69 CO -0.00 1.05 0.49 0.40 0.09 0.00 0.00 178.44 180.47 3hn0 h ILE 70 N -0.00 1.11 -0.18 1.22 2.04 -0.92 -2.27 117.51 118.50 3hn0 h ILE 70 Ca -0.02 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.51 3hn0 h ILE 70 Cb 1.03 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3hn0 h ILE 70 CO 0.08 0.17 0.00 0.29 0.00 0.00 0.00 178.15 178.70 3hn0 n LYS 71 N -4.61 1.69 -3.66 2.37 5.02 -0.19 -4.93 118.16 113.86 3hn0 n LYS 71 Ca 0.09 -1.05 -0.21 0.00 -2.02 0.00 0.00 58.31 55.12 3hn0 n LYS 71 Cb 0.09 -1.37 0.04 0.00 -0.02 0.00 0.00 35.03 33.77 3hn0 n LYS 71 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3hn0 n GLN 72 N 0.28 -4.85 -0.06 1.97 6.02 -0.73 -4.90 117.38 115.11 3hn0 n GLN 72 Ca 0.15 0.64 0.04 0.00 -0.01 0.00 0.00 57.00 57.83 3hn0 n GLN 72 Cb 0.31 -5.23 0.07 0.00 1.02 0.00 0.00 30.24 26.41 3hn0 n GLN 72 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3hn0 n GLU 73 N -4.22 1.38 -3.94 -1.09 1.02 0.87 -4.99 120.64 109.67 3hn0 n GLU 73 Ca -0.29 -1.40 -0.09 0.00 -0.02 0.00 0.00 57.16 55.36 3hn0 n GLU 73 Cb 0.67 -1.18 -0.09 0.00 -0.02 0.00 0.00 31.44 30.82 3hn0 n GLU 73 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3hn0 s THR 74 N -0.83 0.14 -0.24 2.62 -1.32 -1.23 -5.00 115.64 109.79 3hn0 s THR 74 Ca 0.13 -1.17 0.01 0.00 -1.21 0.00 0.00 61.69 59.45 3hn0 s THR 74 Cb 0.08 -0.97 -0.18 0.00 -1.51 0.00 0.00 72.50 69.91 3hn0 s THR 74 CO 0.11 -0.65 -0.14 0.47 -2.21 0.00 0.00 174.62 172.20 3hn0 n ASP 75 N 0.66 1.96 -4.01 8.08 8.00 -0.04 -4.84 116.55 126.36 3hn0 n ASP 75 Ca -0.18 -0.09 -0.17 0.00 0.71 0.00 0.00 54.79 55.05 3hn0 n ASP 75 Cb 0.59 -0.44 -0.14 0.00 -0.02 0.00 0.00 41.12 41.10 3hn0 n ASP 75 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hn0 s ILE 76 N -2.52 0.62 0.02 0.53 1.01 -0.21 -2.45 121.20 118.19 3hn0 s ILE 76 Ca -0.33 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3hn0 s ILE 76 Cb 0.09 -0.54 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 3hn0 s ILE 76 CO 0.63 0.11 -0.03 0.00 0.00 0.00 0.00 174.94 175.64 3hn0 s ALA 77 N -0.33 0.13 -0.23 9.38 0.00 -0.46 -0.88 121.76 129.37 3hn0 s ALA 77 Ca 0.02 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 3hn0 s ALA 77 Cb -0.04 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.23 3hn0 s ALA 77 CO -0.00 -0.14 -0.08 0.08 0.00 0.00 0.00 175.76 175.62 3hn0 s VAL 78 N -1.30 2.83 0.28 0.00 1.01 -0.00 -0.55 120.40 122.68 3hn0 s VAL 78 Ca -0.14 -0.91 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 3hn0 s VAL 78 Cb -0.09 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.93 3hn0 s VAL 78 CO -0.01 0.30 0.63 -1.48 0.00 0.00 0.00 175.10 174.54 3hn0 s LEU 79 N 1.35 0.03 0.00 3.92 2.34 -0.49 -2.51 118.68 123.32 3hn0 s LEU 79 Ca 0.02 -0.82 0.00 0.00 0.06 0.00 0.00 54.13 53.39 3hn0 s LEU 79 Cb -0.16 2.34 0.00 0.00 -0.56 0.00 0.00 46.19 47.82 3hn0 s LEU 79 CO -0.06 -1.31 0.00 -2.65 -1.06 0.00 0.00 176.35 171.27 3hn0 n PRO 80 N -0.44 2.68 0.00 1.48 -0.02 -1.26 -0.12 135.00 137.32 3hn0 n PRO 80 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 3hn0 n PRO 80 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 3hn0 n PRO 80 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3hn0 n ILE 82 N 0.00 0.00 -0.18 4.25 -5.35 -1.26 -1.69 119.36 115.13 3hn0 n ILE 82 Ca 0.00 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.39 3hn0 n ILE 82 Cb 0.00 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 37.91 3hn0 n ILE 82 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 3hn0 h ASN 83 N 0.00 0.86 -0.31 7.28 4.21 -1.92 -0.89 115.58 124.82 3hn0 h ASN 83 Ca 0.00 -0.29 0.01 0.00 1.21 0.00 0.00 56.30 57.22 3hn0 h ASN 83 Cb 0.00 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 36.95 3hn0 h ASN 83 CO 0.00 0.94 0.20 0.00 -1.29 0.00 0.00 177.43 177.28 3hn0 h ALA 84 N 0.95 0.39 -0.49 -0.83 0.00 -1.64 -0.22 119.26 117.42 3hn0 h ALA 84 Ca 0.15 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.07 3hn0 h ALA 84 Cb 0.48 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3hn0 h ALA 84 CO 0.02 -0.16 0.28 0.00 0.00 0.00 0.00 179.25 179.40 3hn0 h ALA 85 N 1.12 0.63 -0.35 0.00 0.00 -1.80 -0.64 119.26 118.22 3hn0 h ALA 85 Ca 0.12 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3hn0 h ALA 85 Cb -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3hn0 h ALA 85 CO -0.03 -0.03 0.15 -0.97 0.00 0.00 0.00 179.25 178.37 3hn0 h ASN 86 N 0.56 0.21 -0.56 0.00 -1.24 -0.56 -0.19 115.58 113.79 3hn0 h ASN 86 Ca 0.20 0.03 -0.10 0.00 0.71 0.00 0.00 56.30 57.14 3hn0 h ASN 86 Cb 0.05 -0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 3hn0 h ASN 86 CO -0.11 0.16 -0.05 -0.07 -1.29 0.00 0.00 177.43 176.07 3hn0 h LEU 87 N 0.32 1.03 -0.56 0.34 3.38 -0.81 -1.21 115.31 117.79 3hn0 h LEU 87 Ca 0.15 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3hn0 h LEU 87 Cb 0.09 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3hn0 h LEU 87 CO -0.13 1.10 0.29 0.22 0.09 0.00 0.00 178.44 180.02 3hn0 h TYR 88 N 0.94 0.78 -0.13 1.13 3.20 -0.79 -0.43 116.97 121.67 3hn0 h TYR 88 Ca 0.16 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 3hn0 h TYR 88 Cb 0.61 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3hn0 h TYR 88 CO 0.04 0.58 -0.26 -0.91 -1.64 0.00 0.00 178.16 175.97 3hn0 h ASN 89 N 0.75 0.22 -0.09 -2.11 2.35 -0.80 -1.55 115.58 114.35 3hn0 h ASN 89 Ca 0.19 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 3hn0 h ASN 89 Cb 0.08 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.38 3hn0 h ASN 89 CO -0.03 0.49 0.00 0.29 -1.65 0.00 0.00 177.43 176.54 3hn0 n LYS 90 N -4.15 1.38 -0.49 0.81 5.02 -0.48 -4.90 118.16 115.34 3hn0 n LYS 90 Ca -0.01 -0.57 0.00 0.00 -2.02 0.00 0.00 58.31 55.71 3hn0 n LYS 90 Cb 0.37 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 3hn0 n LYS 90 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hn0 n GLY 91 N 0.94 0.75 3.74 0.72 0.00 -0.58 -5.05 105.19 105.71 3hn0 n GLY 91 Ca 0.14 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3hn0 n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hn0 s ILE 92 N -2.00 3.12 -1.27 -0.61 -1.09 -0.23 -4.90 121.20 114.22 3hn0 s ILE 92 Ca 0.00 0.92 -0.18 0.00 -2.23 0.00 0.00 60.65 59.16 3hn0 s ILE 92 Cb 0.00 -3.59 0.07 0.00 -1.58 0.00 0.00 42.46 37.36 3hn0 s ILE 92 CO 0.00 0.14 1.70 -0.54 -1.23 0.00 0.00 174.94 175.01 3hn0 s LYS 93 N -0.16 3.95 0.13 2.79 -0.14 -1.26 -4.46 119.74 120.58 3hn0 s LYS 93 Ca 0.57 -1.92 0.04 0.00 -1.36 0.00 0.00 55.97 53.30 3hn0 s LYS 93 Cb -0.37 -5.50 -0.04 0.00 -1.68 0.00 0.00 37.83 30.23 3hn0 s LYS 93 CO 0.39 -2.24 -0.11 0.96 -0.76 0.00 0.00 175.35 173.60 3hn0 s ILE 94 N 4.22 1.11 0.09 2.17 -4.36 -1.26 -4.29 121.20 118.88 3hn0 s ILE 94 Ca 0.53 -1.88 0.04 0.00 -0.26 0.00 0.00 60.65 59.08 3hn0 s ILE 94 Cb 0.03 -1.64 -0.03 0.00 1.25 0.00 0.00 42.46 42.07 3hn0 s ILE 94 CO 0.06 -0.64 -0.11 -0.54 0.24 0.00 0.00 174.94 173.95 3hn0 s LYS 95 N -3.29 0.83 -0.21 0.37 1.02 -0.16 -4.93 119.74 113.37 3hn0 s LYS 95 Ca 0.12 -1.09 -0.26 0.00 0.02 0.00 0.00 55.97 54.76 3hn0 s LYS 95 Cb -0.00 -0.61 -0.00 0.00 -0.52 0.00 0.00 37.83 36.70 3hn0 s LYS 95 CO 0.01 0.11 0.91 -1.17 -0.92 0.00 0.00 175.35 174.28 3hn0 s LEU 96 N -2.23 4.12 -0.07 3.17 2.96 -0.69 -1.20 118.68 124.74 3hn0 s LEU 96 Ca 0.03 1.21 -0.25 0.00 -0.22 0.00 0.00 54.13 54.90 3hn0 s LEU 96 Cb -0.05 -3.33 -0.25 0.00 0.50 0.00 0.00 46.19 43.05 3hn0 s LEU 96 CO 0.01 -0.53 0.95 0.00 -1.32 0.00 0.00 176.35 175.46 3hn0 h ALA 97 N 7.49 0.01 0.00 5.97 0.00 -0.81 -3.42 119.26 128.49 3hn0 h ALA 97 Ca -0.24 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3hn0 h ALA 97 Cb 1.09 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3hn0 h ALA 97 CO 0.90 0.10 0.00 0.41 0.00 0.00 0.00 179.25 180.66 3hn0 n GLY 98 N 1.25 -1.40 3.00 0.00 0.00 -1.19 -0.49 105.19 106.36 3hn0 n GLY 98 Ca -0.10 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 3hn0 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hn0 n PRO 100 N 3.87 2.21 -3.73 0.00 -0.04 -1.26 -1.79 135.00 134.26 3hn0 n PRO 100 Ca -0.23 -1.86 -0.12 0.00 -0.04 0.00 0.00 63.50 61.25 3hn0 n PRO 100 Cb 0.52 -1.45 -0.11 0.00 -0.04 0.00 0.00 33.50 32.42 3hn0 n PRO 100 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3hn0 s ILE 101 N -1.98 -0.01 0.00 0.52 2.07 -1.24 -1.53 121.20 119.04 3hn0 s ILE 101 Ca 0.27 0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.54 3hn0 s ILE 101 Cb 0.19 -0.54 0.00 0.00 0.13 0.00 0.00 42.46 42.25 3hn0 s ILE 101 CO 0.31 0.01 0.00 0.79 -1.91 0.00 0.00 174.94 174.14 3hn0 n TRP 102 N 3.30 0.00 -2.03 3.50 7.02 -0.61 -4.57 117.44 124.04 3hn0 n TRP 102 Ca -0.16 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 55.90 3hn0 n TRP 102 Cb 0.57 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.43 3hn0 n TRP 102 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 3hn0 s GLY 103 N -0.90 2.25 0.00 6.99 0.00 0.16 -4.75 107.32 111.06 3hn0 s GLY 103 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 44.72 46.02 3hn0 s GLY 103 CO 0.00 2.30 0.00 -0.37 0.00 0.00 0.00 173.10 175.03 3hn0 n THR 104 N 2.58 0.00 -1.56 0.90 5.66 -1.26 -4.94 114.28 115.67 3hn0 n THR 104 Ca 0.08 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.77 3hn0 n THR 104 Cb 0.40 -0.04 0.07 0.00 -1.55 0.00 0.00 70.33 69.21 3hn0 n THR 104 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3hn0 s LEU 105 N 0.00 2.84 0.10 1.09 1.43 -1.26 -4.72 118.68 118.16 3hn0 s LEU 105 Ca 0.00 1.45 0.08 0.00 -1.03 0.00 0.00 54.13 54.63 3hn0 s LEU 105 Cb 0.00 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.01 3hn0 s LEU 105 CO 0.00 -1.74 -0.21 -0.31 0.23 0.00 0.00 176.35 174.32 3hn0 s TYR 106 N -3.10 1.78 -0.11 0.29 1.51 -0.53 -2.40 117.35 114.79 3hn0 s TYR 106 Ca 0.60 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 56.10 3hn0 s TYR 106 Cb -0.14 -0.98 -0.05 0.00 -0.11 0.00 0.00 41.96 40.68 3hn0 s TYR 106 CO 0.55 0.20 0.33 -0.51 -1.11 0.00 0.00 175.55 175.01 3hn0 s LEU 107 N -1.91 4.33 0.16 -1.29 1.02 0.05 -1.66 118.68 119.37 3hn0 s LEU 107 Ca 0.06 0.67 0.10 0.00 0.02 0.00 0.00 54.13 54.98 3hn0 s LEU 107 Cb -0.10 -2.44 -0.04 0.00 0.02 0.00 0.00 46.19 43.63 3hn0 s LEU 107 CO 0.04 0.18 -0.22 0.68 0.02 0.00 0.00 176.35 177.05 3hn0 s VAL 108 N -0.10 2.06 0.04 -1.59 -7.23 0.14 -0.65 120.40 113.08 3hn0 s VAL 108 Ca 0.20 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.38 3hn0 s VAL 108 Cb -0.14 -1.92 0.01 0.00 0.56 0.00 0.00 36.38 34.89 3hn0 s VAL 108 CO 0.07 -0.13 0.26 -1.61 -0.31 0.00 0.00 175.10 173.38 3hn0 s GLU 109 N -2.47 0.76 0.03 4.82 2.02 0.14 -1.83 118.70 122.17 3hn0 s GLU 109 Ca 0.16 -0.55 -0.04 0.00 0.02 0.00 0.00 54.97 54.55 3hn0 s GLU 109 Cb -0.08 0.32 -0.04 0.00 0.10 0.00 0.00 34.13 34.43 3hn0 s GLU 109 CO 0.07 -0.23 0.24 0.15 0.02 0.00 0.00 175.26 175.51 3hn0 s LYS 110 N -2.54 3.51 -0.09 1.61 1.02 -0.48 -0.40 119.74 122.37 3hn0 s LYS 110 Ca -0.05 -0.22 -0.01 0.00 0.02 0.00 0.00 55.97 55.71 3hn0 s LYS 110 Cb -0.01 -3.05 -0.03 0.00 -0.52 0.00 0.00 37.83 34.22 3hn0 s LYS 110 CO -0.03 0.63 -0.06 0.95 -0.92 0.00 0.00 175.35 175.92 3hn0 s THR 111 N -1.39 3.78 0.60 2.17 -4.23 -1.24 -3.24 115.64 112.09 3hn0 s THR 111 Ca 0.30 -0.43 -0.18 0.00 -1.18 0.00 0.00 61.69 60.21 3hn0 s THR 111 Cb -0.13 -2.58 -0.03 0.00 1.34 0.00 0.00 72.50 71.10 3hn0 s THR 111 CO 0.20 0.57 1.13 -2.84 -0.54 0.00 0.00 174.62 173.14 3hn0 s PRO 112 N -0.46 3.07 -1.12 3.99 0.02 -1.26 -4.90 135.00 134.33 3hn0 s PRO 112 Ca 0.07 1.56 -0.14 0.00 0.02 0.00 0.00 61.00 62.51 3hn0 s PRO 112 Cb -0.12 -1.97 0.19 0.00 0.02 0.00 0.00 34.50 32.62 3hn0 s PRO 112 CO 0.02 -1.07 1.29 -1.17 -0.33 0.00 0.00 177.00 175.74 3hn0 s LEU 113 N -4.27 5.40 0.40 -5.54 2.96 -1.20 -4.86 118.68 111.57 3hn0 s LEU 113 Ca 0.71 -2.95 0.14 0.00 -0.22 0.00 0.00 54.13 51.81 3hn0 s LEU 113 Cb -0.23 -2.35 0.85 0.00 0.50 0.00 0.00 46.19 44.95 3hn0 s LEU 113 CO 0.33 -0.70 1.89 0.11 -1.32 0.00 0.00 176.35 176.67 3hn0 h LYS 114 N 7.36 0.00 -3.50 1.98 6.56 -1.93 -3.42 116.57 123.62 3hn0 h LYS 114 Ca 0.25 0.00 -0.35 0.00 -1.06 0.00 0.00 60.65 59.49 3hn0 h LYS 114 Cb 0.91 0.00 -0.36 0.00 -0.57 0.00 0.00 32.23 32.20 3hn0 h LYS 114 CO 1.15 0.30 -0.74 -1.21 -2.06 0.00 0.00 179.45 176.89 3hn0 s GLU 115 N -4.33 0.09 0.08 3.15 0.41 -1.26 -5.05 118.70 111.79 3hn0 s GLU 115 Ca -0.03 0.23 0.23 0.00 -0.41 0.00 0.00 54.97 54.99 3hn0 s GLU 115 Cb 0.15 -0.48 0.92 0.00 -1.78 0.00 0.00 34.13 32.93 3hn0 s GLU 115 CO 0.71 -0.24 1.71 -0.35 -0.49 0.00 0.00 175.26 176.60 3hn0 n PRO 116 N 4.73 0.08 -1.77 0.39 -0.04 -1.26 -4.66 135.00 132.47 3hn0 n PRO 116 Ca -0.15 0.19 -0.41 0.00 -0.04 0.00 0.00 63.50 63.09 3hn0 n PRO 116 Cb 0.50 -1.61 -0.01 0.00 -0.04 0.00 0.00 33.50 32.34 3hn0 n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hn0 s ALA 117 N -3.07 3.68 -0.37 0.55 0.00 -1.26 -4.55 121.76 116.75 3hn0 s ALA 117 Ca 0.09 1.59 -0.13 0.00 0.00 0.00 0.00 51.96 53.52 3hn0 s ALA 117 Cb 0.13 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3hn0 s ALA 117 CO 0.43 -1.04 0.25 -1.17 0.00 0.00 0.00 175.76 174.23 3hn0 s LEU 118 N -1.17 4.72 -0.01 0.00 2.96 0.96 -4.14 118.68 122.00 3hn0 s LEU 118 Ca 0.59 -0.64 -0.30 0.00 -0.22 0.00 0.00 54.13 53.56 3hn0 s LEU 118 Cb -0.48 -2.13 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 3hn0 s LEU 118 CO 0.55 -0.32 1.01 -0.31 -1.32 0.00 0.00 176.35 175.96 3hn0 s TYR 119 N 1.69 3.61 0.04 5.38 1.51 0.50 -1.47 117.35 128.60 3hn0 s TYR 119 Ca 0.05 1.64 0.06 0.00 -1.01 0.00 0.00 57.07 57.80 3hn0 s TYR 119 Cb -0.18 -3.17 -0.02 0.00 -0.11 0.00 0.00 41.96 38.48 3hn0 s TYR 119 CO 0.10 -0.19 -0.16 0.08 -1.11 0.00 0.00 175.55 174.26 3hn0 s VAL 120 N 1.17 1.29 0.36 0.71 1.01 -0.30 -2.18 120.40 122.47 3hn0 s VAL 120 Ca 0.52 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.55 3hn0 s VAL 120 Cb -0.22 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 3hn0 s VAL 120 CO 0.27 0.10 0.21 0.72 0.00 0.00 0.00 175.10 176.40 3hn0 s PHE 121 N -0.79 2.73 -0.88 5.22 -0.71 -1.26 -4.36 117.98 117.94 3hn0 s PHE 121 Ca 0.04 -0.41 -0.03 0.00 -1.04 0.00 0.00 56.93 55.49 3hn0 s PHE 121 Cb -0.08 -1.80 0.00 0.00 -1.21 0.00 0.00 43.02 39.93 3hn0 s PHE 121 CO 0.01 0.21 0.75 0.41 -1.34 0.00 0.00 175.22 175.26 3hn0 n GLY 122 N -1.27 -0.10 3.57 1.99 0.00 -0.80 -3.69 105.19 104.89 3hn0 n GLY 122 Ca -0.01 -0.06 -0.51 0.00 0.00 0.00 0.00 46.02 45.43 3hn0 n GLY 122 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hn0 n ASN 123 N -2.08 1.24 0.00 1.61 2.85 -1.26 -1.25 115.26 116.38 3hn0 n ASN 123 Ca -0.11 1.13 0.00 0.00 -0.11 0.00 0.00 54.58 55.50 3hn0 n ASN 123 Cb 0.58 -1.16 0.00 0.00 1.24 0.00 0.00 39.78 40.44 3hn0 n ASN 123 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3hn0 n GLY 124 N 2.19 0.86 1.44 8.20 0.00 -1.26 -4.98 105.19 111.63 3hn0 n GLY 124 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 3hn0 n GLY 124 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hn0 n THR 125 N -2.18 0.00 -0.21 2.61 -2.24 -0.38 -4.79 114.28 107.09 3hn0 n THR 125 Ca 0.00 -0.99 -0.05 0.00 -2.27 0.00 0.00 64.05 60.74 3hn0 n THR 125 Cb 0.00 0.29 0.01 0.00 -2.10 0.00 0.00 70.33 68.53 3hn0 n THR 125 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3hn0 h THR 126 N 1.21 0.17 -0.48 4.28 2.02 -1.94 0.42 112.91 118.58 3hn0 h THR 126 Ca -0.15 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 3hn0 h THR 126 Cb 0.51 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 3hn0 h THR 126 CO 0.24 0.00 0.15 1.55 0.37 0.00 0.00 175.52 177.83 3hn0 h PRO 127 N -0.15 0.71 -0.30 6.66 0.13 -1.83 0.11 132.00 137.32 3hn0 h PRO 127 Ca 0.24 -0.12 -0.08 0.00 -0.87 0.00 0.00 66.00 65.17 3hn0 h PRO 127 Cb 0.55 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 3hn0 h PRO 127 CO -0.69 0.62 -0.11 0.22 -0.23 0.00 0.00 178.00 177.81 3hn0 h ASP 128 N 0.69 0.63 -0.34 1.44 3.58 -1.38 -2.47 116.42 118.58 3hn0 h ASP 128 Ca 0.16 -0.39 -0.06 0.00 0.42 0.00 0.00 57.03 57.16 3hn0 h ASP 128 Cb 0.21 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 3hn0 h ASP 128 CO -0.01 0.87 -0.04 0.40 -2.88 0.00 0.00 179.24 177.59 3hn0 h ILE 129 N 0.38 1.27 -0.57 2.25 2.04 -0.19 0.03 117.51 122.72 3hn0 h ILE 129 Ca 0.07 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.85 3hn0 h ILE 129 Cb 0.62 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 3hn0 h ILE 129 CO 0.04 0.34 0.23 -0.07 0.00 0.00 0.00 178.15 178.70 3hn0 h LEU 130 N 0.42 0.75 -0.21 1.44 3.38 -0.87 -0.62 115.31 119.59 3hn0 h LEU 130 Ca 0.09 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3hn0 h LEU 130 Cb 0.52 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3hn0 h LEU 130 CO 0.03 0.67 -0.03 0.74 0.09 0.00 0.00 178.44 179.94 3hn0 h THR 131 N 0.82 1.27 -0.49 0.22 2.02 -0.98 -0.50 112.91 115.26 3hn0 h THR 131 Ca 0.20 -0.97 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 3hn0 h THR 131 Cb 0.15 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 3hn0 h THR 131 CO -0.02 0.30 0.07 0.03 0.37 0.00 0.00 175.52 176.26 3hn0 h ARG 132 N 0.14 0.83 -0.44 6.66 3.08 -0.83 -0.70 114.38 123.12 3hn0 h ARG 132 Ca 0.06 -0.23 0.04 0.00 0.07 0.00 0.00 59.98 59.92 3hn0 h ARG 132 Cb 0.45 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 3hn0 h ARG 132 CO 0.02 0.83 0.20 -0.92 -1.07 0.00 0.00 179.97 179.03 3hn0 h TYR 133 N 0.70 0.37 -0.05 3.04 3.20 -1.04 0.28 116.97 123.47 3hn0 h TYR 133 Ca 0.15 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 3hn0 h TYR 133 Cb 0.42 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 3hn0 h TYR 133 CO 0.03 0.18 0.02 -0.92 -1.64 0.00 0.00 178.16 175.83 3hn0 h TYR 134 N 0.41 0.09 -0.31 -3.82 3.20 -0.86 -0.57 116.97 115.10 3hn0 h TYR 134 Ca 0.19 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 3hn0 h TYR 134 Cb 0.12 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 3hn0 h TYR 134 CO -0.11 0.23 0.01 -0.07 -1.64 0.00 0.00 178.16 176.58 3hn0 h LEU 135 N -0.08 0.44 0.11 2.82 3.38 -0.95 -1.04 115.31 119.98 3hn0 h LEU 135 Ca 0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3hn0 h LEU 135 Cb 0.18 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3hn0 h LEU 135 CO -0.00 0.50 -0.05 1.23 0.09 0.00 0.00 178.44 180.20 3hn0 h GLY 136 N 0.77 -0.15 1.16 0.83 0.00 -0.75 -0.18 103.07 104.76 3hn0 h GLY 136 Ca 0.10 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.52 3hn0 h GLY 136 CO 0.01 -0.05 0.49 3.21 0.00 0.00 0.00 176.54 180.19 3hn0 h ARG 137 N -0.36 0.87 -0.01 4.80 2.47 -0.75 -1.95 114.38 119.46 3hn0 h ARG 137 Ca -0.01 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 3hn0 h ARG 137 Cb 0.29 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 3hn0 h ARG 137 CO 0.02 0.58 -0.10 1.04 0.56 0.00 0.00 179.97 182.07 3hn0 n GLN 138 N -4.45 1.11 -3.79 0.04 1.13 -0.43 -4.96 117.38 106.04 3hn0 n GLN 138 Ca 0.09 -0.55 -0.25 0.00 -1.94 0.00 0.00 57.00 54.35 3hn0 n GLN 138 Cb 0.12 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 29.01 3hn0 n GLN 138 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3hn0 n ARG 139 N -0.46 -5.37 -4.01 -1.09 1.74 -0.28 -4.99 116.66 102.21 3hn0 n ARG 139 Ca 0.16 0.62 -0.35 0.00 -0.77 0.00 0.00 57.85 57.52 3hn0 n ARG 139 Cb 0.31 -5.36 -0.09 0.00 -1.02 0.00 0.00 32.46 26.31 3hn0 n ARG 139 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hn0 s LEU 140 N -6.97 3.94 -0.48 0.55 1.43 -0.24 -5.04 118.68 111.88 3hn0 s LEU 140 Ca 0.32 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.64 3hn0 s LEU 140 Cb -0.16 -1.98 0.53 0.00 0.03 0.00 0.00 46.19 44.62 3hn0 s LEU 140 CO 0.81 0.25 1.78 -0.90 0.23 0.00 0.00 176.35 178.53 3hn0 n ASP 141 N 3.00 5.01 -4.75 2.29 5.75 -1.26 -4.66 116.55 121.93 3hn0 n ASP 141 Ca -0.17 -3.73 -0.41 0.00 -0.01 0.00 0.00 54.79 50.46 3hn0 n ASP 141 Cb 0.53 -0.79 -0.03 0.00 -1.03 0.00 0.00 41.12 39.81 3hn0 n ASP 141 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3hn0 s TYR 142 N -3.51 3.21 0.37 2.11 2.02 -1.26 -4.99 117.35 115.29 3hn0 s TYR 142 Ca 0.56 1.34 -0.26 0.00 -0.37 0.00 0.00 57.07 58.35 3hn0 s TYR 142 Cb 0.47 -3.60 -0.09 0.00 -0.40 0.00 0.00 41.96 38.34 3hn0 s TYR 142 CO 0.04 -1.74 1.15 -1.25 -1.57 0.00 0.00 175.55 172.17 3hn0 s PRO 143 N -0.92 4.21 -0.15 -1.71 0.04 -1.26 -4.83 135.00 130.37 3hn0 s PRO 143 Ca 0.52 1.81 -0.04 0.00 0.04 0.00 0.00 61.00 63.33 3hn0 s PRO 143 Cb -0.37 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 3hn0 s PRO 143 CO 0.44 -0.18 -0.01 -0.51 0.04 0.00 0.00 177.00 176.79 3hn0 s LEU 144 N -2.26 3.42 -0.11 -3.56 1.43 -1.26 -0.02 118.68 116.32 3hn0 s LEU 144 Ca 0.54 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.62 3hn0 s LEU 144 Cb -0.30 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.10 3hn0 s LEU 144 CO 0.38 0.21 -0.17 0.21 0.23 0.00 0.00 176.35 177.21 3hn0 s ASN 145 N 0.14 2.55 -0.10 2.29 3.84 -0.54 -4.92 114.94 118.20 3hn0 s ASN 145 Ca 0.00 -0.46 0.14 0.00 0.21 0.00 0.00 52.86 52.76 3hn0 s ASN 145 Cb -0.13 -1.15 0.45 0.00 -0.55 0.00 0.00 41.25 39.86 3hn0 s ASN 145 CO 0.02 0.04 1.37 -1.22 -2.79 0.00 0.00 177.10 174.52 3hn0 n TYR 146 N 4.06 0.79 0.22 0.43 4.01 -1.26 -1.15 117.16 124.26 3hn0 n TYR 146 Ca -0.20 -0.70 0.15 0.00 -0.16 0.00 0.00 57.90 56.99 3hn0 n TYR 146 Cb 0.52 -0.19 0.80 0.00 -0.31 0.00 0.00 39.34 40.15 3hn0 n TYR 146 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hn0 h ALA 147 N 2.04 1.84 -3.20 -0.72 0.00 -1.95 -3.24 119.26 114.02 3hn0 h ALA 147 Ca 0.00 -0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 3hn0 h ALA 147 Cb 1.15 0.01 -0.36 0.00 0.00 0.00 0.00 17.79 18.60 3hn0 h ALA 147 CO 0.13 -0.19 -0.46 -0.06 0.00 0.00 0.00 179.25 178.68 3hn0 s PHE 148 N -4.76 3.45 -2.21 0.00 0.08 -1.26 -4.96 117.98 108.31 3hn0 s PHE 148 Ca -0.05 -2.70 0.20 0.00 0.12 0.00 0.00 56.93 54.50 3hn0 s PHE 148 Cb 0.16 -3.16 0.77 0.00 -0.57 0.00 0.00 43.02 40.22 3hn0 s PHE 148 CO 0.59 -0.87 1.55 -1.71 -0.10 0.00 0.00 175.22 174.68 3hn0 n ASN 149 N 3.77 1.41 -4.41 1.36 5.15 -1.22 -4.17 115.26 117.15 3hn0 n ASN 149 Ca 0.05 -1.69 -0.21 0.00 -0.60 0.00 0.00 54.58 52.13 3hn0 n ASN 149 Cb 0.38 -0.10 -0.10 0.00 -0.53 0.00 0.00 39.78 39.44 3hn0 n ASN 149 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3hn0 s THR 150 N -1.81 1.87 -0.10 -0.44 -4.23 -1.26 -1.91 115.64 107.77 3hn0 s THR 150 Ca 0.31 -2.22 0.27 0.00 -1.18 0.00 0.00 61.69 58.86 3hn0 s THR 150 Cb 0.16 -2.25 0.32 0.00 1.34 0.00 0.00 72.50 72.07 3hn0 s THR 150 CO 0.25 -0.45 1.79 0.00 -0.54 0.00 0.00 174.62 175.67 3hn0 h ALA 151 N 2.39 0.98 -0.21 3.99 0.00 -1.95 -2.55 119.26 121.90 3hn0 h ALA 151 Ca -0.39 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 3hn0 h ALA 151 Cb 1.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3hn0 h ALA 151 CO 0.64 0.10 -0.07 0.78 0.00 0.00 0.00 179.25 180.69 3hn0 h GLY 152 N 2.83 0.45 1.26 0.00 0.00 -1.96 -2.27 103.07 103.37 3hn0 h GLY 152 Ca -0.00 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 46.96 3hn0 h GLY 152 CO 0.01 0.35 0.48 0.83 0.00 0.00 0.00 176.54 178.21 3hn0 h GLU 153 N 0.13 0.93 -0.15 4.80 5.08 -1.83 -1.90 114.58 121.63 3hn0 h GLU 153 Ca 0.05 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3hn0 h GLU 153 Cb 0.54 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 3hn0 h GLU 153 CO 0.03 0.61 -0.15 0.82 -1.00 0.00 0.00 179.01 179.32 3hn0 h ILE 154 N 0.95 1.34 -0.42 3.13 2.04 -1.36 0.41 117.51 123.61 3hn0 h ILE 154 Ca 0.27 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.83 3hn0 h ILE 154 Cb -0.07 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 3hn0 h ILE 154 CO -0.06 0.38 0.27 0.74 0.00 0.00 0.00 178.15 179.48 3hn0 h THR 155 N -0.00 1.12 0.38 -0.27 2.02 -1.31 0.98 112.91 115.83 3hn0 h THR 155 Ca 0.02 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 3hn0 h THR 155 Cb 0.68 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 3hn0 h THR 155 CO 0.04 0.12 -0.46 -0.61 0.37 0.00 0.00 175.52 174.97 3hn0 h GLN 156 N 0.56 -0.83 -1.02 6.66 5.75 -1.29 0.10 115.11 125.04 3hn0 h GLN 156 Ca 0.15 0.06 0.25 0.00 -0.15 0.00 0.00 58.65 58.96 3hn0 h GLN 156 Cb -0.03 0.19 -0.09 0.00 1.07 0.00 0.00 27.48 28.61 3hn0 h GLN 156 CO -0.03 -0.56 0.65 0.78 -2.65 0.00 0.00 178.83 177.02 3hn0 h GLY 157 N -0.86 1.29 1.15 2.39 0.00 0.40 0.49 103.07 107.94 3hn0 h GLY 157 Ca -0.05 -0.23 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 3hn0 h GLY 157 CO -0.10 -0.12 -0.10 -2.22 0.00 0.00 0.00 176.54 174.00 3hn0 h ILE 158 N 0.45 1.27 -0.35 2.60 2.04 0.13 -2.03 117.51 121.62 3hn0 h ILE 158 Ca 0.58 -1.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 3hn0 h ILE 158 Cb 1.38 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 3hn0 h ILE 158 CO -0.31 0.44 0.14 -0.07 0.00 0.00 0.00 178.15 178.36 3hn0 h LEU 159 N 0.88 0.48 -2.07 1.44 3.38 0.24 -2.58 115.31 117.08 3hn0 h LEU 159 Ca 0.14 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3hn0 h LEU 159 Cb 0.66 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3hn0 h LEU 159 CO 0.05 0.51 -0.02 0.00 0.09 0.00 0.00 178.44 179.06 3hn0 h ALA 160 N 0.99 1.85 0.00 1.53 0.00 -0.32 -3.46 119.26 119.84 3hn0 h ALA 160 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3hn0 h ALA 160 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hn0 h ALA 160 CO -0.01 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3hn0 n GLY 161 N -1.42 0.78 0.14 0.00 0.00 -0.93 -4.97 105.19 98.79 3hn0 n GLY 161 Ca -0.03 -0.29 0.11 0.00 0.00 0.00 0.00 46.02 45.81 3hn0 n GLY 161 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3hn0 h LYS 162 N 0.85 0.00 -4.94 1.61 5.09 -1.63 -3.46 116.57 114.08 3hn0 h LYS 162 Ca 0.00 0.00 -0.66 0.00 0.09 0.00 0.00 60.65 60.08 3hn0 h LYS 162 Cb 0.00 0.00 -0.27 0.00 0.10 0.00 0.00 32.23 32.06 3hn0 h LYS 162 CO 0.00 0.03 -0.70 0.08 -2.09 0.00 0.00 179.45 176.77 3hn0 s VAL 163 N -3.29 3.53 -1.48 0.07 1.01 -1.13 -4.98 120.40 114.13 3hn0 s VAL 163 Ca 0.02 -0.56 0.20 0.00 0.00 0.00 0.00 61.98 61.64 3hn0 s VAL 163 Cb 0.08 -2.67 -0.09 0.00 0.00 0.00 0.00 36.38 33.70 3hn0 s VAL 163 CO 0.76 0.32 0.93 0.59 0.00 0.00 0.00 175.10 177.70 3hn0 n ASN 164 N 4.81 1.50 -3.64 3.32 5.03 -1.26 -4.67 115.26 120.36 3hn0 n ASN 164 Ca -0.17 -1.25 -0.06 0.00 0.87 0.00 0.00 54.58 53.97 3hn0 n ASN 164 Cb 0.50 0.69 -0.07 0.00 -1.02 0.00 0.00 39.78 39.88 3hn0 n ASN 164 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 3hn0 s ARG 165 N -2.50 0.63 0.19 3.52 3.52 -1.26 -1.38 118.95 121.67 3hn0 s ARG 165 Ca 0.13 1.12 -0.23 0.00 -0.13 0.00 0.00 55.73 56.63 3hn0 s ARG 165 Cb 0.16 0.17 0.06 0.00 -1.56 0.00 0.00 34.95 33.77 3hn0 s ARG 165 CO 0.63 -0.14 0.63 0.00 -0.81 0.00 0.00 175.30 175.61 3hn0 s ALA 166 N 1.65 -1.51 -0.12 6.12 0.00 -0.76 -0.37 121.76 126.77 3hn0 s ALA 166 Ca -0.10 0.30 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 3hn0 s ALA 166 Cb -0.05 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 3hn0 s ALA 166 CO -0.19 -0.84 0.04 0.14 0.00 0.00 0.00 175.76 174.91 3hn0 s VAL 167 N -3.78 4.60 0.01 0.00 -7.23 -0.93 -0.68 120.40 112.39 3hn0 s VAL 167 Ca 0.04 -0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.08 3hn0 s VAL 167 Cb -0.02 -2.98 -0.01 0.00 0.56 0.00 0.00 36.38 33.92 3hn0 s VAL 167 CO -0.08 0.57 -0.02 -0.76 -0.31 0.00 0.00 175.10 174.50 3hn0 s LEU 168 N -0.55 2.13 0.37 1.32 1.43 -0.67 -4.73 118.68 117.99 3hn0 s LEU 168 Ca 0.10 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 52.99 3hn0 s LEU 168 Cb -0.12 0.03 -0.03 0.00 0.03 0.00 0.00 46.19 46.10 3hn0 s LEU 168 CO 0.02 -0.16 0.27 -0.83 0.23 0.00 0.00 176.35 175.88 3hn0 s GLY 169 N -0.82 1.99 0.48 -3.19 0.00 -1.26 -1.45 107.32 103.07 3hn0 s GLY 169 Ca -0.09 -1.82 -0.22 0.00 0.00 0.00 0.00 44.72 42.60 3hn0 s GLY 169 CO -0.00 -1.70 1.14 -0.54 0.00 0.00 0.00 173.10 172.00 3hn0 s GLU 170 N -3.99 3.67 0.00 2.90 0.41 -1.26 -1.54 118.70 118.88 3hn0 s GLU 170 Ca 0.42 1.68 0.29 0.00 -0.41 0.00 0.00 54.97 56.96 3hn0 s GLU 170 Cb -0.03 -2.28 1.33 0.00 -1.78 0.00 0.00 34.13 31.37 3hn0 s GLU 170 CO 0.26 -0.60 1.93 -0.35 -0.49 0.00 0.00 175.26 176.00 3hn0 n PRO 171 N -0.73 0.56 0.16 0.39 -0.04 -1.26 -4.60 135.00 129.48 3hn0 n PRO 171 Ca 0.09 -0.13 0.02 0.00 -0.04 0.00 0.00 63.50 63.44 3hn0 n PRO 171 Cb 0.49 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.82 3hn0 n PRO 171 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3hn0 h PHE 172 N 0.31 0.09 -0.43 0.54 0.04 -1.70 -1.22 116.94 114.58 3hn0 h PHE 172 Ca 0.00 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 3hn0 h PHE 172 Cb 0.33 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 3hn0 h PHE 172 CO 0.00 0.37 0.26 1.25 -0.60 0.00 0.00 178.31 179.60 3hn0 h LEU 173 N 0.08 0.51 -0.74 1.54 5.85 -1.59 0.92 115.31 121.88 3hn0 h LEU 173 Ca 0.01 -0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 3hn0 h LEU 173 Cb 0.56 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 3hn0 h LEU 173 CO 0.04 0.41 0.03 0.28 -0.34 0.00 0.00 178.44 178.86 3hn0 h SER 174 N 0.57 0.96 -0.38 1.25 0.02 -1.54 -0.35 113.55 114.08 3hn0 h SER 174 Ca 0.15 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.78 3hn0 h SER 174 Cb -0.01 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 3hn0 h SER 174 CO -0.03 1.00 -0.06 0.40 -1.14 0.00 0.00 176.83 177.00 3hn0 h ILE 175 N 0.92 1.27 0.25 3.27 2.04 -1.02 -2.10 117.51 122.14 3hn0 h ILE 175 Ca 0.17 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 3hn0 h ILE 175 Cb 0.49 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3hn0 h ILE 175 CO 0.02 0.37 -0.12 0.00 0.00 0.00 0.00 178.15 178.42 3hn0 h ALA 176 N 0.85 -0.34 -0.12 1.87 0.00 -0.82 -3.04 119.26 117.66 3hn0 h ALA 176 Ca 0.10 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.88 3hn0 h ALA 176 Cb 0.56 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 3hn0 h ALA 176 CO 0.03 -0.55 0.11 -0.07 0.00 0.00 0.00 179.25 178.77 3hn0 h LEU 177 N -0.61 0.00 0.12 0.00 3.38 -1.01 -2.85 115.31 114.34 3hn0 h LEU 177 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3hn0 h LEU 177 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3hn0 h LEU 177 CO 0.06 0.00 -0.06 -0.09 0.09 0.00 0.00 178.44 178.44 3hn0 h ARG 178 N 0.00 -0.15 -0.38 1.13 2.43 -1.36 -3.26 114.38 112.80 3hn0 h ARG 178 Ca 0.06 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.34 3hn0 h ARG 178 Cb 0.28 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3hn0 h ARG 178 CO -0.00 0.27 0.33 0.87 -1.51 0.00 0.00 179.97 179.93 3hn0 h LYS 179 N -0.94 0.00 -3.87 0.20 6.56 -1.41 -3.39 116.57 113.71 3hn0 h LYS 179 Ca -0.02 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 59.00 3hn0 h LYS 179 Cb 0.48 0.00 -0.39 0.00 -0.57 0.00 0.00 32.23 31.75 3hn0 h LYS 179 CO 0.03 0.00 -0.76 0.34 -2.06 0.00 0.00 179.45 176.99 3hn0 s ASP 180 N -5.87 3.70 0.55 0.86 -1.08 -1.09 -4.99 116.67 108.75 3hn0 s ASP 180 Ca -0.05 -1.29 0.33 0.00 -0.52 0.00 0.00 52.55 51.02 3hn0 s ASP 180 Cb 0.17 -0.93 1.51 0.00 -1.46 0.00 0.00 42.92 42.21 3hn0 s ASP 180 CO 0.63 -0.33 2.05 0.77 0.52 0.00 0.00 175.17 178.81 3hn0 h SER 181 N 8.06 0.00 0.72 -0.34 4.64 -1.78 -1.99 113.55 122.87 3hn0 h SER 181 Ca -0.15 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.08 3hn0 h SER 181 Cb 1.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 3hn0 h SER 181 CO 0.42 0.06 -0.41 0.77 -0.87 0.00 0.00 176.83 176.79 3hn0 h SER 182 N 0.00 0.00 -3.20 4.97 4.64 -1.92 -3.44 113.55 114.60 3hn0 h SER 182 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 3hn0 h SER 182 Cb 0.42 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.53 3hn0 h SER 182 CO 0.01 0.41 0.65 -0.22 -0.87 0.00 0.00 176.83 176.80 3hn0 s LEU 183 N -7.31 4.39 0.02 5.97 2.96 -0.75 -3.63 118.68 120.34 3hn0 s LEU 183 Ca -0.01 2.27 0.00 0.00 -0.22 0.00 0.00 54.13 56.17 3hn0 s LEU 183 Cb 0.12 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.20 3hn0 s LEU 183 CO 0.70 -0.54 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.55 3hn0 s ARG 184 N 0.61 0.30 0.04 1.98 3.52 0.47 -4.95 118.95 120.91 3hn0 s ARG 184 Ca 0.60 -0.56 -0.30 0.00 -0.13 0.00 0.00 55.73 55.33 3hn0 s ARG 184 Cb -0.35 0.06 -0.05 0.00 -1.56 0.00 0.00 34.95 33.06 3hn0 s ARG 184 CO 0.33 -0.03 1.11 0.42 -0.81 0.00 0.00 175.30 176.32 3hn0 s ILE 185 N -1.30 4.36 -0.18 4.11 1.01 -1.26 -0.69 121.20 127.25 3hn0 s ILE 185 Ca -0.14 1.70 0.05 0.00 0.00 0.00 0.00 60.65 62.26 3hn0 s ILE 185 Cb -0.09 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 3hn0 s ILE 185 CO -0.01 0.13 0.18 0.35 0.00 0.00 0.00 174.94 175.60 3hn0 n THR 186 N 3.89 0.00 -3.59 2.92 -2.24 0.17 -4.94 114.28 110.50 3hn0 n THR 186 Ca 0.08 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.38 3hn0 n THR 186 Cb 0.48 0.90 -0.06 0.00 -2.10 0.00 0.00 70.33 69.55 3hn0 n THR 186 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hn0 s ALA 187 N -1.58 -1.85 -0.23 6.98 0.00 -1.17 -4.97 121.76 118.93 3hn0 s ALA 187 Ca 0.01 1.71 -0.12 0.00 0.00 0.00 0.00 51.96 53.56 3hn0 s ALA 187 Cb 0.03 -0.80 -0.05 0.00 0.00 0.00 0.00 23.12 22.30 3hn0 s ALA 187 CO 0.19 -0.32 0.21 0.34 0.00 0.00 0.00 175.76 176.18 3hn0 s ASP 188 N -0.38 6.18 0.51 0.00 -1.08 -1.26 -0.77 116.67 119.86 3hn0 s ASP 188 Ca -0.03 0.19 0.34 0.00 -0.52 0.00 0.00 52.55 52.53 3hn0 s ASP 188 Cb -0.03 -2.13 1.67 0.00 -1.46 0.00 0.00 42.92 40.97 3hn0 s ASP 188 CO 0.02 0.03 2.03 -0.07 0.52 0.00 0.00 175.17 177.70 3hn0 h LEU 189 N 7.58 0.00 -1.63 -1.34 -0.00 -1.84 0.21 115.31 118.30 3hn0 h LEU 189 Ca -0.37 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.48 3hn0 h LEU 189 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.83 3hn0 h LEU 189 CO 0.66 0.00 -0.10 -1.13 -0.00 0.00 0.00 178.44 177.88 3hn0 h ASN 190 N 0.00 0.00 -2.48 -0.43 -1.24 -1.93 -3.42 115.58 106.08 3hn0 h ASN 190 Ca 0.00 0.00 -0.62 0.00 0.71 0.00 0.00 56.30 56.39 3hn0 h ASN 190 Cb 0.21 0.00 -0.14 0.00 0.73 0.00 0.00 38.32 39.12 3hn0 h ASN 190 CO 0.00 0.10 0.72 -2.28 -1.29 0.00 0.00 177.43 174.68 3hn0 s HIS 191 N -3.85 2.68 -0.04 0.67 2.46 0.06 -4.76 115.29 112.51 3hn0 s HIS 191 Ca -0.01 -0.63 0.04 0.00 0.47 0.00 0.00 55.06 54.93 3hn0 s HIS 191 Cb 0.11 -4.36 -0.06 0.00 -0.13 0.00 0.00 32.58 28.14 3hn0 s HIS 191 CO 0.57 -1.70 0.03 1.28 -2.47 0.00 0.00 174.74 172.44 3hn0 n LEU 192 N 7.83 0.00 -4.61 8.88 4.77 -1.26 -4.87 117.00 127.74 3hn0 n LEU 192 Ca 0.04 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.73 3hn0 n LEU 192 Cb 0.47 0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 3hn0 n LEU 192 CO 0.63 0.10 -0.21 0.42 -1.33 0.00 0.00 177.39 177.00 3hn0 s THR 193 N -2.14 0.73 -0.71 -5.08 -4.23 -1.26 -5.05 115.64 97.90 3hn0 s THR 193 Ca -0.02 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.74 3hn0 s THR 193 Cb 0.02 -2.23 0.19 0.00 1.34 0.00 0.00 72.50 71.81 3hn0 s THR 193 CO 0.19 0.00 1.59 0.47 -0.54 0.00 0.00 174.62 176.33 3hn0 n ASP 194 N -1.37 0.74 -3.49 3.99 9.92 -1.26 -4.22 116.55 120.87 3hn0 n ASP 194 Ca -0.11 0.37 -0.27 0.00 -0.53 0.00 0.00 54.79 54.26 3hn0 n ASP 194 Cb 0.65 -0.38 -0.10 0.00 -0.64 0.00 0.00 41.12 40.65 3hn0 n ASP 194 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 3hn0 n ASN 195 N -2.17 1.01 -4.75 -2.24 5.15 -1.26 -5.12 115.26 105.88 3hn0 n ASN 195 Ca 0.05 -2.76 -0.41 0.00 -0.60 0.00 0.00 54.58 50.85 3hn0 n ASN 195 Cb 0.43 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.01 3hn0 n ASN 195 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3hn0 s ASP 196 N -0.84 6.99 0.91 1.20 1.01 -1.26 -5.04 116.67 119.64 3hn0 s ASP 196 Ca 0.32 2.44 -0.11 0.00 0.71 0.00 0.00 52.55 55.90 3hn0 s ASP 196 Cb 0.05 -2.63 0.14 0.00 1.01 0.00 0.00 42.92 41.49 3hn0 s ASP 196 CO -0.16 -0.40 1.09 0.42 0.21 0.00 0.00 175.17 176.34 3hn0 s THR 197 N -0.69 2.61 0.59 -1.27 -4.23 -1.26 -4.89 115.64 106.51 3hn0 s THR 197 Ca 0.50 0.20 0.29 0.00 -1.18 0.00 0.00 61.69 61.50 3hn0 s THR 197 Cb -0.36 -2.60 0.37 0.00 1.34 0.00 0.00 72.50 71.25 3hn0 s THR 197 CO 0.44 -0.26 1.96 0.25 -0.54 0.00 0.00 174.62 176.47 3hn0 h LEU 198 N -1.63 0.00 0.00 4.79 5.85 -1.98 -3.47 115.31 118.87 3hn0 h LEU 198 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 3hn0 h LEU 198 Cb 1.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.31 3hn0 h LEU 198 CO 0.53 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 179.24 3hn0 n GLY 199 N -1.45 0.02 3.77 3.75 0.00 -1.26 -4.86 105.19 105.15 3hn0 n GLY 199 Ca 0.05 -2.28 -0.37 0.00 0.00 0.00 0.00 46.02 43.42 3hn0 n GLY 199 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hn0 s PHE 200 N 0.00 2.96 -0.66 1.61 0.08 -1.26 -4.73 117.98 115.97 3hn0 s PHE 200 Ca 0.00 1.55 -0.18 0.00 0.12 0.00 0.00 56.93 58.42 3hn0 s PHE 200 Cb 0.00 -3.37 0.12 0.00 -0.57 0.00 0.00 43.02 39.21 3hn0 s PHE 200 CO 0.00 -1.40 0.75 0.00 -0.10 0.00 0.00 175.22 174.47 3hn0 s ALA 201 N -1.52 3.52 -0.40 5.36 0.00 -0.89 -4.86 121.76 122.97 3hn0 s ALA 201 Ca 0.61 -2.47 0.22 0.00 0.00 0.00 0.00 51.96 50.33 3hn0 s ALA 201 Cb -0.29 -3.57 -0.21 0.00 0.00 0.00 0.00 23.12 19.05 3hn0 s ALA 201 CO 0.35 -2.40 0.74 1.04 0.00 0.00 0.00 175.76 175.49 3hn0 n GLN 202 N 5.96 0.42 -4.87 0.00 6.02 -1.26 -4.69 117.38 118.96 3hn0 n GLN 202 Ca -0.03 -0.09 -0.32 0.00 -0.01 0.00 0.00 57.00 56.56 3hn0 n GLN 202 Cb 0.44 -1.55 -0.17 0.00 1.02 0.00 0.00 30.24 29.98 3hn0 n GLN 202 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3hn0 s THR 203 N -3.31 2.01 -0.14 5.09 2.01 -1.26 -4.49 115.64 115.53 3hn0 s THR 203 Ca -0.01 -0.96 -0.10 0.00 0.31 0.00 0.00 61.69 60.92 3hn0 s THR 203 Cb 0.14 -1.76 -0.05 0.00 0.01 0.00 0.00 72.50 70.85 3hn0 s THR 203 CO 0.87 0.54 0.20 0.00 -0.69 0.00 0.00 174.62 175.54 3hn0 s ALA 204 N 0.63 3.73 -0.31 7.40 0.00 0.83 -4.31 121.76 129.73 3hn0 s ALA 204 Ca -0.12 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.15 3hn0 s ALA 204 Cb -0.16 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 3hn0 s ALA 204 CO 0.03 0.32 0.23 0.08 0.00 0.00 0.00 175.76 176.42 3hn0 s VAL 205 N -0.21 5.29 0.20 0.00 1.01 -0.08 -1.39 120.40 125.21 3hn0 s VAL 205 Ca 0.14 -0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.22 3hn0 s VAL 205 Cb -0.12 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 3hn0 s VAL 205 CO 0.03 0.10 -0.17 0.68 0.00 0.00 0.00 175.10 175.74 3hn0 s VAL 206 N 1.77 2.74 0.05 2.92 -7.23 0.29 -0.07 120.40 120.88 3hn0 s VAL 206 Ca 0.07 -1.91 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 3hn0 s VAL 206 Cb -0.17 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 3hn0 s VAL 206 CO 0.11 -0.15 -0.01 -0.72 -0.31 0.00 0.00 175.10 174.02 3hn0 s TYR 207 N -1.78 0.49 0.41 2.82 1.13 -0.34 -1.35 117.35 118.73 3hn0 s TYR 207 Ca 0.24 -1.04 0.05 0.00 -1.41 0.00 0.00 57.07 54.91 3hn0 s TYR 207 Cb -0.08 -0.37 0.00 0.00 -1.10 0.00 0.00 41.96 40.42 3hn0 s TYR 207 CO 0.13 -0.39 0.58 0.95 -2.51 0.00 0.00 175.55 174.30 3hn0 s THR 208 N -3.92 3.48 0.32 -3.49 -4.23 -1.03 -0.99 115.64 105.79 3hn0 s THR 208 Ca 0.07 -0.89 0.06 0.00 -1.18 0.00 0.00 61.69 59.75 3hn0 s THR 208 Cb 0.08 -3.21 0.31 0.00 1.34 0.00 0.00 72.50 71.01 3hn0 s THR 208 CO -0.10 -0.10 1.85 -0.65 -0.54 0.00 0.00 174.62 175.08 3hn0 h PRO 209 N 0.62 0.79 -2.42 3.99 0.11 -1.93 -3.28 132.00 129.88 3hn0 h PRO 209 Ca -0.43 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 3hn0 h PRO 209 Cb 1.27 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 3hn0 h PRO 209 CO 0.50 0.52 0.12 0.25 -0.21 0.00 0.00 178.00 179.18 3hn0 n THR 210 N -4.60 1.98 0.00 -1.15 -2.24 -1.26 -4.65 114.28 102.36 3hn0 n THR 210 Ca 0.19 -1.01 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 3hn0 n THR 210 Cb 0.44 -1.85 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 3hn0 n THR 210 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3hn0 n GLU 212 N 2.77 0.00 0.26 -0.78 4.07 -1.24 -4.68 120.64 121.03 3hn0 n GLU 212 Ca 0.29 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.57 3hn0 n GLU 212 Cb 0.56 -0.06 0.89 0.00 -0.06 0.00 0.00 31.44 32.77 3hn0 n GLU 212 CO 0.00 0.00 0.00 1.57 -0.06 0.00 0.00 177.13 178.64 3hn0 h LYS 213 N 0.00 0.00 -0.07 5.31 2.10 -1.95 -1.19 116.57 120.77 3hn0 h LYS 213 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hn0 h LYS 213 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3hn0 h LYS 213 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 3hn0 n TYR 214 N -2.74 0.06 0.15 0.07 4.01 -1.26 -4.74 117.16 112.71 3hn0 n TYR 214 Ca -0.02 -0.03 -0.13 0.00 -0.16 0.00 0.00 57.90 57.56 3hn0 n TYR 214 Cb 0.10 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.07 3hn0 n TYR 214 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3hn0 h ARG 215 N 4.31 -0.48 -0.33 -0.72 2.43 -1.62 0.68 114.38 118.65 3hn0 h ARG 215 Ca 0.00 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3hn0 h ARG 215 Cb 0.92 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.56 3hn0 h ARG 215 CO 0.00 -0.32 0.19 0.82 -1.51 0.00 0.00 179.97 179.15 3hn0 h ILE 216 N -0.50 1.13 -0.69 1.20 1.08 -1.85 0.23 117.51 118.11 3hn0 h ILE 216 Ca 0.01 -0.31 0.04 0.00 -0.39 0.00 0.00 64.86 64.21 3hn0 h ILE 216 Cb 0.48 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 34.93 3hn0 h ILE 216 CO -0.09 0.13 0.42 0.00 -0.69 0.00 0.00 178.15 177.91 3hn0 h ALA 217 N 1.06 0.91 -0.27 1.87 0.00 -1.77 0.04 119.26 121.11 3hn0 h ALA 217 Ca 0.12 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hn0 h ALA 217 Cb 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3hn0 h ALA 217 CO -0.02 0.15 -0.07 0.35 0.00 0.00 0.00 179.25 179.67 3hn0 h PHE 218 N 0.80 0.58 -0.62 0.00 3.57 -0.65 -1.40 116.94 119.22 3hn0 h PHE 218 Ca 0.29 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3hn0 h PHE 218 Cb 0.08 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 3hn0 h PHE 218 CO -0.05 0.73 0.22 0.93 -2.23 0.00 0.00 178.31 177.91 3hn0 h GLU 219 N 0.27 0.95 -0.86 1.11 5.08 -0.59 0.16 114.58 120.69 3hn0 h GLU 219 Ca 0.07 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3hn0 h GLU 219 Cb 0.54 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 3hn0 h GLU 219 CO 0.03 0.82 0.44 -0.44 -1.00 0.00 0.00 179.01 178.86 3hn0 h ASP 220 N 0.88 1.11 -0.44 1.42 3.32 -0.90 0.19 116.42 122.00 3hn0 h ASP 220 Ca 0.20 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 3hn0 h ASP 220 Cb 0.25 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 3hn0 h ASP 220 CO -0.01 0.92 -0.05 0.00 -1.72 0.00 0.00 179.24 178.37 3hn0 h ALA 221 N 1.24 0.96 -0.22 3.45 0.00 -0.65 -1.98 119.26 122.05 3hn0 h ALA 221 Ca 0.30 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 3hn0 h ALA 221 Cb 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hn0 h ALA 221 CO -0.04 0.62 -0.62 1.25 0.00 0.00 0.00 179.25 180.46 3hn0 h LEU 222 N 0.81 0.88 -0.67 0.00 5.85 -0.22 -1.27 115.31 120.68 3hn0 h LEU 222 Ca 0.14 -0.51 0.08 0.00 0.84 0.00 0.00 57.88 58.44 3hn0 h LEU 222 Cb 0.56 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.26 3hn0 h LEU 222 CO 0.03 1.29 0.34 0.03 -0.34 0.00 0.00 178.44 179.79 3hn0 h ARG 223 N 0.57 0.57 -0.65 1.25 3.08 -0.50 -0.20 114.38 118.50 3hn0 h ARG 223 Ca -0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3hn0 h ARG 223 Cb 1.22 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 3hn0 h ARG 223 CO 0.13 0.38 0.42 0.00 -1.07 0.00 0.00 179.97 179.83 3hn0 h ALA 224 N 1.40 0.83 -0.72 0.04 0.00 -0.91 -1.16 119.26 118.74 3hn0 h ALA 224 Ca 0.32 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 3hn0 h ALA 224 Cb 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3hn0 h ALA 224 CO -0.25 0.27 0.21 1.03 0.00 0.00 0.00 179.25 180.52 3hn0 h SER 225 N 0.88 1.06 -0.29 0.00 0.87 -0.71 -0.56 113.55 114.80 3hn0 h SER 225 Ca 0.24 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 3hn0 h SER 225 Cb -0.07 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.60 3hn0 h SER 225 CO -0.05 0.99 0.13 0.00 -0.53 0.00 0.00 176.83 177.37 3hn0 h GLN 227 N 0.33 0.04 -0.51 0.00 4.20 -0.94 -2.31 115.11 115.93 3hn0 h GLN 227 Ca 0.10 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3hn0 h GLN 227 Cb 0.14 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3hn0 h GLN 227 CO -0.01 0.38 0.07 -0.22 -0.67 0.00 0.00 178.83 178.37 3hn0 h LYS 228 N 0.04 0.86 -0.59 1.46 3.64 -0.81 0.07 116.57 121.23 3hn0 h LYS 228 Ca 0.00 -0.24 0.04 0.00 -1.27 0.00 0.00 60.65 59.19 3hn0 h LYS 228 Cb 0.62 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 3hn0 h LYS 228 CO 0.05 0.85 0.33 0.00 -2.27 0.00 0.00 179.45 178.41 3hn0 h ALA 229 N 0.97 0.77 -0.44 5.00 0.00 -0.90 0.26 119.26 124.91 3hn0 h ALA 229 Ca 0.15 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3hn0 h ALA 229 Cb 0.42 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3hn0 h ALA 229 CO 0.01 0.02 -0.08 0.28 0.00 0.00 0.00 179.25 179.48 3hn0 h VAL 230 N 0.63 1.27 0.00 0.00 2.07 -1.06 -3.03 116.25 116.13 3hn0 h VAL 230 Ca 0.25 -1.18 -0.21 0.00 0.82 0.00 0.00 66.70 66.38 3hn0 h VAL 230 Cb 0.11 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3hn0 h VAL 230 CO -0.15 0.40 -1.04 0.03 0.02 0.00 0.00 177.57 176.84 3hn0 h ARG 231 N 0.68 0.00 -2.16 1.57 3.08 -0.87 -3.38 114.38 113.29 3hn0 h ARG 231 Ca 0.12 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.60 3hn0 h ARG 231 Cb 0.61 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.25 3hn0 h ARG 231 CO 0.04 0.92 -0.82 0.66 -1.07 0.00 0.00 179.97 179.69 3hn0 n TYR 232 N -3.31 2.47 -0.25 3.04 4.01 0.90 -4.95 117.16 119.06 3hn0 n TYR 232 Ca -0.02 -3.93 -0.06 0.00 -0.16 0.00 0.00 57.90 53.73 3hn0 n TYR 232 Cb 0.94 -0.47 0.07 0.00 -0.31 0.00 0.00 39.34 39.57 3hn0 n TYR 232 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hn0 h PRO 233 N 3.39 1.12 -0.25 -0.72 0.13 -1.72 -1.24 132.00 132.70 3hn0 h PRO 233 Ca 0.13 -0.25 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 3hn0 h PRO 233 Cb 0.70 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 3hn0 h PRO 233 CO 0.70 0.97 0.11 0.87 -0.23 0.00 0.00 178.00 180.41 3hn0 h LYS 234 N 1.07 0.37 -0.62 0.86 1.57 -1.92 -0.18 116.57 117.73 3hn0 h LYS 234 Ca 0.23 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 3hn0 h LYS 234 Cb 0.33 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 3hn0 h LYS 234 CO -0.00 0.39 0.14 0.93 -0.57 0.00 0.00 179.45 180.34 3hn0 h GLU 235 N 0.26 0.97 0.12 3.15 3.07 -1.95 -0.36 114.58 119.85 3hn0 h GLU 235 Ca 0.08 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 3hn0 h GLU 235 Cb 0.16 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3hn0 h GLU 235 CO -0.01 0.87 -0.06 1.15 -1.40 0.00 0.00 179.01 179.56 3hn0 h THR 236 N 0.93 0.94 -0.49 1.13 2.02 -0.92 -1.07 112.91 115.44 3hn0 h THR 236 Ca 0.20 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 67.18 3hn0 h THR 236 Cb 0.34 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 3hn0 h THR 236 CO 0.00 0.05 0.28 0.40 0.37 0.00 0.00 175.52 176.63 3hn0 h ILE 237 N -0.27 1.02 -0.70 3.11 2.04 -0.90 -0.98 117.51 120.83 3hn0 h ILE 237 Ca -0.02 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.67 3hn0 h ILE 237 Cb 0.22 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3hn0 h ILE 237 CO 0.03 0.10 0.45 0.45 0.00 0.00 0.00 178.15 179.18 3hn0 h HIS 238 N 0.56 0.84 -0.32 1.37 3.86 -0.90 -0.11 115.15 120.45 3hn0 h HIS 238 Ca 0.20 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.42 3hn0 h HIS 238 Cb 0.05 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 3hn0 h HIS 238 CO -0.08 0.50 0.13 1.03 0.86 0.00 0.00 177.93 180.38 3hn0 h SER 239 N 0.89 0.43 -0.98 2.45 0.87 -0.82 -0.07 113.55 116.33 3hn0 h SER 239 Ca 0.27 -0.15 0.05 0.00 -1.23 0.00 0.00 61.79 60.73 3hn0 h SER 239 Cb -0.02 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 61.76 3hn0 h SER 239 CO -0.09 0.47 0.63 -0.07 -0.53 0.00 0.00 176.83 177.24 3hn0 h LEU 240 N 0.37 1.03 -0.18 2.23 3.38 -0.75 -1.20 115.31 120.19 3hn0 h LEU 240 Ca 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 3hn0 h LEU 240 Cb 0.17 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3hn0 h LEU 240 CO -0.01 0.68 -0.06 -0.33 0.09 0.00 0.00 178.44 178.82 3hn0 h GLU 241 N 1.19 0.36 0.00 1.13 5.08 -0.73 0.03 114.58 121.63 3hn0 h GLU 241 Ca 0.41 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 3hn0 h GLU 241 Cb 0.09 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 3hn0 h GLU 241 CO -0.15 0.63 -0.09 0.93 -1.00 0.00 0.00 179.01 179.33 3hn0 h GLU 242 N 0.06 0.00 -0.61 2.33 5.08 -0.65 -1.62 114.58 119.18 3hn0 h GLU 242 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3hn0 h GLU 242 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3hn0 h GLU 242 CO 0.02 0.09 0.00 0.72 -1.00 0.00 0.00 179.01 178.84 3hn0 n HIS 243 N -3.41 0.84 -2.32 4.33 8.25 -0.49 -4.97 115.22 117.45 3hn0 n HIS 243 Ca -0.01 -0.41 -0.18 0.00 -0.26 0.00 0.00 57.72 56.86 3hn0 n HIS 243 Cb 0.26 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.34 3hn0 n HIS 243 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hn0 n GLY 244 N 1.42 -0.33 0.14 -1.41 0.00 -0.61 -4.91 105.19 99.50 3hn0 n GLY 244 Ca 0.20 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 3hn0 n GLY 244 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hn0 h ILE 245 N 0.00 0.98 -4.00 -0.61 1.08 -1.22 -3.46 117.51 110.29 3hn0 h ILE 245 Ca -0.42 -2.53 -0.53 0.00 -0.39 0.00 0.00 64.86 60.99 3hn0 h ILE 245 Cb 1.31 2.80 -0.23 0.00 -3.07 0.00 0.00 36.82 37.63 3hn0 h ILE 245 CO 0.50 0.85 -0.82 -0.36 -0.69 0.00 0.00 178.15 177.63 3hn0 s PHE 246 N -2.57 1.66 0.45 1.37 0.08 -1.21 -4.94 117.98 112.81 3hn0 s PHE 246 Ca -0.15 -0.41 -0.25 0.00 0.12 0.00 0.00 56.93 56.24 3hn0 s PHE 246 Cb 0.05 -0.94 -0.09 0.00 -0.57 0.00 0.00 43.02 41.48 3hn0 s PHE 246 CO 0.86 0.14 1.36 0.00 -0.10 0.00 0.00 175.22 177.48 3hn0 n ALA 247 N 1.39 1.71 -1.66 5.36 0.00 -1.26 -4.26 120.51 121.78 3hn0 n ALA 247 Ca -0.19 0.24 -0.46 0.00 0.00 0.00 0.00 53.44 53.03 3hn0 n ALA 247 Cb 0.54 -2.34 -0.04 0.00 0.00 0.00 0.00 19.45 17.61 3hn0 n ALA 247 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3hn0 n GLN 248 N -0.19 2.06 -0.49 0.00 0.00 -1.26 -1.72 117.38 115.78 3hn0 n GLN 248 Ca 0.06 0.74 0.00 0.00 -0.00 0.00 0.00 57.00 57.81 3hn0 n GLN 248 Cb 0.41 -2.49 0.00 0.00 0.00 0.00 0.00 30.24 28.16 3hn0 n GLN 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hn0 n GLY 249 N 3.16 1.49 0.04 1.69 0.00 -1.26 -4.90 105.19 105.41 3hn0 n GLY 249 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3hn0 n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hn0 n ALA 250 N 0.09 2.45 -2.48 4.61 0.00 -0.70 -4.70 120.51 119.78 3hn0 n ALA 250 Ca 0.00 -0.10 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 3hn0 n ALA 250 Cb 0.00 -1.42 -0.14 0.00 0.00 0.00 0.00 19.45 17.89 3hn0 n ALA 250 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hn0 s LEU 251 N -3.65 2.20 0.31 0.00 1.43 -1.26 -4.51 118.68 113.20 3hn0 s LEU 251 Ca 0.12 -0.58 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 3hn0 s LEU 251 Cb 0.16 -0.99 -0.06 0.00 0.03 0.00 0.00 46.19 45.33 3hn0 s LEU 251 CO 0.58 0.15 0.05 0.42 0.23 0.00 0.00 176.35 177.78 3hn0 s THR 252 N -0.89 1.18 0.48 5.49 -4.23 -1.26 -4.99 115.64 111.41 3hn0 s THR 252 Ca 0.08 -2.01 0.19 0.00 -1.18 0.00 0.00 61.69 58.77 3hn0 s THR 252 Cb -0.09 -2.74 0.35 0.00 1.34 0.00 0.00 72.50 71.35 3hn0 s THR 252 CO 0.03 -0.04 2.01 -0.65 -0.54 0.00 0.00 174.62 175.43 3hn0 h PRO 253 N 2.16 0.18 -0.15 3.99 0.11 -2.00 0.17 132.00 136.46 3hn0 h PRO 253 Ca -0.40 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.61 3hn0 h PRO 253 Cb 1.24 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3hn0 h PRO 253 CO 0.69 0.12 -0.26 0.87 -0.21 0.00 0.00 178.00 179.21 3hn0 h LYS 254 N 0.19 0.27 -0.45 1.05 1.57 -1.99 -2.17 116.57 115.04 3hn0 h LYS 254 Ca 0.23 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.94 3hn0 h LYS 254 Cb 0.67 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 3hn0 h LYS 254 CO -0.04 0.52 0.26 0.77 -0.57 0.00 0.00 179.45 180.40 3hn0 h SER 255 N 0.25 0.42 -0.53 0.86 0.02 -1.36 -0.34 113.55 112.87 3hn0 h SER 255 Ca 0.04 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3hn0 h SER 255 Cb 0.60 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 3hn0 h SER 255 CO 0.04 0.30 0.34 0.40 -1.14 0.00 0.00 176.83 176.77 3hn0 h ILE 256 N 0.53 1.14 -0.44 3.27 2.04 -1.07 -1.50 117.51 121.48 3hn0 h ILE 256 Ca 0.18 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.78 3hn0 h ILE 256 Cb 0.02 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 3hn0 h ILE 256 CO -0.09 0.14 0.25 -0.33 0.00 0.00 0.00 178.15 178.13 3hn0 h GLU 257 N 0.72 0.50 0.00 2.37 5.08 -0.99 -2.32 114.58 119.93 3hn0 h GLU 257 Ca 0.19 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 3hn0 h GLU 257 Cb -0.06 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 3hn0 h GLU 257 CO -0.04 0.33 -0.10 0.00 -1.00 0.00 0.00 179.01 178.20 3hn0 h ARG 258 N 0.51 0.00 0.00 2.33 3.08 -0.65 -2.11 114.38 117.54 3hn0 h ARG 258 Ca 0.18 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 3hn0 h ARG 258 Cb 0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 3hn0 h ARG 258 CO -0.09 0.10 -0.06 0.00 -1.07 0.00 0.00 179.97 178.85 3hn0 n LYS 260 N -3.15 -1.43 -2.66 0.00 5.02 -0.80 -0.67 118.16 114.48 3hn0 n LYS 260 Ca 0.02 1.11 -0.43 0.00 -2.02 0.00 0.00 58.31 56.99 3hn0 n LYS 260 Cb 0.42 -4.59 -0.02 0.00 -0.02 0.00 0.00 35.03 30.81 3hn0 n LYS 260 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hn0 s ILE 261 N -3.08 4.63 -0.30 -0.18 -1.09 -1.26 -1.58 121.20 118.34 3hn0 s ILE 261 Ca 0.09 1.91 -0.17 0.00 -2.23 0.00 0.00 60.65 60.25 3hn0 s ILE 261 Cb -0.03 -4.34 0.18 0.00 -1.58 0.00 0.00 42.46 36.69 3hn0 s ILE 261 CO 0.80 -0.28 1.13 -0.47 -1.23 0.00 0.00 174.94 174.90 3hn0 s TYR 262 N 3.34 -0.36 -0.19 3.97 5.04 -0.58 -4.86 117.35 123.73 3hn0 s TYR 262 Ca 0.44 0.64 -0.16 0.00 -2.44 0.00 0.00 57.07 55.55 3hn0 s TYR 262 Cb -0.14 0.21 -0.04 0.00 0.35 0.00 0.00 41.96 42.34 3hn0 s TYR 262 CO 0.09 -0.18 0.41 -0.47 -1.34 0.00 0.00 175.55 174.06 3hn0 s TYR 263 N 1.91 3.40 -0.07 4.97 5.04 -1.26 -3.64 117.35 127.69 3hn0 s TYR 263 Ca -0.03 0.66 0.02 0.00 -2.44 0.00 0.00 57.07 55.28 3hn0 s TYR 263 Cb -0.03 -2.52 0.02 0.00 0.35 0.00 0.00 41.96 39.77 3hn0 s TYR 263 CO -0.15 0.03 -0.11 -1.17 -1.34 0.00 0.00 175.55 172.81 3hn0 s LEU 264 N 1.15 1.54 0.71 6.97 2.96 -0.74 -4.97 118.68 126.30 3hn0 s LEU 264 Ca 0.20 -0.28 -0.15 0.00 -0.22 0.00 0.00 54.13 53.68 3hn0 s LEU 264 Cb -0.15 -0.79 0.03 0.00 0.50 0.00 0.00 46.19 45.78 3hn0 s LEU 264 CO 0.08 -0.00 1.18 -0.55 -1.32 0.00 0.00 176.35 175.74 3hn0 s SER 265 N 0.86 4.47 0.30 3.68 0.15 -1.26 -1.62 113.70 120.27 3hn0 s SER 265 Ca -0.11 2.27 -0.02 0.00 0.70 0.00 0.00 55.95 58.79 3hn0 s SER 265 Cb -0.15 -2.58 0.44 0.00 -1.71 0.00 0.00 66.02 62.02 3hn0 s SER 265 CO 0.01 -2.07 1.97 0.00 1.20 0.00 0.00 173.24 174.35 3hn0 h ALA 266 N -0.16 1.41 -0.51 5.45 0.00 -1.05 -1.32 119.26 123.09 3hn0 h ALA 266 Ca -0.48 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.26 3hn0 h ALA 266 Cb 1.28 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3hn0 h ALA 266 CO 0.51 0.54 -0.14 0.97 0.00 0.00 0.00 179.25 181.13 3hn0 h ILE 267 N 1.12 1.27 0.00 0.00 6.09 -1.84 -0.78 117.51 123.37 3hn0 h ILE 267 Ca 0.30 -1.29 -0.04 0.00 -1.37 0.00 0.00 64.86 62.46 3hn0 h ILE 267 Cb -0.12 1.02 -0.01 0.00 0.47 0.00 0.00 36.82 38.18 3hn0 h ILE 267 CO -0.07 0.45 -0.21 -0.33 -3.07 0.00 0.00 178.15 174.92 3hn0 h GLU 268 N 0.86 0.00 -0.68 2.19 5.08 -1.71 -2.87 114.58 117.45 3hn0 h GLU 268 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3hn0 h GLU 268 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3hn0 h GLU 268 CO 0.05 0.21 0.00 0.00 -1.00 0.00 0.00 179.01 178.27 3hn0 n ALA 269 N -2.28 2.88 -0.13 3.43 0.00 -0.58 -4.71 120.51 119.12 3hn0 n ALA 269 Ca -0.01 -1.47 -0.04 0.00 0.00 0.00 0.00 53.44 51.92 3hn0 n ALA 269 Cb 0.35 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.84 3hn0 n ALA 269 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3hn0 h LYS 270 N 4.11 0.15 -0.33 0.00 3.64 -0.93 0.81 116.57 124.02 3hn0 h LYS 270 Ca 0.00 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 3hn0 h LYS 270 Cb 1.30 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 3hn0 h LYS 270 CO 0.16 0.10 -0.30 -0.44 -2.27 0.00 0.00 179.45 176.70 3hn0 h ASP 271 N 0.16 0.72 -0.24 4.20 3.32 -1.86 -2.54 116.42 120.18 3hn0 h ASP 271 Ca 0.21 -0.29 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 3hn0 h ASP 271 Cb 0.29 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 3hn0 h ASP 271 CO -0.32 0.98 -0.03 0.00 -1.72 0.00 0.00 179.24 178.15 3hn0 h ALA 272 N 1.07 1.28 0.00 3.45 0.00 -1.59 0.13 119.26 123.59 3hn0 h ALA 272 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3hn0 h ALA 272 Cb 0.81 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3hn0 h ALA 272 CO 0.07 0.48 0.00 0.28 0.00 0.00 0.00 179.25 180.08 3hn0 n VAL 273 N -4.25 0.00 0.00 0.00 0.31 0.18 -2.09 118.33 112.49 3hn0 n VAL 273 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3hn0 n VAL 273 Cb 0.28 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 3hn0 n VAL 273 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hn0 n GLY 275 N 0.18 0.00 0.09 2.92 0.00 0.44 -1.28 105.19 107.54 3hn0 n GLY 275 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 3hn0 n GLY 275 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hn0 h PHE 276 N 0.00 0.21 0.00 1.61 3.57 -1.73 -2.87 116.94 117.73 3hn0 h PHE 276 Ca 0.00 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 3hn0 h PHE 276 Cb 0.00 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 3hn0 h PHE 276 CO 0.00 0.69 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.56 3hn0 h LEU 277 N -0.33 0.00 -0.33 0.59 3.38 -1.47 -1.65 115.31 115.50 3hn0 h LEU 277 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 3hn0 h LEU 277 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3hn0 h LEU 277 CO 0.02 0.14 -0.69 0.03 0.09 0.00 0.00 178.44 178.03 3hn0 h ARG 278 N 0.00 0.64 0.31 1.13 3.08 -1.80 -1.36 114.38 116.38 3hn0 h ARG 278 Ca -0.00 -0.48 -0.02 0.00 0.07 0.00 0.00 59.98 59.55 3hn0 h ARG 278 Cb 0.37 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.51 3hn0 h ARG 278 CO 0.02 1.10 -0.15 1.25 -1.07 0.00 0.00 179.97 181.12 3hn0 h LEU 279 N 0.46 -0.35 -0.89 3.04 5.85 -1.10 -2.51 115.31 119.80 3hn0 h LEU 279 Ca -0.02 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 3hn0 h LEU 279 Cb 1.28 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 3hn0 h LEU 279 CO 0.13 -0.07 0.55 0.40 -0.34 0.00 0.00 178.44 179.11 3hn0 h ILE 280 N -0.65 1.24 0.00 4.05 1.08 -1.37 -2.84 117.51 119.02 3hn0 h ILE 280 Ca -0.04 -0.50 -0.10 0.00 -0.39 0.00 0.00 64.86 63.83 3hn0 h ILE 280 Cb 0.46 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.17 3hn0 h ILE 280 CO 0.07 0.25 -0.46 -0.08 -0.69 0.00 0.00 178.15 177.24 3hn0 h GLU 281 N 1.21 0.00 -0.33 2.37 4.22 -1.24 0.84 114.58 121.66 3hn0 h GLU 281 Ca 0.32 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.67 3hn0 h GLU 281 Cb -0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3hn0 h GLU 281 CO -0.06 0.46 -0.18 -0.56 -2.18 0.00 0.00 179.01 176.49 3hn0 h GLN 282 N 0.00 0.60 0.00 1.92 3.07 -1.20 -3.19 115.11 116.30 3hn0 h GLN 282 Ca -0.00 -0.21 0.00 0.00 0.09 0.00 0.00 58.65 58.53 3hn0 h GLN 282 Cb 1.00 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 28.51 3hn0 h GLN 282 CO 0.06 0.75 -1.58 0.66 0.09 0.00 0.00 178.83 178.80 3hn0 n TYR 283 N -4.15 0.00 -2.98 0.06 4.01 -0.92 -4.77 117.16 108.41 3hn0 n TYR 283 Ca 0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.60 3hn0 n TYR 283 Cb 0.38 -0.31 0.02 0.00 -0.31 0.00 0.00 39.34 39.11 3hn0 n TYR 283 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3hn0 n GLU 284 N -1.96 0.96 -0.05 -0.72 2.13 0.29 -5.01 120.64 116.29 3hn0 n GLU 284 Ca -0.02 -2.68 0.20 0.00 0.66 0.00 0.00 57.16 55.32 3hn0 n GLU 284 Cb 0.42 -1.38 0.65 0.00 0.27 0.00 0.00 31.44 31.39 3hn0 n GLU 284 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3hn0 h PRO 285 N 3.13 0.09 -0.79 5.31 0.13 -1.70 -1.44 132.00 136.73 3hn0 h PRO 285 Ca 0.00 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 3hn0 h PRO 285 Cb 1.02 -0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 3hn0 h PRO 285 CO 0.34 0.06 0.45 0.87 -0.23 0.00 0.00 178.00 179.48 3hn0 h LYS 286 N 0.09 1.08 -0.05 0.86 6.56 -1.93 0.70 116.57 123.88 3hn0 h LYS 286 Ca 0.29 -0.11 -0.07 0.00 -1.06 0.00 0.00 60.65 59.71 3hn0 h LYS 286 Cb 1.04 -0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 32.47 3hn0 h LYS 286 CO -0.03 0.78 -0.27 0.00 -2.06 0.00 0.00 179.45 177.87 3hn0 h ALA 287 N 1.40 1.45 -0.03 3.86 0.00 -1.64 -2.84 119.26 121.46 3hn0 h ALA 287 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hn0 h ALA 287 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3hn0 h ALA 287 CO -0.05 0.40 -0.16 1.33 0.00 0.00 0.00 179.25 180.77 3hn0 n VAL 288 N -4.19 0.00 0.00 0.00 0.24 -1.10 -4.45 118.33 108.83 3hn0 n VAL 288 Ca -0.02 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 3hn0 n VAL 288 Cb 0.34 1.42 0.00 0.00 -1.47 0.00 0.00 33.84 34.13 3hn0 n VAL 288 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hn0 n GLY 289 N 1.37 0.71 1.44 7.63 0.00 -1.02 -3.41 105.19 111.92 3hn0 n GLY 289 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3hn0 n GLY 289 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hn0 n GLY 290 N -1.82 0.75 3.43 -0.02 0.00 0.24 -4.96 105.19 102.81 3hn0 n GLY 290 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3hn0 n GLY 290 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hn0 s ARG 291 N -0.50 1.28 0.42 1.61 1.70 -1.26 -5.01 118.95 117.18 3hn0 s ARG 291 Ca 0.00 -0.58 -0.25 0.00 -0.47 0.00 0.00 55.73 54.43 3hn0 s ARG 291 Cb 0.00 0.56 -0.08 0.00 -0.57 0.00 0.00 34.95 34.86 3hn0 s ARG 291 CO 0.00 -0.55 1.27 -0.51 -1.08 0.00 0.00 175.30 174.43 3hn0 s LEU 292 N -2.78 4.16 0.48 -1.89 1.02 -1.26 -4.90 118.68 113.51 3hn0 s LEU 292 Ca 0.03 2.57 -0.23 0.00 0.02 0.00 0.00 54.13 56.51 3hn0 s LEU 292 Cb -0.01 -3.99 -0.07 0.00 0.02 0.00 0.00 46.19 42.14 3hn0 s LEU 292 CO -0.11 -0.88 1.24 -2.84 0.02 0.00 0.00 176.35 173.78 3hn0 s PRO 293 N -2.35 3.61 0.78 1.29 0.02 -1.26 -5.01 135.00 132.07 3hn0 s PRO 293 Ca 0.59 1.95 -0.13 0.00 0.02 0.00 0.00 61.00 63.43 3hn0 s PRO 293 Cb -0.36 -2.41 0.19 0.00 0.02 0.00 0.00 34.50 31.94 3hn0 s PRO 293 CO 0.45 -0.73 0.77 -0.40 -0.33 0.00 0.00 177.00 176.77 3hn0 n ASP 294 N -0.56 -1.25 -0.26 2.53 5.68 -1.26 -4.92 116.55 116.50 3hn0 n ASP 294 Ca 0.08 -1.04 -0.03 0.00 -0.50 0.00 0.00 54.79 53.29 3hn0 n ASP 294 Cb 0.47 -0.67 0.08 0.00 -1.14 0.00 0.00 41.12 39.85 3hn0 n ASP 294 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hn0 h ALA 295 N -2.33 0.96 0.00 2.12 0.00 -1.95 -2.93 119.26 115.14 3hn0 h ALA 295 Ca -0.28 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3hn0 h ALA 295 Cb 0.82 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3hn0 h ALA 295 CO 0.19 0.27 0.04 0.41 0.00 0.00 0.00 179.25 180.16 3hn0 n GLY 296 N -1.30 -0.25 0.25 0.00 0.00 -1.26 -1.51 105.19 101.11 3hn0 n GLY 296 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 3hn0 n GLY 296 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hn0 h PHE 297 N 0.00 0.92 -3.51 1.61 3.57 -1.87 -3.39 116.94 114.27 3hn0 h PHE 297 Ca 0.00 -0.17 -0.70 0.00 3.53 0.00 0.00 57.97 60.63 3hn0 h PHE 297 Cb 0.08 -0.23 -0.34 0.00 2.79 0.00 0.00 35.95 38.24 3hn0 h PHE 297 CO 0.00 0.90 -0.41 0.42 -2.23 0.00 0.00 178.31 176.98 3hn0 s ILE 298 N -4.93 3.68 0.73 1.41 1.01 -0.57 -1.71 121.20 120.82 3hn0 s ILE 298 Ca -0.12 -2.54 -0.11 0.00 0.00 0.00 0.00 60.65 57.88 3hn0 s ILE 298 Cb 0.11 -3.43 0.03 0.00 0.01 0.00 0.00 42.46 39.17 3hn0 s ILE 298 CO 0.82 -0.81 1.07 -2.16 0.00 0.00 0.00 174.94 173.86 3hn0 s PRO 299 N 0.48 2.66 0.00 2.79 0.05 -1.26 -4.93 135.00 134.78 3hn0 s PRO 299 Ca 0.13 1.01 0.20 0.00 0.05 0.00 0.00 61.00 62.39 3hn0 s PRO 299 Cb -0.21 -1.95 1.21 0.00 0.05 0.00 0.00 34.50 33.59 3hn0 s PRO 299 CO -0.04 -1.31 1.59 -1.91 0.05 0.00 0.00 177.00 175.38