#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mro n GLN 3 N 0.00 0.72 0.00 0.00 10.64 -1.26 -5.01 117.38 122.47 1mro n GLN 3 Ca 0.00 -0.13 0.00 0.00 -1.83 0.00 0.00 57.00 55.04 1mro n GLN 3 Cb 0.00 -1.46 0.00 0.00 -0.86 0.00 0.00 30.24 27.92 1mro n GLN 3 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1mro n TYR 4 N -2.31 0.00 -3.65 2.61 4.01 -1.26 -4.74 117.16 111.83 1mro n TYR 4 Ca -0.11 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.49 1mro n TYR 4 Cb 0.67 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.62 1mro n TYR 4 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1mro s TYR 5 N 0.00 -0.69 0.68 -0.72 5.04 -1.26 -5.00 117.35 115.39 1mro s TYR 5 Ca 0.00 1.65 -0.10 0.00 -2.44 0.00 0.00 57.07 56.17 1mro s TYR 5 Cb 0.00 0.25 0.01 0.00 0.35 0.00 0.00 41.96 42.57 1mro s TYR 5 CO 0.00 -0.36 1.05 -1.25 -1.34 0.00 0.00 175.55 173.65 1mro s PRO 6 N 0.18 2.94 0.00 4.97 0.04 -1.26 -4.94 135.00 136.93 1mro s PRO 6 Ca -0.01 0.40 0.00 0.00 0.04 0.00 0.00 61.00 61.43 1mro s PRO 6 Cb -0.04 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1mro s PRO 6 CO 0.02 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 176.54 1mro n GLY 7 N -2.90 3.64 0.00 0.56 0.00 -1.26 -4.57 105.19 100.65 1mro n GLY 7 Ca 0.06 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1mro n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mro n THR 8 N -1.25 0.92 -2.48 2.61 -2.24 -1.26 -4.72 114.28 105.85 1mro n THR 8 Ca 0.00 -0.94 -0.23 0.00 -2.27 0.00 0.00 64.05 60.61 1mro n THR 8 Cb 0.00 0.53 0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1mro n THR 8 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1mro s THR 9 N -0.95 2.70 0.25 4.28 -4.23 -1.26 -4.98 115.64 111.45 1mro s THR 9 Ca 0.01 -0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.04 1mro s THR 9 Cb 0.01 -3.07 0.11 0.00 1.34 0.00 0.00 72.50 70.88 1mro s THR 9 CO 0.00 -0.06 1.74 0.50 -0.54 0.00 0.00 174.62 176.26 1mro h LYS 10 N -0.17 0.83 -0.43 3.99 1.63 -1.95 -2.27 116.57 118.20 1mro h LYS 10 Ca -0.43 -0.23 0.05 0.00 -0.85 0.00 0.00 60.65 59.19 1mro h LYS 10 Cb 1.30 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 32.79 1mro h LYS 10 CO 0.56 0.83 0.16 0.28 -3.45 0.00 0.00 179.45 177.84 1mro h VAL 11 N 0.78 0.88 -0.70 2.00 2.07 -1.91 0.91 116.25 120.28 1mro h VAL 11 Ca 0.15 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1mro h VAL 11 Cb 0.46 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1mro h VAL 11 CO 0.02 0.06 0.21 0.00 0.02 0.00 0.00 177.57 177.88 1mro h ALA 12 N 1.27 1.04 -0.56 1.67 0.00 -1.83 -1.24 119.26 119.61 1mro h ALA 12 Ca 0.20 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1mro h ALA 12 Cb 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1mro h ALA 12 CO -0.19 0.64 -0.09 0.37 0.00 0.00 0.00 179.25 179.99 1mro h GLN 13 N 1.05 1.05 -0.62 0.00 5.75 -0.88 -2.13 115.11 119.33 1mro h GLN 13 Ca 0.23 -0.38 -0.05 0.00 -0.15 0.00 0.00 58.65 58.30 1mro h GLN 13 Cb 0.31 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.76 1mro h GLN 13 CO -0.01 1.08 0.19 -0.91 -2.65 0.00 0.00 178.83 176.53 1mro h ASN 14 N 0.93 0.87 -0.57 -0.69 2.35 -0.35 0.17 115.58 118.29 1mro h ASN 14 Ca 0.15 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 55.70 1mro h ASN 14 Cb 0.66 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 1mro h ASN 14 CO 0.05 0.81 0.15 0.03 -1.65 0.00 0.00 177.43 176.82 1mro h ARG 15 N 0.91 0.91 -0.56 0.81 3.08 -1.07 -1.26 114.38 117.19 1mro h ARG 15 Ca 0.20 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1mro h ARG 15 Cb 0.26 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1mro h ARG 15 CO -0.01 0.83 0.26 0.00 -1.07 0.00 0.00 179.97 179.98 1mro h ARG 16 N 0.81 0.82 -0.48 0.04 3.08 -0.98 -2.76 114.38 114.91 1mro h ARG 16 Ca 0.18 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1mro h ARG 16 Cb 0.32 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1mro h ARG 16 CO -0.00 0.68 0.27 -0.91 -1.07 0.00 0.00 179.97 178.94 1mro h ASN 17 N 0.76 0.59 -0.20 7.04 2.35 -0.65 -0.94 115.58 124.54 1mro h ASN 17 Ca 0.19 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1mro h ASN 17 Cb 0.15 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1mro h ASN 17 CO -0.02 0.50 0.06 -0.26 -1.65 0.00 0.00 177.43 176.06 1mro h PHE 18 N 0.64 0.39 0.00 1.19 0.04 -1.13 -2.67 116.94 115.40 1mro h PHE 18 Ca 0.17 -0.02 -0.17 0.00 2.80 0.00 0.00 57.97 60.75 1mro h PHE 18 Cb 0.04 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 1mro h PHE 18 CO -0.02 0.36 -0.91 0.00 -0.60 0.00 0.00 178.31 177.14 1mro s ASN 20 N -6.48 6.57 0.57 0.00 3.84 -0.40 -4.58 114.94 114.46 1mro s ASN 20 Ca 0.01 0.60 0.38 0.00 0.21 0.00 0.00 52.86 54.06 1mro s ASN 20 Cb 0.09 -2.55 1.90 0.00 -0.55 0.00 0.00 41.25 40.14 1mro s ASN 20 CO 0.79 -1.28 2.14 -0.65 -2.79 0.00 0.00 177.10 175.31 1mro h PRO 21 N 9.55 0.00 -0.00 0.43 0.11 -1.86 -1.07 132.00 139.16 1mro h PRO 21 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1mro h PRO 21 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1mro h PRO 21 CO 1.11 0.00 -0.43 0.39 -0.21 0.00 0.00 178.00 178.87 1mro n GLU 22 N -2.92 0.31 -2.75 1.05 -0.58 -1.26 -4.77 120.64 109.72 1mro n GLU 22 Ca -0.01 -0.18 -0.42 0.00 -0.42 0.00 0.00 57.16 56.12 1mro n GLU 22 Cb 0.14 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.49 1mro n GLU 22 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1mro s TYR 23 N -2.82 3.41 -0.44 -0.32 5.04 -0.41 -5.01 117.35 116.81 1mro s TYR 23 Ca 0.16 1.43 -0.27 0.00 -2.44 0.00 0.00 57.07 55.95 1mro s TYR 23 Cb 0.18 -3.16 0.03 0.00 0.35 0.00 0.00 41.96 39.36 1mro s TYR 23 CO 0.64 -0.33 1.01 -2.00 -1.34 0.00 0.00 175.55 173.53 1mro s GLU 24 N 2.52 3.69 0.31 4.97 2.12 -1.26 -4.94 118.70 126.10 1mro s GLU 24 Ca 0.43 0.43 -0.30 0.00 0.36 0.00 0.00 54.97 55.90 1mro s GLU 24 Cb -0.16 -3.89 -0.11 0.00 0.26 0.00 0.00 34.13 30.23 1mro s GLU 24 CO 0.12 -1.21 1.58 -0.51 -0.54 0.00 0.00 175.26 174.69 1mro s LEU 25 N 3.94 4.34 -0.02 2.70 1.43 -1.26 -4.93 118.68 124.89 1mro s LEU 25 Ca 0.42 2.97 -0.30 0.00 -1.03 0.00 0.00 54.13 56.19 1mro s LEU 25 Cb -0.09 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.43 1mro s LEU 25 CO 0.26 -0.91 1.43 -0.70 0.23 0.00 0.00 176.35 176.66 1mro s GLU 26 N -0.78 4.26 -0.10 1.70 2.12 -1.26 -4.87 118.70 119.77 1mro s GLU 26 Ca 0.61 1.98 -0.28 0.00 0.36 0.00 0.00 54.97 57.65 1mro s GLU 26 Cb -0.48 -3.64 -0.02 0.00 0.26 0.00 0.00 34.13 30.26 1mro s GLU 26 CO 0.51 -0.63 0.93 0.21 -0.54 0.00 0.00 175.26 175.74 1mro s LYS 27 N 2.70 4.41 -0.02 4.30 2.20 -1.26 -1.58 119.74 130.49 1mro s LYS 27 Ca 0.65 1.26 0.11 0.00 -0.36 0.00 0.00 55.97 57.62 1mro s LYS 27 Cb -0.31 -3.53 -0.17 0.00 -1.51 0.00 0.00 37.83 32.31 1mro s LYS 27 CO 0.26 -0.25 0.23 1.28 -0.36 0.00 0.00 175.35 176.51 1mro n LEU 28 N 4.80 0.00 -3.74 5.43 4.77 0.38 -4.98 117.00 123.66 1mro n LEU 28 Ca 0.06 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 1mro n LEU 28 Cb 0.49 0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.54 1mro n LEU 28 CO 0.51 0.01 0.04 0.00 -1.33 0.00 0.00 177.39 176.62 1mro s ARG 29 N -2.73 0.96 -0.23 3.23 1.70 -0.97 -4.96 118.95 115.95 1mro s ARG 29 Ca -0.04 -0.82 -0.03 0.00 -0.47 0.00 0.00 55.73 54.37 1mro s ARG 29 Cb 0.07 0.41 0.00 0.00 -0.57 0.00 0.00 34.95 34.86 1mro s ARG 29 CO 0.45 -0.34 -0.05 -2.00 -1.08 0.00 0.00 175.30 172.27 1mro s GLU 30 N -3.80 3.18 -0.05 3.89 2.56 -1.26 -4.69 118.70 118.54 1mro s GLU 30 Ca 0.04 -0.75 0.04 0.00 0.00 0.00 0.00 54.97 54.30 1mro s GLU 30 Cb 0.03 -2.99 -0.00 0.00 2.00 0.00 0.00 34.13 33.17 1mro s GLU 30 CO -0.11 -0.27 -0.17 0.42 -0.56 0.00 0.00 175.26 174.56 1mro s ILE 31 N 1.42 1.47 0.67 -3.70 1.01 -1.26 -4.98 121.20 115.83 1mro s ILE 31 Ca 0.04 -0.73 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 1mro s ILE 31 Cb -0.15 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.06 1mro s ILE 31 CO -0.04 0.42 1.08 -0.94 0.00 0.00 0.00 174.94 175.46 1mro s SER 32 N 0.12 5.24 0.19 3.58 1.04 -1.26 -4.92 113.70 117.69 1mro s SER 32 Ca -0.06 1.81 -0.12 0.00 0.48 0.00 0.00 55.95 58.06 1mro s SER 32 Cb -0.12 -2.52 0.18 0.00 0.10 0.00 0.00 66.02 63.66 1mro s SER 32 CO 0.03 -1.53 1.75 0.44 0.98 0.00 0.00 173.24 174.90 1mro h ASP 33 N -0.30 0.20 -0.89 7.02 5.19 -2.00 -2.27 116.42 123.38 1mro h ASP 33 Ca -0.45 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1mro h ASP 33 Cb 1.23 0.04 -0.04 0.00 0.18 0.00 0.00 39.33 40.73 1mro h ASP 33 CO 0.55 0.14 0.57 -0.08 -3.12 0.00 0.00 179.24 177.30 1mro h GLU 34 N 0.37 1.18 0.00 3.56 4.81 -2.00 -2.37 114.58 120.14 1mro h GLU 34 Ca 0.25 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.29 1mro h GLU 34 Cb 0.26 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1mro h GLU 34 CO -0.25 0.80 -0.50 -0.44 -0.73 0.00 0.00 179.01 177.89 1mro h ASP 35 N 1.21 0.00 -0.36 1.04 3.32 -1.82 -1.23 116.42 118.58 1mro h ASP 35 Ca 0.32 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.32 1mro h ASP 35 Cb -0.11 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1mro h ASP 35 CO -0.07 0.50 0.03 0.58 -1.72 0.00 0.00 179.24 178.57 1mro h VAL 36 N 0.00 1.25 -0.87 -1.35 2.07 -0.92 -0.70 116.25 115.73 1mro h VAL 36 Ca -0.01 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1mro h VAL 36 Cb 1.08 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 1mro h VAL 36 CO 0.07 0.31 0.47 0.58 0.02 0.00 0.00 177.57 179.01 1mro h VAL 37 N 0.45 1.25 -0.59 2.57 2.07 -1.25 -1.08 116.25 119.68 1mro h VAL 37 Ca 0.11 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1mro h VAL 37 Cb 0.41 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1mro h VAL 37 CO 0.01 0.29 0.25 0.11 0.02 0.00 0.00 177.57 178.25 1mro h LYS 38 N 1.21 0.86 -0.43 1.57 1.57 -1.03 -1.41 116.57 118.92 1mro h LYS 38 Ca 0.30 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 1mro h LYS 38 Cb 0.04 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1mro h LYS 38 CO -0.05 0.73 -0.16 0.82 -0.57 0.00 0.00 179.45 180.22 1mro h ILE 39 N 0.81 1.28 -0.26 1.86 2.04 -0.75 -3.09 117.51 119.39 1mro h ILE 39 Ca 0.20 -1.29 -0.00 0.00 1.00 0.00 0.00 64.86 64.77 1mro h ILE 39 Cb 0.17 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1mro h ILE 39 CO -0.02 0.44 0.15 -0.07 0.00 0.00 0.00 178.15 178.65 1mro h LEU 40 N 0.69 0.31 0.28 1.44 3.38 -1.08 -1.15 115.31 119.18 1mro h LEU 40 Ca 0.10 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1mro h LEU 40 Cb 0.71 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1mro h LEU 40 CO 0.05 0.28 -0.08 0.61 0.09 0.00 0.00 178.44 179.39 1mro n GLY 41 N -1.03 0.60 0.08 0.83 0.00 -0.54 -4.58 105.19 100.56 1mro n GLY 41 Ca -0.02 -0.85 -0.06 0.00 0.00 0.00 0.00 46.02 45.09 1mro n GLY 41 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mro n HIS 42 N -3.10 0.98 -3.84 1.61 8.25 -1.26 -4.96 115.22 112.89 1mro n HIS 42 Ca -0.04 0.35 -0.10 0.00 -0.26 0.00 0.00 57.72 57.67 1mro n HIS 42 Cb 0.22 -1.15 -0.06 0.00 1.12 0.00 0.00 29.99 30.12 1mro n HIS 42 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1mro s ARG 43 N -2.69 1.17 0.39 -0.41 1.70 -1.26 -5.07 118.95 112.79 1mro s ARG 43 Ca -0.04 -1.00 -0.23 0.00 -0.47 0.00 0.00 55.73 53.99 1mro s ARG 43 Cb 0.08 0.43 -0.11 0.00 -0.57 0.00 0.00 34.95 34.78 1mro s ARG 43 CO 0.82 -0.45 0.95 0.00 -1.08 0.00 0.00 175.30 175.54 1mro s ALA 44 N -3.91 3.10 -0.02 7.88 0.00 -1.26 -4.72 121.76 122.83 1mro s ALA 44 Ca 0.12 0.44 -0.35 0.00 0.00 0.00 0.00 51.96 52.17 1mro s ALA 44 Cb 0.02 -3.16 -0.13 0.00 0.00 0.00 0.00 23.12 19.85 1mro s ALA 44 CO -0.04 0.15 1.71 -2.30 0.00 0.00 0.00 175.76 175.28 1mro n PRO 45 N -0.23 1.91 -0.22 0.00 -0.02 -1.26 -1.34 135.00 133.84 1mro n PRO 45 Ca 0.05 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1mro n PRO 45 Cb 0.53 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1mro n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mro n GLY 46 N 3.88 0.93 3.75 -1.23 0.00 -1.26 -5.04 105.19 106.22 1mro n GLY 46 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1mro n GLY 46 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1mro s GLU 47 N -0.60 4.50 0.42 1.61 2.12 -0.45 -5.05 118.70 121.25 1mro s GLU 47 Ca 0.00 1.08 -0.25 0.00 0.36 0.00 0.00 54.97 56.16 1mro s GLU 47 Cb 0.00 -3.35 -0.08 0.00 0.26 0.00 0.00 34.13 30.96 1mro s GLU 47 CO 0.00 0.31 1.26 -1.21 -0.54 0.00 0.00 175.26 175.08 1mro s GLU 48 N -0.18 3.91 0.01 4.30 2.02 -1.26 -4.85 118.70 122.66 1mro s GLU 48 Ca 0.38 2.04 -0.31 0.00 0.02 0.00 0.00 54.97 57.10 1mro s GLU 48 Cb -0.21 -2.67 -0.10 0.00 0.10 0.00 0.00 34.13 31.26 1mro s GLU 48 CO 0.23 -0.50 1.94 0.66 0.02 0.00 0.00 175.26 177.62 1mro n TYR 49 N -0.03 2.47 -1.69 1.61 4.01 -1.26 -4.98 117.16 117.30 1mro n TYR 49 Ca 0.05 -0.27 -0.36 0.00 -0.16 0.00 0.00 57.90 57.16 1mro n TYR 49 Cb 0.45 -2.76 0.07 0.00 -0.31 0.00 0.00 39.34 36.78 1mro n TYR 49 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1mro s PRO 50 N 4.23 2.50 0.13 -0.72 0.02 -1.26 -5.00 135.00 134.91 1mro s PRO 50 Ca 0.89 1.87 0.09 0.00 0.02 0.00 0.00 61.00 63.87 1mro s PRO 50 Cb -0.51 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.11 1mro s PRO 50 CO 0.44 -1.58 -0.15 -1.54 -0.33 0.00 0.00 177.00 173.84 1mro s SER 51 N -1.73 4.05 -0.01 2.53 1.04 -1.26 -3.32 113.70 115.00 1mro s SER 51 Ca 0.78 -0.54 0.15 0.00 0.48 0.00 0.00 55.95 56.81 1mro s SER 51 Cb -0.32 -0.63 -0.21 0.00 0.10 0.00 0.00 66.02 64.96 1mro s SER 51 CO 0.40 0.16 0.40 0.55 0.98 0.00 0.00 173.24 175.73 1mro n VAL 52 N 0.60 0.00 -3.75 5.02 3.14 0.31 -4.80 118.33 118.85 1mro n VAL 52 Ca -0.14 -0.29 -0.09 0.00 -2.96 0.00 0.00 64.34 60.86 1mro n VAL 52 Cb 0.53 0.39 -0.03 0.00 -1.06 0.00 0.00 33.84 33.68 1mro n VAL 52 CO 0.00 0.00 0.00 -1.38 -6.46 0.00 0.00 176.83 168.99 1mro s HIS 53 N -2.85 -0.21 0.87 1.45 -3.43 -1.22 -5.08 115.29 104.84 1mro s HIS 53 Ca -0.02 -0.17 -0.11 0.00 -0.80 0.00 0.00 55.06 53.96 1mro s HIS 53 Cb 0.10 0.56 0.12 0.00 -1.43 0.00 0.00 32.58 31.93 1mro s HIS 53 CO 0.61 -1.06 1.15 -2.14 -2.00 0.00 0.00 174.74 171.30 1mro s PRO 54 N -3.88 1.31 0.44 -0.38 0.02 -1.26 -4.44 135.00 126.80 1mro s PRO 54 Ca 0.09 1.54 -0.25 0.00 0.02 0.00 0.00 61.00 62.40 1mro s PRO 54 Cb -0.03 -1.76 -0.09 0.00 0.02 0.00 0.00 34.50 32.63 1mro s PRO 54 CO 0.01 -2.41 1.22 -2.30 -0.33 0.00 0.00 177.00 173.18 1mro n PRO 55 N -3.95 1.77 -0.07 5.54 -0.02 -1.26 -4.53 135.00 132.47 1mro n PRO 55 Ca 0.12 0.63 0.03 0.00 -2.02 0.00 0.00 63.50 62.26 1mro n PRO 55 Cb 0.52 -2.33 0.37 0.00 -0.02 0.00 0.00 33.50 32.04 1mro n PRO 55 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1mro h LEU 56 N 1.88 0.59 -2.25 2.45 3.38 -1.63 -0.74 115.31 118.99 1mro h LEU 56 Ca -0.47 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1mro h LEU 56 Cb 1.31 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1mro h LEU 56 CO 0.59 0.42 0.00 -0.33 0.09 0.00 0.00 178.44 179.21 1mro h GLU 57 N 0.69 0.00 -0.02 1.13 4.39 -1.90 -1.92 114.58 116.95 1mro h GLU 57 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1mro h GLU 57 Cb -0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1mro h GLU 57 CO -0.05 0.00 -0.17 0.39 -1.16 0.00 0.00 179.01 178.02 1mro n GLU 58 N -2.92 1.82 -4.09 2.33 1.02 -0.30 -4.93 120.64 113.57 1mro n GLU 58 Ca -0.02 -1.51 -0.30 0.00 -0.02 0.00 0.00 57.16 55.32 1mro n GLU 58 Cb 0.14 -1.44 -0.07 0.00 -0.02 0.00 0.00 31.44 30.05 1mro n GLU 58 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1mro s MET 59 N -2.07 2.71 -1.00 3.49 -1.94 -0.72 -4.98 119.30 114.79 1mro s MET 59 Ca 0.23 -0.80 -0.15 0.00 -1.71 0.00 0.00 55.69 53.27 1mro s MET 59 Cb 0.18 -2.62 0.19 0.00 2.01 0.00 0.00 34.83 34.59 1mro s MET 59 CO 0.38 0.54 1.10 0.34 -0.01 0.00 0.00 175.02 177.37 1mro s ASP 60 N -2.46 6.88 0.45 3.03 -1.08 -1.26 -4.96 116.67 117.27 1mro s ASP 60 Ca 0.28 -2.70 -0.23 0.00 -0.52 0.00 0.00 52.55 49.38 1mro s ASP 60 Cb -0.12 -2.32 -0.08 0.00 -1.46 0.00 0.00 42.92 38.95 1mro s ASP 60 CO 0.20 -0.73 1.15 -1.61 0.52 0.00 0.00 175.17 174.71 1mro s GLU 61 N 1.09 3.84 0.82 4.34 2.02 -1.26 -5.01 118.70 124.54 1mro s GLU 61 Ca 0.31 1.75 -0.11 0.00 0.02 0.00 0.00 54.97 56.94 1mro s GLU 61 Cb -0.07 -2.45 0.09 0.00 0.10 0.00 0.00 34.13 31.80 1mro s GLU 61 CO -0.07 -0.48 1.14 -1.25 0.02 0.00 0.00 175.26 174.62 1mro s PRO 62 N -2.63 1.70 -0.10 0.39 0.04 -1.26 -4.94 135.00 128.20 1mro s PRO 62 Ca 0.62 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.83 1mro s PRO 62 Cb -0.28 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 1mro s PRO 62 CO 0.34 -2.11 1.74 -1.21 0.04 0.00 0.00 177.00 175.81 1mro s GLU 63 N -4.57 3.98 -0.30 4.56 2.02 -1.26 -4.94 118.70 118.20 1mro s GLU 63 Ca 0.66 2.10 -0.02 0.00 0.02 0.00 0.00 54.97 57.74 1mro s GLU 63 Cb -0.22 -4.06 0.19 0.00 0.10 0.00 0.00 34.13 30.14 1mro s GLU 63 CO 0.54 -1.09 0.66 0.34 0.02 0.00 0.00 175.26 175.73 1mro s ASP 64 N 4.19 -1.30 0.42 -0.19 -1.08 -1.26 -5.03 116.67 112.42 1mro s ASP 64 Ca 0.78 0.70 0.10 0.00 -0.52 0.00 0.00 52.55 53.61 1mro s ASP 64 Cb -0.32 2.05 0.93 0.00 -1.46 0.00 0.00 42.92 44.11 1mro s ASP 64 CO 0.32 -0.24 2.02 0.00 0.52 0.00 0.00 175.17 177.79 1mro h ALA 65 N 7.99 1.83 -0.42 3.66 0.00 -1.99 -2.06 119.26 128.26 1mro h ALA 65 Ca -0.19 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1mro h ALA 65 Cb 1.17 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1mro h ALA 65 CO 0.20 0.10 -0.11 0.82 0.00 0.00 0.00 179.25 180.26 1mro h ILE 66 N 0.50 1.27 -0.73 0.00 1.08 -1.99 -1.44 117.51 116.21 1mro h ILE 66 Ca 0.21 -1.22 -0.01 0.00 -0.39 0.00 0.00 64.86 63.45 1mro h ILE 66 Cb 0.19 1.19 -0.04 0.00 -3.07 0.00 0.00 36.82 35.09 1mro h ILE 66 CO -0.05 0.41 0.43 0.03 -0.69 0.00 0.00 178.15 178.28 1mro h ARG 67 N 0.65 0.99 -0.42 2.37 3.08 -1.72 -1.23 114.38 118.09 1mro h ARG 67 Ca 0.11 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 1mro h ARG 67 Cb 0.65 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1mro h ARG 67 CO 0.04 0.70 -0.17 0.93 -1.07 0.00 0.00 179.97 180.40 1mro h GLU 68 N 1.00 0.79 0.00 0.04 5.08 -1.02 -3.27 114.58 117.21 1mro h GLU 68 Ca 0.26 -0.29 -0.18 0.00 -1.00 0.00 0.00 59.36 58.15 1mro h GLU 68 Cb -0.03 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1mro h GLU 68 CO -0.05 0.91 -1.13 0.52 -1.00 0.00 0.00 179.01 178.26 1mro h MET 69 N 0.70 0.00 -4.71 2.33 2.86 -0.91 -3.44 114.93 111.76 1mro h MET 69 Ca 0.11 0.00 -0.70 0.00 -2.06 0.00 0.00 59.70 57.05 1mro h MET 69 Cb 0.67 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.14 1mro h MET 69 CO 0.05 0.50 -0.32 0.08 1.06 0.00 0.00 176.91 178.28 1mro s VAL 70 N -2.85 5.17 -0.11 -2.22 1.01 -0.50 -5.04 120.40 115.87 1mro s VAL 70 Ca -0.01 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 1mro s VAL 70 Cb 0.08 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1mro s VAL 70 CO 0.80 -0.34 1.39 -0.70 0.00 0.00 0.00 175.10 176.25 1mro s GLU 71 N 1.92 4.23 0.40 2.72 2.56 -1.26 -4.84 118.70 124.43 1mro s GLU 71 Ca 0.09 1.85 -0.26 0.00 0.00 0.00 0.00 54.97 56.65 1mro s GLU 71 Cb -0.18 -3.80 -0.09 0.00 2.00 0.00 0.00 34.13 32.06 1mro s GLU 71 CO 0.12 -0.72 1.26 -1.25 -0.56 0.00 0.00 175.26 174.11 1mro s PRO 72 N 3.49 4.03 0.78 4.30 0.04 -1.26 -5.02 135.00 141.36 1mro s PRO 72 Ca 0.61 2.07 -0.11 0.00 0.04 0.00 0.00 61.00 63.61 1mro s PRO 72 Cb -0.26 -2.77 0.07 0.00 0.04 0.00 0.00 34.50 31.58 1mro s PRO 72 CO 0.21 -0.41 1.12 0.96 0.04 0.00 0.00 177.00 178.91 1mro s ILE 73 N -1.29 2.95 0.31 0.56 -4.36 -1.26 -4.79 121.20 113.33 1mro s ILE 73 Ca 0.56 0.34 0.03 0.00 -0.26 0.00 0.00 60.65 61.32 1mro s ILE 73 Cb -0.36 -2.73 0.29 0.00 1.25 0.00 0.00 42.46 40.91 1mro s ILE 73 CO 0.46 -0.37 1.89 0.44 0.24 0.00 0.00 174.94 177.60 1mro h ASP 74 N -1.06 0.84 0.28 4.36 3.32 -2.00 -0.91 116.42 121.25 1mro h ASP 74 Ca -0.44 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.56 1mro h ASP 74 Cb 1.25 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 1mro h ASP 74 CO 0.49 0.50 -0.31 1.23 -1.72 0.00 0.00 179.24 179.43 1mro h GLY 75 N 0.93 0.06 0.92 2.75 0.00 -1.91 -2.07 103.07 103.75 1mro h GLY 75 Ca 0.42 -0.05 -0.11 0.00 0.00 0.00 0.00 47.33 47.58 1mro h GLY 75 CO -0.18 0.04 -0.30 0.00 0.00 0.00 0.00 176.54 176.11 1mro h ALA 76 N 1.64 0.36 -0.76 3.60 0.00 -1.54 -0.02 119.26 122.54 1mro h ALA 76 Ca 0.01 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.57 1mro h ALA 76 Cb 0.58 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1mro h ALA 76 CO 0.04 0.37 0.50 0.87 0.00 0.00 0.00 179.25 181.03 1mro h LYS 77 N 0.32 0.82 0.00 0.00 1.57 -1.15 -2.50 116.57 115.64 1mro h LYS 77 Ca 0.03 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1mro h LYS 77 Cb 0.87 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1mro h LYS 77 CO 0.07 0.54 -0.49 0.00 -0.57 0.00 0.00 179.45 179.00 1mro h ALA 78 N 1.58 0.76 0.00 3.86 0.00 -1.33 -2.31 119.26 121.83 1mro h ALA 78 Ca 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1mro h ALA 78 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1mro h ALA 78 CO -0.10 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.62 1mro n GLY 79 N 1.15 0.84 3.66 0.00 0.00 -0.59 -4.18 105.19 106.07 1mro n GLY 79 Ca 0.02 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 1mro n GLY 79 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mro n ASP 80 N 1.23 0.69 -4.68 1.61 8.00 -0.12 -0.53 116.55 122.76 1mro n ASP 80 Ca 0.00 0.58 -0.33 0.00 0.71 0.00 0.00 54.79 55.75 1mro n ASP 80 Cb 0.18 -1.47 0.13 0.00 -0.02 0.00 0.00 41.12 39.94 1mro n ASP 80 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1mro n ARG 81 N -2.93 0.06 -3.37 -1.24 1.74 -1.21 -4.37 116.66 105.34 1mro n ARG 81 Ca 0.13 0.10 -0.41 0.00 -0.77 0.00 0.00 57.85 56.90 1mro n ARG 81 Cb 0.50 -2.40 -0.09 0.00 -1.02 0.00 0.00 32.46 29.45 1mro n ARG 81 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1mro s VAL 82 N -2.21 5.14 0.33 1.55 1.01 -1.26 -1.03 120.40 123.93 1mro s VAL 82 Ca 0.72 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1mro s VAL 82 Cb -0.28 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1mro s VAL 82 CO 0.52 -0.14 0.01 0.54 0.00 0.00 0.00 175.10 176.04 1mro n ARG 83 N 5.45 1.20 -4.22 2.72 5.12 -0.55 -4.89 116.66 121.50 1mro n ARG 83 Ca -0.08 -2.36 -0.13 0.00 -1.93 0.00 0.00 57.85 53.35 1mro n ARG 83 Cb 0.49 0.61 -0.10 0.00 -1.16 0.00 0.00 32.46 32.30 1mro n ARG 83 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 1mro s TYR 84 N -2.15 1.12 -0.01 -1.55 1.13 -1.26 -1.69 117.35 112.94 1mro s TYR 84 Ca 0.01 -0.96 0.01 0.00 -1.41 0.00 0.00 57.07 54.72 1mro s TYR 84 Cb -0.00 -0.63 0.01 0.00 -1.10 0.00 0.00 41.96 40.23 1mro s TYR 84 CO 0.01 -0.16 -0.01 -1.50 -2.51 0.00 0.00 175.55 171.37 1mro s ILE 85 N -3.61 0.15 -0.04 -3.49 2.07 -0.85 -5.01 121.20 110.43 1mro s ILE 85 Ca 0.19 -0.04 0.03 0.00 -1.41 0.00 0.00 60.65 59.42 1mro s ILE 85 Cb 0.05 -0.16 0.00 0.00 0.13 0.00 0.00 42.46 42.48 1mro s ILE 85 CO 0.01 0.07 -0.12 -1.58 -1.91 0.00 0.00 174.94 171.41 1mro s GLN 86 N 0.20 1.32 0.08 3.50 0.74 -1.26 -2.08 119.66 122.16 1mro s GLN 86 Ca -0.02 -0.41 0.09 0.00 0.05 0.00 0.00 55.36 55.07 1mro s GLN 86 Cb -0.04 -1.18 -0.03 0.00 1.10 0.00 0.00 33.01 32.87 1mro s GLN 86 CO -0.01 0.14 -0.24 -0.06 -0.55 0.00 0.00 175.29 174.58 1mro s PHE 87 N 0.22 2.08 -0.08 1.67 0.08 0.10 -0.73 117.98 121.32 1mro s PHE 87 Ca -0.05 -0.39 0.03 0.00 0.12 0.00 0.00 56.93 56.64 1mro s PHE 87 Cb -0.11 -1.20 -0.02 0.00 -0.57 0.00 0.00 43.02 41.13 1mro s PHE 87 CO 0.01 0.18 -0.17 0.99 -0.10 0.00 0.00 175.22 176.13 1mro s THR 88 N -0.93 2.75 -0.13 0.64 2.01 -0.04 -0.75 115.64 119.19 1mro s THR 88 Ca 0.10 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.32 1mro s THR 88 Cb -0.10 -2.08 0.01 0.00 0.01 0.00 0.00 72.50 70.34 1mro s THR 88 CO 0.03 0.56 -0.21 -1.81 -0.69 0.00 0.00 174.62 172.51 1mro s ASP 89 N -0.22 2.95 0.33 3.53 1.01 -1.26 -1.21 116.67 121.80 1mro s ASP 89 Ca -0.00 -0.56 -0.29 0.00 0.71 0.00 0.00 52.55 52.41 1mro s ASP 89 Cb -0.13 -1.36 -0.10 0.00 1.01 0.00 0.00 42.92 42.33 1mro s ASP 89 CO 0.03 0.08 1.34 -0.55 0.21 0.00 0.00 175.17 176.28 1mro s SER 90 N 0.80 6.70 0.00 0.27 0.15 0.14 -4.64 113.70 117.12 1mro s SER 90 Ca -0.08 2.74 0.21 0.00 0.70 0.00 0.00 55.95 59.51 1mro s SER 90 Cb -0.16 -2.65 1.00 0.00 -1.71 0.00 0.00 66.02 62.51 1mro s SER 90 CO -0.01 -0.59 1.66 0.23 1.20 0.00 0.00 173.24 175.73 1mro n MET 91 N 0.86 0.22 -2.02 5.44 2.81 -0.34 -2.58 117.12 121.51 1mro n MET 91 Ca 0.01 0.11 -0.41 0.00 -1.81 0.00 0.00 57.70 55.60 1mro n MET 91 Cb 0.41 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.42 1mro n MET 91 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1mro n TYR 92 N -1.34 2.68 -2.16 2.03 4.01 -1.26 -4.72 117.16 116.40 1mro n TYR 92 Ca 0.09 -2.84 -0.08 0.00 -0.16 0.00 0.00 57.90 54.90 1mro n TYR 92 Cb 0.19 -1.93 -0.00 0.00 -0.31 0.00 0.00 39.34 37.28 1mro n TYR 92 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1mro n PHE 93 N 2.52 -0.39 -1.79 -0.72 3.72 -1.23 -4.99 117.46 114.57 1mro n PHE 93 Ca 0.58 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.59 1mro n PHE 93 Cb 0.28 -2.18 0.04 0.00 -0.94 0.00 0.00 39.48 36.67 1mro n PHE 93 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mro s ALA 94 N -2.41 2.90 0.08 4.37 0.00 -1.06 -4.62 121.76 121.01 1mro s ALA 94 Ca 0.00 1.36 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 1mro s ALA 94 Cb 0.00 -3.57 -0.11 0.00 0.00 0.00 0.00 23.12 19.44 1mro s ALA 94 CO 0.00 -1.33 1.61 -1.00 0.00 0.00 0.00 175.76 175.03 1mro h PRO 95 N 1.63 0.21 -6.04 0.00 0.13 -1.83 -3.33 132.00 122.78 1mro h PRO 95 Ca -0.51 -0.04 -0.55 0.00 -0.87 0.00 0.00 66.00 64.03 1mro h PRO 95 Cb 1.29 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1mro h PRO 95 CO 0.58 0.32 -0.46 0.00 -0.23 0.00 0.00 178.00 178.21 1mro s ALA 96 N -5.50 3.97 0.17 -0.56 0.00 -1.26 -2.48 121.76 116.10 1mro s ALA 96 Ca -0.14 -1.00 -0.00 0.00 0.00 0.00 0.00 51.96 50.82 1mro s ALA 96 Cb 0.06 -1.80 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 1mro s ALA 96 CO 0.70 0.57 0.07 -0.65 0.00 0.00 0.00 175.76 176.45 1mro s GLN 97 N -3.15 1.07 0.11 0.00 -1.52 -1.26 -4.82 119.66 110.09 1mro s GLN 97 Ca 0.35 -1.53 -0.28 0.00 -1.95 0.00 0.00 55.36 51.94 1mro s GLN 97 Cb -0.11 0.13 -0.10 0.00 -0.22 0.00 0.00 33.01 32.71 1mro s GLN 97 CO 0.28 -0.28 1.63 -1.35 -0.25 0.00 0.00 175.29 175.33 1mro h PRO 98 N 2.73 -0.51 -0.07 2.91 0.11 -1.92 -0.87 132.00 134.37 1mro h PRO 98 Ca -0.36 0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.67 1mro h PRO 98 Cb 1.22 0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 1mro h PRO 98 CO 0.58 -0.34 -0.46 1.88 -0.21 0.00 0.00 178.00 179.45 1mro h TYR 99 N -0.53 0.21 -0.97 0.65 0.05 -1.97 -2.54 116.97 111.87 1mro h TYR 99 Ca 0.01 -0.06 0.02 0.00 0.05 0.00 0.00 58.73 58.75 1mro h TYR 99 Cb 0.53 -0.05 -0.05 0.00 1.01 0.00 0.00 36.73 38.17 1mro h TYR 99 CO -0.22 0.61 0.64 0.28 -1.05 0.00 0.00 178.16 178.42 1mro h VAL 100 N 0.15 1.23 0.30 -2.88 2.07 -1.88 -1.25 116.25 113.98 1mro h VAL 100 Ca 0.01 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1mro h VAL 100 Cb 0.87 -0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1mro h VAL 100 CO 0.07 0.24 -0.14 0.03 0.02 0.00 0.00 177.57 177.78 1mro h ARG 101 N 1.29 -0.39 -0.71 1.57 3.08 -0.77 -1.01 114.38 117.44 1mro h ARG 101 Ca 0.36 0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.39 1mro h ARG 101 Cb -0.11 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1mro h ARG 101 CO -0.09 -0.16 0.23 0.77 -1.07 0.00 0.00 179.97 179.65 1mro h SER 102 N -0.56 1.02 -0.34 7.04 0.02 -1.33 0.25 113.55 119.66 1mro h SER 102 Ca -0.04 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.70 1mro h SER 102 Cb 0.41 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1mro h SER 102 CO 0.07 0.95 0.14 0.03 -1.14 0.00 0.00 176.83 176.87 1mro h ARG 103 N 1.06 0.51 -0.48 3.45 3.08 -1.23 -2.70 114.38 118.07 1mro h ARG 103 Ca 0.23 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 1mro h ARG 103 Cb 0.29 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1mro h ARG 103 CO -0.01 0.51 0.06 0.00 -1.07 0.00 0.00 179.97 179.46 1mro h ALA 104 N 0.98 0.64 -0.62 0.04 0.00 -0.64 -2.64 119.26 117.02 1mro h ALA 104 Ca 0.11 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1mro h ALA 104 Cb 0.19 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1mro h ALA 104 CO -0.01 0.39 0.35 1.88 0.00 0.00 0.00 179.25 181.86 1mro h TYR 105 N 0.68 0.64 -0.00 0.00 -1.99 -0.44 0.11 116.97 115.97 1mro h TYR 105 Ca 0.14 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.90 1mro h TYR 105 Cb 0.42 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 38.95 1mro h TYR 105 CO 0.03 0.32 -0.09 1.28 -0.00 0.00 0.00 178.16 179.70 1mro n LEU 106 N -4.79 0.33 0.01 3.88 4.32 -1.03 -0.39 117.00 119.34 1mro n LEU 106 Ca 0.07 0.10 -0.19 0.00 -0.02 0.00 0.00 56.01 55.97 1mro n LEU 106 Cb 0.15 -0.22 -0.14 0.00 -1.62 0.00 0.00 43.42 41.58 1mro n LEU 106 CO 0.30 0.06 -0.68 0.00 -1.22 0.00 0.00 177.39 175.85 1mro n ARG 108 N -3.42 0.69 -4.65 0.00 1.74 0.29 -4.79 116.66 106.52 1mro n ARG 108 Ca -0.27 0.23 -0.31 0.00 -0.77 0.00 0.00 57.85 56.73 1mro n ARG 108 Cb 1.05 -1.70 -0.13 0.00 -1.02 0.00 0.00 32.46 30.67 1mro n ARG 108 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1mro s TYR 109 N -2.56 2.55 0.35 -1.55 2.02 0.48 -5.06 117.35 113.59 1mro s TYR 109 Ca -0.15 -0.26 -0.12 0.00 -0.37 0.00 0.00 57.07 56.17 1mro s TYR 109 Cb 0.07 -1.46 -0.07 0.00 -0.40 0.00 0.00 41.96 40.10 1mro s TYR 109 CO 0.78 0.25 0.73 1.03 -1.57 0.00 0.00 175.55 176.77 1mro s ARG 110 N -1.45 3.87 -1.38 -0.62 0.52 -1.26 -4.48 118.95 114.14 1mro s ARG 110 Ca 0.15 0.52 -0.07 0.00 -0.52 0.00 0.00 55.73 55.80 1mro s ARG 110 Cb -0.10 -2.44 0.03 0.00 0.52 0.00 0.00 34.95 32.96 1mro s ARG 110 CO 0.05 0.08 0.99 0.41 0.02 0.00 0.00 175.30 176.85 1mro n GLY 111 N -0.80 -0.44 3.56 -3.53 0.00 -1.26 -4.96 105.19 97.74 1mro n GLY 111 Ca 0.03 0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1mro n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mro s ALA 112 N -3.40 2.99 -0.40 4.61 0.00 -1.26 -4.69 121.76 119.61 1mro s ALA 112 Ca 0.39 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.45 1mro s ALA 112 Cb -0.18 -1.33 0.10 0.00 0.00 0.00 0.00 23.12 21.71 1mro s ALA 112 CO 0.78 0.47 0.18 0.34 0.00 0.00 0.00 175.76 177.53 1mro s ASP 113 N -0.45 5.25 -0.06 0.00 2.15 -0.64 -4.99 116.67 117.93 1mro s ASP 113 Ca 0.07 -1.87 -0.01 0.00 0.43 0.00 0.00 52.55 51.17 1mro s ASP 113 Cb -0.12 -1.83 -0.03 0.00 -0.30 0.00 0.00 42.92 40.63 1mro s ASP 113 CO 0.02 -0.51 0.00 0.00 -0.17 0.00 0.00 175.17 174.52 1mro s ALA 114 N 1.19 3.29 -0.04 3.66 0.00 -1.26 0.04 121.76 128.65 1mro s ALA 114 Ca 0.06 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.18 1mro s ALA 114 Cb -0.22 -1.44 0.01 0.00 0.00 0.00 0.00 23.12 21.47 1mro s ALA 114 CO -0.03 0.61 -0.08 0.20 0.00 0.00 0.00 175.76 176.46 1mro s GLY 115 N -1.13 0.55 -0.14 0.00 0.00 0.23 -4.99 107.32 101.84 1mro s GLY 115 Ca 0.16 -0.27 -0.03 0.00 0.00 0.00 0.00 44.72 44.57 1mro s GLY 115 CO 0.05 0.06 -0.04 -1.59 0.00 0.00 0.00 173.10 171.59 1mro s THR 116 N 0.43 3.91 0.22 0.90 2.01 -1.26 -1.48 115.64 120.35 1mro s THR 116 Ca -0.07 -0.36 -0.00 0.00 0.31 0.00 0.00 61.69 61.57 1mro s THR 116 Cb -0.11 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1mro s THR 116 CO 0.01 0.52 0.14 -0.76 -0.69 0.00 0.00 174.62 173.83 1mro s LEU 117 N 0.11 1.24 0.20 4.42 1.02 -0.54 -5.03 118.68 120.10 1mro s LEU 117 Ca -0.01 -1.42 -0.03 0.00 0.02 0.00 0.00 54.13 52.69 1mro s LEU 117 Cb -0.14 0.37 0.15 0.00 0.02 0.00 0.00 46.19 46.59 1mro s LEU 117 CO 0.03 -0.85 1.55 0.77 0.02 0.00 0.00 176.35 177.86 1mro h SER 118 N 2.56 0.64 -0.20 2.29 4.64 -2.01 -3.29 113.55 118.18 1mro h SER 118 Ca -0.35 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 60.66 1mro h SER 118 Cb 1.25 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1mro h SER 118 CO 0.52 1.01 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 1mro n GLY 119 N 0.11 1.25 3.52 -0.77 0.00 -1.26 -4.89 105.19 103.15 1mro n GLY 119 Ca -0.02 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 1mro n GLY 119 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1mro s ARG 120 N -1.01 0.82 -0.06 1.61 1.70 -1.24 -4.59 118.95 116.19 1mro s ARG 120 Ca 0.20 -0.07 -0.04 0.00 -0.47 0.00 0.00 55.73 55.35 1mro s ARG 120 Cb 0.12 0.38 0.02 0.00 -0.57 0.00 0.00 34.95 34.90 1mro s ARG 120 CO 0.16 -0.31 0.14 -1.14 -1.08 0.00 0.00 175.30 173.07 1mro s GLN 121 N -2.16 0.14 0.01 3.89 -0.44 0.07 -1.47 119.66 119.71 1mro s GLN 121 Ca -0.00 0.25 0.03 0.00 -2.50 0.00 0.00 55.36 53.13 1mro s GLN 121 Cb -0.01 -0.01 -0.01 0.00 -1.64 0.00 0.00 33.01 31.35 1mro s GLN 121 CO -0.02 -0.07 -0.09 -1.50 0.50 0.00 0.00 175.29 174.11 1mro s ILE 122 N 0.43 0.69 -0.06 -2.34 2.07 -0.55 -0.73 121.20 120.72 1mro s ILE 122 Ca -0.03 -0.62 0.04 0.00 -1.41 0.00 0.00 60.65 58.63 1mro s ILE 122 Cb -0.04 -0.63 -0.00 0.00 0.13 0.00 0.00 42.46 41.92 1mro s ILE 122 CO -0.02 0.02 -0.18 -0.51 -1.91 0.00 0.00 174.94 172.34 1mro s ILE 123 N -0.57 1.55 -0.12 2.00 2.07 -0.88 -0.60 121.20 124.65 1mro s ILE 123 Ca -0.00 -0.76 0.03 0.00 -1.41 0.00 0.00 60.65 58.51 1mro s ILE 123 Cb -0.05 -1.34 0.00 0.00 0.13 0.00 0.00 42.46 41.19 1mro s ILE 123 CO 0.00 0.44 -0.21 -1.61 -1.91 0.00 0.00 174.94 171.65 1mro s GLU 124 N 0.19 3.10 0.34 3.50 2.02 0.11 -2.01 118.70 125.96 1mro s GLU 124 Ca -0.09 -0.84 -0.15 0.00 0.02 0.00 0.00 54.97 53.92 1mro s GLU 124 Cb -0.14 -2.41 0.03 0.00 0.10 0.00 0.00 34.13 31.72 1mro s GLU 124 CO 0.04 0.12 0.71 -0.08 0.02 0.00 0.00 175.26 176.06 1mro s THR 125 N 0.51 0.00 0.34 3.63 -1.32 -0.68 -1.63 115.64 116.49 1mro s THR 125 Ca -0.14 -1.11 -0.28 0.00 -1.21 0.00 0.00 61.69 58.95 1mro s THR 125 Cb -0.17 -2.57 -0.12 0.00 -1.51 0.00 0.00 72.50 68.13 1mro s THR 125 CO 0.05 0.00 1.34 0.54 -2.21 0.00 0.00 174.62 174.34 1mro n ARG 126 N -0.50 2.23 -0.15 7.08 5.12 -1.26 -1.48 116.66 127.70 1mro n ARG 126 Ca -0.06 0.78 -0.03 0.00 -1.93 0.00 0.00 57.85 56.62 1mro n ARG 126 Cb 0.60 -2.40 0.06 0.00 -1.16 0.00 0.00 32.46 29.56 1mro n ARG 126 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 1mro h GLU 127 N 2.82 0.29 0.00 5.56 4.81 -1.37 0.66 114.58 127.36 1mro h GLU 127 Ca -0.47 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.66 1mro h GLU 127 Cb 1.27 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1mro h GLU 127 CO 0.64 0.19 -0.43 0.07 -0.73 0.00 0.00 179.01 178.76 1mro h ARG 128 N 0.29 0.00 0.04 1.92 0.11 -1.90 -1.72 114.38 113.13 1mro h ARG 128 Ca 0.24 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.09 1mro h ARG 128 Cb 0.28 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.34 1mro h ARG 128 CO -0.27 0.43 -1.04 -0.44 0.10 0.00 0.00 179.97 178.74 1mro h ASP 129 N 0.00 0.16 -0.94 0.08 3.32 -1.67 -3.09 116.42 114.27 1mro h ASP 129 Ca -0.00 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 56.92 1mro h ASP 129 Cb 0.83 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.27 1mro h ASP 129 CO 0.06 1.09 0.61 0.25 -1.72 0.00 0.00 179.24 179.53 1mro h LEU 130 N 0.04 1.02 -0.86 1.55 5.85 -0.38 -1.36 115.31 121.17 1mro h LEU 130 Ca -0.05 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1mro h LEU 130 Cb 1.77 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 1mro h LEU 130 CO 0.15 0.70 0.07 -0.33 -0.34 0.00 0.00 178.44 178.69 1mro h GLU 131 N 1.19 0.92 -0.17 1.25 5.08 -1.26 0.15 114.58 121.73 1mro h GLU 131 Ca 0.38 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1mro h GLU 131 Cb 0.01 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1mro h GLU 131 CO -0.12 0.87 -0.05 0.87 -1.00 0.00 0.00 179.01 179.58 1mro h LYS 132 N 0.86 0.34 -0.73 2.33 1.57 -1.37 -2.64 116.57 116.93 1mro h LYS 132 Ca 0.17 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1mro h LYS 132 Cb 0.42 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1mro h LYS 132 CO 0.01 0.61 0.27 0.82 -0.57 0.00 0.00 179.45 180.60 1mro h ILE 133 N 0.05 1.25 -0.03 1.86 2.04 -1.10 -3.01 117.51 118.56 1mro h ILE 133 Ca 0.04 -0.80 -0.07 0.00 1.00 0.00 0.00 64.86 65.03 1mro h ILE 133 Cb 0.49 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1mro h ILE 133 CO 0.02 0.32 -0.33 0.28 0.00 0.00 0.00 178.15 178.44 1mro h SER 134 N 1.06 0.05 -0.09 1.72 0.02 -0.58 -1.52 113.55 114.22 1mro h SER 134 Ca 0.24 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1mro h SER 134 Cb 0.23 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1mro h SER 134 CO -0.02 0.38 0.02 0.50 -1.14 0.00 0.00 176.83 176.58 1mro h LYS 135 N 0.05 0.06 -0.71 3.45 1.63 -1.33 -0.98 116.57 118.74 1mro h LYS 135 Ca 0.00 -0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1mro h LYS 135 Cb 0.61 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.19 1mro h LYS 135 CO 0.04 0.04 0.33 1.49 -3.45 0.00 0.00 179.45 177.91 1mro h GLU 136 N 0.07 1.02 -0.05 1.90 4.81 -1.42 0.02 114.58 120.93 1mro h GLU 136 Ca 0.04 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1mro h GLU 136 Cb 0.02 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1mro h GLU 136 CO -0.04 0.81 -0.25 -0.07 -0.73 0.00 0.00 179.01 178.73 1mro h LEU 137 N 0.99 0.07 0.02 1.64 3.38 -1.07 -2.35 115.31 117.99 1mro h LEU 137 Ca 0.24 -0.02 -0.30 0.00 0.09 0.00 0.00 57.88 57.89 1mro h LEU 137 Cb 0.13 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 1mro h LEU 137 CO -0.03 0.33 -1.74 0.18 0.09 0.00 0.00 178.44 177.27 1mro n LEU 138 N -4.21 1.13 0.07 1.67 4.77 -0.39 -3.88 117.00 116.16 1mro n LEU 138 Ca -0.02 0.39 0.03 0.00 -0.03 0.00 0.00 56.01 56.38 1mro n LEU 138 Cb 0.32 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 1mro n LEU 138 CO 0.38 0.45 -0.05 -0.33 -1.33 0.00 0.00 177.39 176.51 1mro h GLU 139 N 0.01 0.00 0.00 3.23 5.08 -0.93 -3.45 114.58 118.53 1mro h GLU 139 Ca -0.30 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.97 1mro h GLU 139 Cb 2.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.27 1mro h GLU 139 CO 0.08 0.28 -0.01 0.25 -1.00 0.00 0.00 179.01 178.61 1mro n THR 140 N -2.93 0.00 1.41 1.13 -2.24 -0.89 -0.47 114.28 110.29 1mro n THR 140 Ca -0.05 -0.34 0.08 0.00 -2.27 0.00 0.00 64.05 61.47 1mro n THR 140 Cb 0.76 -0.96 0.49 0.00 -2.10 0.00 0.00 70.33 68.52 1mro n THR 140 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1mro n GLU 141 N -1.24 0.70 0.25 -0.78 0.28 -0.61 -1.88 120.64 117.36 1mro n GLU 141 Ca 0.03 0.00 0.14 0.00 -0.16 0.00 0.00 57.16 57.17 1mro n GLU 141 Cb 0.11 -1.37 0.81 0.00 1.43 0.00 0.00 31.44 32.42 1mro n GLU 141 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 177.13 177.71 1mro h PHE 142 N 0.00 0.00 -3.60 -1.84 0.04 -1.87 -3.39 116.94 106.29 1mro h PHE 142 Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 1mro h PHE 142 Cb 0.00 0.00 -0.32 0.00 2.20 0.00 0.00 35.95 37.83 1mro h PHE 142 CO 0.00 0.00 -0.81 0.12 -0.60 0.00 0.00 178.31 177.02 1mro s PHE 143 N -4.76 1.42 -0.08 -0.55 5.36 -0.79 -4.11 117.98 114.47 1mro s PHE 143 Ca -0.05 -0.47 0.04 0.00 -0.96 0.00 0.00 56.93 55.49 1mro s PHE 143 Cb 0.16 -1.02 -0.00 0.00 -0.34 0.00 0.00 43.02 41.82 1mro s PHE 143 CO 0.59 -0.22 -0.22 0.34 -1.46 0.00 0.00 175.22 174.25 1mro s ASP 144 N 0.44 2.83 0.06 6.13 2.15 -1.26 -4.85 116.67 122.17 1mro s ASP 144 Ca -0.10 -0.50 0.19 0.00 0.43 0.00 0.00 52.55 52.57 1mro s ASP 144 Cb -0.14 -1.16 0.78 0.00 -0.30 0.00 0.00 42.92 42.11 1mro s ASP 144 CO 0.03 0.16 1.59 -0.81 -0.17 0.00 0.00 175.17 175.96 1mro n PRO 145 N 3.42 0.05 -0.13 4.34 -0.04 -1.26 -0.76 135.00 140.63 1mro n PRO 145 Ca -0.19 0.25 -0.20 0.00 -0.04 0.00 0.00 63.50 63.32 1mro n PRO 145 Cb 0.53 -1.59 -0.12 0.00 -0.04 0.00 0.00 33.50 32.28 1mro n PRO 145 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mro n ALA 146 N -1.57 1.36 0.47 0.55 0.00 -1.26 -4.59 120.51 115.47 1mro n ALA 146 Ca 0.04 -1.08 0.12 0.00 0.00 0.00 0.00 53.44 52.52 1mro n ALA 146 Cb 0.22 -0.09 0.19 0.00 0.00 0.00 0.00 19.45 19.77 1mro n ALA 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mro n ARG 147 N -3.46 2.48 -4.06 0.00 5.12 -1.14 -1.34 116.66 114.26 1mro n ARG 147 Ca -0.47 -2.22 -0.08 0.00 -1.93 0.00 0.00 57.85 53.15 1mro n ARG 147 Cb 0.97 -1.51 -0.10 0.00 -1.16 0.00 0.00 32.46 30.66 1mro n ARG 147 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1mro s SER 148 N -1.61 0.47 -0.05 0.55 0.01 0.06 -0.68 113.70 112.46 1mro s SER 148 Ca 0.37 -0.80 -0.08 0.00 1.31 0.00 0.00 55.95 56.74 1mro s SER 148 Cb 0.22 0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.62 1mro s SER 148 CO 0.32 -0.46 0.21 -0.83 0.41 0.00 0.00 173.24 172.88 1mro s GLY 149 N -2.35 -0.10 -0.43 3.44 0.00 -0.35 -4.59 107.32 102.93 1mro s GLY 149 Ca -0.02 0.37 -0.22 0.00 0.00 0.00 0.00 44.72 44.86 1mro s GLY 149 CO -0.06 0.26 0.72 0.14 0.00 0.00 0.00 173.10 174.15 1mro s VAL 150 N -0.47 4.75 -0.12 1.40 1.01 -1.26 -0.86 120.40 124.84 1mro s VAL 150 Ca -0.06 0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 1mro s VAL 150 Cb -0.04 -4.25 0.05 0.00 0.00 0.00 0.00 36.38 32.15 1mro s VAL 150 CO 0.01 -0.62 0.09 -0.13 0.00 0.00 0.00 175.10 174.46 1mro s ARG 151 N 3.04 0.01 0.10 2.72 0.52 0.09 -4.55 118.95 120.90 1mro s ARG 151 Ca 0.27 0.13 0.25 0.00 -0.52 0.00 0.00 55.73 55.86 1mro s ARG 151 Cb -0.13 -1.24 0.52 0.00 0.52 0.00 0.00 34.95 34.61 1mro s ARG 151 CO 0.20 -0.53 1.45 0.41 0.02 0.00 0.00 175.30 176.86 1mro n GLY 152 N 5.29 -1.44 3.71 -3.53 0.00 0.12 -4.50 105.19 104.84 1mro n GLY 152 Ca -0.05 -0.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 1mro n GLY 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mro s LYS 153 N -3.11 1.55 -1.01 1.61 -2.85 -1.26 -4.97 119.74 109.70 1mro s LYS 153 Ca 0.08 -0.78 -0.09 0.00 -1.00 0.00 0.00 55.97 54.18 1mro s LYS 153 Cb 0.14 0.58 -0.03 0.00 -2.06 0.00 0.00 37.83 36.45 1mro s LYS 153 CO 0.68 -0.70 0.82 0.43 0.10 0.00 0.00 175.35 176.69 1mro n SER 154 N -0.43 -6.39 -0.04 0.03 7.64 -1.26 -4.91 113.62 108.27 1mro n SER 154 Ca -0.08 -0.70 0.12 0.00 1.01 0.00 0.00 58.87 59.23 1mro n SER 154 Cb 0.61 -4.49 0.31 0.00 -1.01 0.00 0.00 64.21 59.63 1mro n SER 154 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1mro n VAL 155 N -3.21 0.00 -1.49 0.44 0.24 -1.26 -4.58 118.33 108.47 1mro n VAL 155 Ca -0.08 -0.02 -0.58 0.00 -2.04 0.00 0.00 64.34 61.62 1mro n VAL 155 Cb 0.59 0.18 -0.08 0.00 -1.47 0.00 0.00 33.84 33.06 1mro n VAL 155 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1mro n HIS 156 N -1.37 0.98 0.00 6.34 -0.00 -1.26 -4.38 115.22 115.52 1mro n HIS 156 Ca 0.07 1.02 0.00 0.00 -0.00 0.00 0.00 57.72 58.81 1mro n HIS 156 Cb 0.33 -2.00 0.00 0.00 -0.00 0.00 0.00 29.99 28.32 1mro n HIS 156 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1mro n GLY 157 N 2.25 0.47 0.30 1.57 0.00 -1.26 -4.52 105.19 103.99 1mro n GLY 157 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1mro n GLY 157 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1mro h HIS 158 N 0.00 0.00 -0.22 1.61 2.07 -1.82 -1.92 115.15 114.86 1mro h HIS 158 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1mro h HIS 158 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1mro h HIS 158 CO 0.00 0.00 0.00 -1.13 -3.07 0.00 0.00 177.93 173.73 1mro n SER 159 N -4.46 2.63 -4.92 3.10 3.41 -1.26 -1.20 113.62 110.92 1mro n SER 159 Ca 0.01 -1.78 -0.27 0.00 -0.26 0.00 0.00 58.87 56.57 1mro n SER 159 Cb 0.26 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 1mro n SER 159 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1mro s LEU 160 N -1.06 3.95 0.61 1.04 1.02 -0.72 -5.03 118.68 118.49 1mro s LEU 160 Ca 0.22 0.68 -0.18 0.00 0.02 0.00 0.00 54.13 54.87 1mro s LEU 160 Cb 0.13 -3.54 -0.03 0.00 0.02 0.00 0.00 46.19 42.77 1mro s LEU 160 CO 0.18 -0.31 1.18 -0.13 0.02 0.00 0.00 176.35 177.29 1mro s ARG 161 N -4.05 2.92 0.59 1.70 0.52 -1.26 -4.88 118.95 114.49 1mro s ARG 161 Ca 0.43 1.71 -0.12 0.00 -0.52 0.00 0.00 55.73 57.24 1mro s ARG 161 Cb -0.10 -1.94 -0.05 0.00 0.52 0.00 0.00 34.95 33.39 1mro s ARG 161 CO 0.35 -1.22 1.00 -0.51 0.02 0.00 0.00 175.30 174.94 1mro s LEU 162 N -4.26 3.34 0.00 2.53 1.43 -1.26 -4.50 118.68 115.96 1mro s LEU 162 Ca 0.75 1.40 -0.09 0.00 -1.03 0.00 0.00 54.13 55.16 1mro s LEU 162 Cb -0.27 -4.42 0.13 0.00 0.03 0.00 0.00 46.19 41.65 1mro s LEU 162 CO 0.34 -0.79 0.77 -0.90 0.23 0.00 0.00 176.35 176.01 1mro n ASP 163 N -2.47 0.10 0.27 2.29 5.68 -0.44 -4.88 116.55 117.09 1mro n ASP 163 Ca 0.06 -1.30 0.11 0.00 -0.50 0.00 0.00 54.79 53.15 1mro n ASP 163 Cb 0.54 -0.59 0.73 0.00 -1.14 0.00 0.00 41.12 40.66 1mro n ASP 163 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1mro h GLU 164 N 0.00 0.00 -0.01 0.11 4.81 -1.98 -0.60 114.58 116.90 1mro h GLU 164 Ca -0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1mro h GLU 164 Cb 0.70 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1mro h GLU 164 CO 0.18 0.05 -0.06 -0.25 -0.73 0.00 0.00 179.01 178.20 1mro n ASP 165 N -4.12 1.05 0.00 1.04 8.00 -1.26 -4.90 116.55 116.36 1mro n ASP 165 Ca -0.03 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.29 1mro n ASP 165 Cb 0.14 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1mro n ASP 165 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mro n GLY 166 N 1.20 0.55 3.79 0.44 0.00 -0.23 -5.04 105.19 105.89 1mro n GLY 166 Ca 0.18 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1mro n GLY 166 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1mro s MET 167 N -0.36 4.54 0.47 1.61 -1.94 -1.26 -4.64 119.30 117.71 1mro s MET 167 Ca 0.00 1.23 -0.23 0.00 -1.71 0.00 0.00 55.69 54.99 1mro s MET 167 Cb 0.00 -2.89 -0.07 0.00 2.01 0.00 0.00 34.83 33.88 1mro s MET 167 CO 0.00 0.34 1.18 1.41 -0.01 0.00 0.00 175.02 177.94 1mro s MET 168 N -1.90 3.68 0.35 2.03 -2.45 -0.45 -1.32 119.30 119.24 1mro s MET 168 Ca 0.47 1.80 -0.29 0.00 -1.25 0.00 0.00 55.69 56.42 1mro s MET 168 Cb -0.19 -2.37 -0.12 0.00 1.25 0.00 0.00 34.83 33.41 1mro s MET 168 CO 0.24 -0.62 1.46 0.34 1.05 0.00 0.00 175.02 177.49 1mro n PHE 169 N -0.58 2.75 -3.60 4.11 7.35 -1.26 -4.88 117.46 121.34 1mro n PHE 169 Ca 0.08 0.44 -0.18 0.00 -0.76 0.00 0.00 57.45 57.02 1mro n PHE 169 Cb 0.48 -2.51 -0.15 0.00 0.35 0.00 0.00 39.48 37.65 1mro n PHE 169 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1mro s ASP 170 N -0.04 1.17 0.54 -2.13 -1.08 -1.26 -4.52 116.67 109.35 1mro s ASP 170 Ca 0.57 0.03 0.30 0.00 -0.52 0.00 0.00 52.55 52.92 1mro s ASP 170 Cb -0.51 0.25 1.46 0.00 -1.46 0.00 0.00 42.92 42.66 1mro s ASP 170 CO 0.60 -0.29 1.92 -0.03 0.52 0.00 0.00 175.17 177.89 1mro h MET 171 N 8.35 0.00 -0.01 4.34 1.85 -1.81 -1.42 114.93 126.24 1mro h MET 171 Ca -0.15 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.94 1mro h MET 171 Cb 1.13 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.16 1mro h MET 171 CO 0.21 0.00 -0.11 1.28 -0.40 0.00 0.00 176.91 177.88 1mro n LEU 172 N -4.24 1.62 -3.67 3.39 4.77 -1.26 -5.04 117.00 112.57 1mro n LEU 172 Ca 0.15 -0.88 -0.22 0.00 -0.03 0.00 0.00 56.01 55.03 1mro n LEU 172 Cb 0.84 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 1mro n LEU 172 CO 0.37 0.31 -0.17 0.54 -1.33 0.00 0.00 177.39 177.11 1mro n ARG 173 N 0.21 -1.56 0.15 3.23 1.74 -0.54 -4.88 116.66 115.01 1mro n ARG 173 Ca 0.06 0.93 0.12 0.00 -0.77 0.00 0.00 57.85 58.18 1mro n ARG 173 Cb 0.26 -2.75 0.10 0.00 -1.02 0.00 0.00 32.46 29.05 1mro n ARG 173 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mro h ARG 174 N 0.04 0.00 -4.53 5.56 3.08 -1.92 -3.44 114.38 113.16 1mro h ARG 174 Ca -0.54 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 58.95 1mro h ARG 174 Cb 1.35 0.00 -0.35 0.00 0.08 0.00 0.00 29.97 31.04 1mro h ARG 174 CO 0.35 0.00 -0.82 -0.65 -1.07 0.00 0.00 179.97 177.77 1mro s GLN 175 N -3.28 1.94 -0.15 0.04 -0.21 -1.26 -0.67 119.66 116.08 1mro s GLN 175 Ca 0.03 -0.44 0.00 0.00 0.02 0.00 0.00 55.36 54.97 1mro s GLN 175 Cb 0.08 -1.77 -0.01 0.00 1.00 0.00 0.00 33.01 32.31 1mro s GLN 175 CO 0.73 -0.15 -0.14 0.42 -2.12 0.00 0.00 175.29 174.02 1mro s ILE 176 N 1.28 2.81 -0.08 1.08 -1.09 0.31 -4.94 121.20 120.57 1mro s ILE 176 Ca -0.01 -0.73 -0.30 0.00 -2.23 0.00 0.00 60.65 57.38 1mro s ILE 176 Cb -0.14 -2.19 -0.02 0.00 -1.58 0.00 0.00 42.46 38.54 1mro s ILE 176 CO -0.05 0.51 1.02 -0.47 -1.23 0.00 0.00 174.94 174.73 1mro s TYR 177 N 0.68 3.51 -0.39 3.97 5.04 -1.26 -1.01 117.35 127.88 1mro s TYR 177 Ca -0.07 1.57 -0.18 0.00 -2.44 0.00 0.00 57.07 55.96 1mro s TYR 177 Cb -0.16 -3.20 0.01 0.00 0.35 0.00 0.00 41.96 38.96 1mro s TYR 177 CO 0.02 -0.30 0.49 1.21 -1.34 0.00 0.00 175.55 175.64 1mro s ASN 178 N 1.11 6.26 0.48 4.32 3.84 0.23 -4.94 114.94 126.24 1mro s ASN 178 Ca 0.50 -0.34 0.25 0.00 0.21 0.00 0.00 52.86 53.47 1mro s ASN 178 Cb -0.19 -2.25 1.17 0.00 -0.55 0.00 0.00 41.25 39.42 1mro s ASN 178 CO 0.20 -0.56 1.94 0.11 -2.79 0.00 0.00 177.10 176.00 1mro h LYS 179 N 8.64 0.00 0.00 0.43 1.57 -1.96 0.33 116.57 125.59 1mro h LYS 179 Ca -0.27 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.39 1mro h LYS 179 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1mro h LYS 179 CO 0.80 0.19 -0.57 -0.44 -0.57 0.00 0.00 179.45 178.85 1mro h ASP 180 N 0.00 0.00 0.00 0.86 3.32 -1.95 -3.33 116.42 115.32 1mro h ASP 180 Ca -0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1mro h ASP 180 Cb 0.55 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1mro h ASP 180 CO 0.02 0.57 -1.41 0.35 -1.72 0.00 0.00 179.24 177.05 1mro n THR 181 N -3.50 0.10 -1.53 0.35 -2.24 -1.14 -4.99 114.28 101.33 1mro n THR 181 Ca 0.00 -0.22 -0.11 0.00 -2.27 0.00 0.00 64.05 61.45 1mro n THR 181 Cb 0.66 0.10 -0.04 0.00 -2.10 0.00 0.00 70.33 68.95 1mro n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mro n GLY 182 N 2.11 0.95 3.56 3.38 0.00 0.12 -5.02 105.19 110.29 1mro n GLY 182 Ca -0.04 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.23 1mro n GLY 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mro s ARG 183 N -3.33 2.03 -0.16 1.61 0.52 -1.20 -4.25 118.95 114.18 1mro s ARG 183 Ca 0.00 -1.29 -0.08 0.00 -0.52 0.00 0.00 55.73 53.85 1mro s ARG 183 Cb 0.00 -2.14 -0.04 0.00 0.52 0.00 0.00 34.95 33.29 1mro s ARG 183 CO 0.00 0.43 0.11 0.08 0.02 0.00 0.00 175.30 175.94 1mro s VAL 184 N -1.71 5.25 -0.08 3.52 1.01 0.05 -0.60 120.40 127.84 1mro s VAL 184 Ca 0.25 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1mro s VAL 184 Cb -0.09 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1mro s VAL 184 CO 0.15 0.53 -0.07 -1.61 0.00 0.00 0.00 175.10 174.10 1mro s GLU 185 N -0.27 2.84 -0.42 2.72 2.02 -0.18 -0.55 118.70 124.86 1mro s GLU 185 Ca 0.10 -0.55 -0.24 0.00 0.02 0.00 0.00 54.97 54.30 1mro s GLU 185 Cb -0.12 -2.62 0.02 0.00 0.10 0.00 0.00 34.13 31.52 1mro s GLU 185 CO 0.01 0.62 0.83 1.41 0.02 0.00 0.00 175.26 178.15 1mro s MET 186 N -0.68 3.59 -0.00 1.61 -2.45 0.77 -0.53 119.30 121.61 1mro s MET 186 Ca 0.10 0.16 0.22 0.00 -1.25 0.00 0.00 55.69 54.92 1mro s MET 186 Cb -0.11 -3.88 -0.22 0.00 1.25 0.00 0.00 34.83 31.87 1mro s MET 186 CO 0.02 -1.04 0.79 1.33 1.05 0.00 0.00 175.02 177.17 1mro n VAL 187 N 6.08 0.02 -4.20 10.11 0.24 0.16 -1.48 118.33 129.27 1mro n VAL 187 Ca 0.04 -0.19 -0.12 0.00 -2.04 0.00 0.00 64.34 62.03 1mro n VAL 187 Cb 0.48 0.56 -0.10 0.00 -1.47 0.00 0.00 33.84 33.31 1mro n VAL 187 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1mro s LYS 188 N -3.19 0.91 1.06 7.34 1.02 -1.19 -0.67 119.74 125.02 1mro s LYS 188 Ca 0.02 -1.37 -0.18 0.00 0.02 0.00 0.00 55.97 54.47 1mro s LYS 188 Cb 0.15 -0.37 0.25 0.00 -0.52 0.00 0.00 37.83 37.34 1mro s LYS 188 CO 0.87 0.02 1.29 0.54 -0.92 0.00 0.00 175.35 177.15 1mro s ASN 189 N -3.06 2.21 0.46 2.83 2.20 0.00 -4.82 114.94 114.76 1mro s ASN 189 Ca 0.13 0.26 0.32 0.00 -0.94 0.00 0.00 52.86 52.63 1mro s ASN 189 Cb 0.04 -0.27 1.43 0.00 -2.00 0.00 0.00 41.25 40.45 1mro s ASN 189 CO -0.03 -3.30 1.94 0.06 -2.94 0.00 0.00 177.10 172.84 1mro h GLN 190 N -2.03 0.00 -0.01 3.55 3.07 -1.44 -0.91 115.11 117.34 1mro h GLN 190 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.30 1mro h GLN 190 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.79 1mro h GLN 190 CO 0.31 0.00 -0.54 1.51 0.09 0.00 0.00 178.83 180.21 1mro n ILE 191 N -2.76 0.00 0.00 1.86 0.13 -1.26 0.14 119.36 117.47 1mro n ILE 191 Ca 0.00 -0.09 0.00 0.00 -1.10 0.00 0.00 62.75 61.56 1mro n ILE 191 Cb 0.21 0.66 0.00 0.00 -0.84 0.00 0.00 39.64 39.68 1mro n ILE 191 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1mro n GLY 192 N 1.44 1.15 3.78 4.50 0.00 -0.35 -4.82 105.19 110.88 1mro n GLY 192 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1mro n GLY 192 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mro s ASP 193 N -2.00 6.85 0.30 1.61 1.01 -1.26 -4.80 116.67 118.37 1mro s ASP 193 Ca 0.00 1.01 -0.30 0.00 0.71 0.00 0.00 52.55 53.97 1mro s ASP 193 Cb 0.00 -2.30 -0.12 0.00 1.01 0.00 0.00 42.92 41.51 1mro s ASP 193 CO 0.00 0.17 1.59 1.21 0.21 0.00 0.00 175.17 178.35 1mro n GLU 194 N 2.58 2.71 -3.08 8.23 4.07 -1.26 -0.82 120.64 133.07 1mro n GLU 194 Ca -0.10 0.96 -0.39 0.00 -0.06 0.00 0.00 57.16 57.58 1mro n GLU 194 Cb 0.52 -2.75 -0.06 0.00 -0.06 0.00 0.00 31.44 29.09 1mro n GLU 194 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1mro s LEU 195 N -0.60 4.56 0.17 4.31 1.43 0.15 -4.81 118.68 123.89 1mro s LEU 195 Ca 0.63 1.51 -0.21 0.00 -1.03 0.00 0.00 54.13 55.03 1mro s LEU 195 Cb -0.49 -3.19 0.07 0.00 0.03 0.00 0.00 46.19 42.61 1mro s LEU 195 CO 0.50 0.22 1.62 -2.24 0.23 0.00 0.00 176.35 176.67 1mro h ASP 196 N 4.33 -0.87 -3.38 2.29 2.03 -1.94 -3.41 116.42 115.48 1mro h ASP 196 Ca -0.48 0.17 -0.50 0.00 -0.73 0.00 0.00 57.03 55.49 1mro h ASP 196 Cb 1.21 0.43 -0.34 0.00 -0.83 0.00 0.00 39.33 39.79 1mro h ASP 196 CO 0.65 -0.28 -0.80 -1.61 -1.03 0.00 0.00 179.24 176.16 1mro s GLU 197 N -6.07 1.52 0.63 4.15 2.02 -1.26 -5.14 118.70 114.55 1mro s GLU 197 Ca -0.15 -0.33 -0.18 0.00 0.02 0.00 0.00 54.97 54.34 1mro s GLU 197 Cb 0.14 -1.34 -0.03 0.00 0.10 0.00 0.00 34.13 33.00 1mro s GLU 197 CO 0.69 -0.05 1.11 -2.30 0.02 0.00 0.00 175.26 174.73 1mro n PRO 198 N 4.08 0.96 -4.01 0.39 -0.02 -1.26 -5.00 135.00 130.13 1mro n PRO 198 Ca -0.21 0.38 -0.35 0.00 -2.02 0.00 0.00 63.50 61.30 1mro n PRO 198 Cb 0.51 -2.34 -0.11 0.00 -0.02 0.00 0.00 33.50 31.54 1mro n PRO 198 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1mro s VAL 199 N -1.47 4.38 0.01 -1.45 1.01 -0.55 -4.90 120.40 117.43 1mro s VAL 199 Ca 0.79 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.30 1mro s VAL 199 Cb -0.39 -2.99 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 1mro s VAL 199 CO 0.44 0.42 1.42 -0.62 0.00 0.00 0.00 175.10 176.76 1mro s ASP 200 N 0.84 6.83 0.00 3.32 2.15 -1.26 -0.17 116.67 128.37 1mro s ASP 200 Ca 0.02 2.16 0.12 0.00 0.43 0.00 0.00 52.55 55.29 1mro s ASP 200 Cb -0.14 -2.56 0.23 0.00 -0.30 0.00 0.00 42.92 40.15 1mro s ASP 200 CO 0.02 -0.73 1.10 0.18 -0.17 0.00 0.00 175.17 175.57 1mro n LEU 201 N 5.32 2.57 0.00 -1.34 4.77 0.29 -4.90 117.00 123.72 1mro n LEU 201 Ca 0.13 -1.52 0.00 0.00 -0.03 0.00 0.00 56.01 54.59 1mro n LEU 201 Cb 0.43 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1mro n LEU 201 CO 0.59 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.84 1mro n GLY 202 N 0.68 -1.95 3.80 -0.72 0.00 -1.24 -4.74 105.19 101.02 1mro n GLY 202 Ca 0.10 -1.42 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 1mro n GLY 202 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mro s GLU 203 N 0.00 4.38 0.41 1.61 2.02 -1.26 -0.77 118.70 125.08 1mro s GLU 203 Ca 0.00 1.03 -0.26 0.00 0.02 0.00 0.00 54.97 55.76 1mro s GLU 203 Cb 0.00 -2.89 -0.10 0.00 0.10 0.00 0.00 34.13 31.24 1mro s GLU 203 CO 0.00 0.37 1.37 -2.30 0.02 0.00 0.00 175.26 174.72 1mro n PRO 204 N 0.75 2.22 -2.06 0.39 -0.02 -1.26 -4.78 135.00 130.22 1mro n PRO 204 Ca -0.01 0.78 -0.39 0.00 -2.02 0.00 0.00 63.50 61.86 1mro n PRO 204 Cb 0.51 -2.51 -0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1mro n PRO 204 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1mro s LEU 205 N -1.97 4.15 0.90 2.45 1.43 -1.26 -5.02 118.68 119.36 1mro s LEU 205 Ca 0.59 2.61 -0.12 0.00 -1.03 0.00 0.00 54.13 56.17 1mro s LEU 205 Cb -0.49 -3.99 0.13 0.00 0.03 0.00 0.00 46.19 41.87 1mro s LEU 205 CO 0.60 -0.93 1.12 1.51 0.23 0.00 0.00 176.35 178.88 1mro s ASP 206 N -0.86 3.59 0.21 2.29 1.47 -1.26 -4.76 116.67 117.34 1mro s ASP 206 Ca 0.59 1.06 -0.08 0.00 1.18 0.00 0.00 52.55 55.30 1mro s ASP 206 Cb -0.37 -1.67 0.30 0.00 -0.34 0.00 0.00 42.92 40.84 1mro s ASP 206 CO 0.46 -2.51 1.75 -0.08 0.68 0.00 0.00 175.17 175.48 1mro h GLU 207 N -1.47 0.46 -0.68 2.11 4.81 -1.99 -1.29 114.58 116.53 1mro h GLU 207 Ca -0.50 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 1mro h GLU 207 Cb 1.32 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 1mro h GLU 207 CO 0.61 0.30 0.33 0.93 -0.73 0.00 0.00 179.01 180.45 1mro h GLU 208 N 0.47 0.98 -0.11 1.92 3.07 -2.00 -2.02 114.58 116.90 1mro h GLU 208 Ca 0.32 -0.14 -0.18 0.00 -0.50 0.00 0.00 59.36 58.86 1mro h GLU 208 Cb 0.38 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 28.11 1mro h GLU 208 CO -0.30 0.77 -0.67 1.15 -1.40 0.00 0.00 179.01 178.56 1mro h THR 209 N 0.94 1.36 -0.64 1.13 2.02 -1.80 -2.22 112.91 113.70 1mro h THR 209 Ca 0.23 -2.02 0.03 0.00 0.77 0.00 0.00 66.41 65.42 1mro h THR 209 Cb 0.12 2.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.49 1mro h THR 209 CO -0.03 0.61 0.40 -0.07 0.37 0.00 0.00 175.52 176.80 1mro h LEU 210 N 0.33 0.65 -0.91 2.58 3.38 -1.07 -1.68 115.31 118.59 1mro h LEU 210 Ca -0.02 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1mro h LEU 210 Cb 1.24 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1mro h LEU 210 CO 0.12 0.46 0.60 0.24 0.09 0.00 0.00 178.44 179.95 1mro h MET 211 N 0.78 1.20 -0.20 1.13 2.86 -1.17 -0.57 114.93 118.95 1mro h MET 211 Ca 0.25 -0.07 -0.10 0.00 -2.06 0.00 0.00 59.70 57.73 1mro h MET 211 Cb 0.01 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.38 1mro h MET 211 CO -0.10 0.79 -0.29 0.93 1.06 0.00 0.00 176.91 179.31 1mro h GLU 212 N 1.23 0.40 0.00 1.72 4.39 -0.86 -3.32 114.58 118.14 1mro h GLU 212 Ca 0.33 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1mro h GLU 212 Cb -0.14 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.49 1mro h GLU 212 CO -0.07 0.65 -1.60 1.63 -1.16 0.00 0.00 179.01 178.46 1mro n LYS 213 N -4.11 0.40 -2.11 2.33 5.02 -0.68 -4.89 118.16 114.12 1mro n LYS 213 Ca -0.01 -0.12 -0.34 0.00 -2.02 0.00 0.00 58.31 55.82 1mro n LYS 213 Cb 0.42 -1.51 0.01 0.00 -0.02 0.00 0.00 35.03 33.93 1mro n LYS 213 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1mro s THR 214 N -3.31 3.20 -0.62 -0.18 -1.32 -0.26 -4.69 115.64 108.45 1mro s THR 214 Ca -0.02 0.69 0.06 0.00 -1.21 0.00 0.00 61.69 61.21 1mro s THR 214 Cb 0.15 -3.24 0.14 0.00 -1.51 0.00 0.00 72.50 68.04 1mro s THR 214 CO 0.89 -0.22 1.01 0.35 -2.21 0.00 0.00 174.62 174.44 1mro n THR 215 N -1.63 0.68 -3.71 5.08 -2.24 -1.03 -4.38 114.28 107.04 1mro n THR 215 Ca 0.11 -0.84 -0.37 0.00 -2.27 0.00 0.00 64.05 60.68 1mro n THR 215 Cb 0.51 0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 69.38 1mro n THR 215 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1mro s ILE 216 N -0.85 5.35 0.03 2.28 2.07 -1.26 -4.93 121.20 123.88 1mro s ILE 216 Ca 0.12 0.42 -0.25 0.00 -1.41 0.00 0.00 60.65 59.53 1mro s ILE 216 Cb 0.06 -3.53 -0.05 0.00 0.13 0.00 0.00 42.46 39.08 1mro s ILE 216 CO 0.09 0.54 0.75 -0.31 -1.91 0.00 0.00 174.94 174.10 1mro s TYR 217 N -0.58 3.71 0.02 3.50 2.02 -1.26 -4.78 117.35 119.99 1mro s TYR 217 Ca 0.16 1.44 -0.14 0.00 -0.37 0.00 0.00 57.07 58.16 1mro s TYR 217 Cb -0.13 -2.81 0.02 0.00 -0.40 0.00 0.00 41.96 38.64 1mro s TYR 217 CO 0.05 0.25 0.30 1.03 -1.57 0.00 0.00 175.55 175.62 1mro s ARG 218 N 0.05 0.75 0.40 -0.62 0.52 -0.02 -4.74 118.95 115.30 1mro s ARG 218 Ca 0.38 -0.39 0.11 0.00 -0.52 0.00 0.00 55.73 55.31 1mro s ARG 218 Cb -0.20 0.33 0.85 0.00 0.52 0.00 0.00 34.95 36.44 1mro s ARG 218 CO 0.22 -0.23 1.93 -0.24 0.02 0.00 0.00 175.30 177.01 1mro h VAL 219 N 3.47 1.17 -0.43 3.52 3.04 -1.96 -0.09 116.25 124.97 1mro h VAL 219 Ca -0.31 -0.75 0.00 0.00 -1.01 0.00 0.00 66.70 64.63 1mro h VAL 219 Cb 1.19 1.27 0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1mro h VAL 219 CO 0.44 0.23 0.00 -0.90 -1.01 0.00 0.00 177.57 176.33 1mro n ASP 220 N -4.28 2.27 0.00 3.17 5.68 -1.26 -4.68 116.55 117.45 1mro n ASP 220 Ca -0.01 -2.00 0.00 0.00 -0.50 0.00 0.00 54.79 52.28 1mro n ASP 220 Cb 0.27 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1mro n ASP 220 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mro n GLY 221 N 1.18 2.07 3.38 6.12 0.00 -0.08 -5.09 105.19 112.77 1mro n GLY 221 Ca 0.14 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1mro n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mro s GLU 222 N 2.32 3.49 0.33 1.61 2.02 -1.05 -4.90 118.70 122.52 1mro s GLU 222 Ca 0.00 -0.59 -0.24 0.00 0.02 0.00 0.00 54.97 54.16 1mro s GLU 222 Cb 0.00 -2.95 -0.10 0.00 0.10 0.00 0.00 34.13 31.18 1mro s GLU 222 CO 0.00 -0.01 0.92 0.00 0.02 0.00 0.00 175.26 176.19 1mro s ALA 223 N 1.01 3.20 0.22 5.21 0.00 -1.02 -0.84 121.76 129.54 1mro s ALA 223 Ca 0.00 0.46 -0.07 0.00 0.00 0.00 0.00 51.96 52.35 1mro s ALA 223 Cb -0.15 -3.13 0.19 0.00 0.00 0.00 0.00 23.12 20.03 1mro s ALA 223 CO 0.01 0.19 1.81 -0.92 0.00 0.00 0.00 175.76 176.84 1mro h TYR 224 N 2.96 1.22 0.00 0.00 3.20 -1.87 -2.04 116.97 120.44 1mro h TYR 224 Ca -0.47 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.33 1mro h TYR 224 Cb 1.19 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.08 1mro h TYR 224 CO 0.62 0.89 0.00 0.07 -1.64 0.00 0.00 178.16 178.10 1mro h ARG 225 N 1.20 0.00 -0.02 1.82 0.11 -2.00 -0.13 114.38 115.37 1mro h ARG 225 Ca 0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.37 1mro h ARG 225 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 1mro h ARG 225 CO -0.03 0.00 -0.15 -0.25 0.10 0.00 0.00 179.97 179.63 1mro n ASP 226 N -2.92 1.79 -4.21 0.08 8.00 -0.77 -4.30 116.55 114.22 1mro n ASP 226 Ca -0.02 -1.44 -0.44 0.00 0.71 0.00 0.00 54.79 53.60 1mro n ASP 226 Cb 0.12 0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1mro n ASP 226 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1mro n ASP 227 N 0.17 5.87 0.14 -2.24 -0.08 -0.06 -4.90 116.55 115.45 1mro n ASP 227 Ca 0.14 -3.19 0.04 0.00 -1.51 0.00 0.00 54.79 50.27 1mro n ASP 227 Cb 0.43 -1.34 0.44 0.00 2.34 0.00 0.00 41.12 42.98 1mro n ASP 227 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1mro h VAL 228 N 3.57 1.14 -0.17 5.18 -1.51 -1.78 -1.60 116.25 121.09 1mro h VAL 228 Ca 0.19 -0.62 -0.15 0.00 -1.23 0.00 0.00 66.70 64.90 1mro h VAL 228 Cb 0.77 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 31.07 1mro h VAL 228 CO 1.15 0.19 -0.51 -0.33 -1.23 0.00 0.00 177.57 176.85 1mro h GLU 229 N 0.19 0.48 -0.31 5.19 5.08 -1.94 0.12 114.58 123.39 1mro h GLU 229 Ca 0.04 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 1mro h GLU 229 Cb 0.29 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1mro h GLU 229 CO 0.01 0.87 -0.06 0.00 -1.00 0.00 0.00 179.01 178.84 1mro h ALA 230 N 1.07 0.43 -0.79 3.43 0.00 -1.57 -2.54 119.26 119.29 1mro h ALA 230 Ca 0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1mro h ALA 230 Cb 1.02 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1mro h ALA 230 CO 0.09 0.24 0.36 0.28 0.00 0.00 0.00 179.25 180.23 1mro h VAL 231 N 0.37 1.25 -0.84 0.00 2.07 -1.17 -2.64 116.25 115.29 1mro h VAL 231 Ca 0.08 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 1mro h VAL 231 Cb 0.55 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1mro h VAL 231 CO 0.03 0.31 0.46 -0.08 0.02 0.00 0.00 177.57 178.30 1mro h GLU 232 N 1.13 1.17 -0.27 1.57 4.81 -0.60 -0.85 114.58 121.55 1mro h GLU 232 Ca 0.27 -0.14 -0.16 0.00 -0.13 0.00 0.00 59.36 59.20 1mro h GLU 232 Cb 0.14 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 1mro h GLU 232 CO -0.03 0.86 -0.48 0.82 -0.73 0.00 0.00 179.01 179.45 1mro h ILE 233 N 1.18 1.29 -0.58 2.32 1.08 -1.23 -0.85 117.51 120.72 1mro h ILE 233 Ca 0.30 -1.68 -0.06 0.00 -0.39 0.00 0.00 64.86 63.03 1mro h ILE 233 Cb 0.03 1.59 -0.02 0.00 -3.07 0.00 0.00 36.82 35.35 1mro h ILE 233 CO -0.05 0.54 0.12 -0.03 -0.69 0.00 0.00 178.15 178.05 1mro h MET 234 N 0.59 0.94 -0.32 2.37 4.05 -1.09 -0.58 114.93 120.88 1mro h MET 234 Ca 0.03 -0.23 -0.09 0.00 -0.28 0.00 0.00 59.70 59.12 1mro h MET 234 Cb 1.05 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 1mro h MET 234 CO 0.10 0.88 -0.18 1.96 0.23 0.00 0.00 176.91 179.90 1mro h GLN 235 N 0.84 0.59 -0.41 0.39 4.20 -1.11 -1.91 115.11 117.69 1mro h GLN 235 Ca 0.18 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1mro h GLN 235 Cb 0.37 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1mro h GLN 235 CO 0.01 0.74 0.21 -0.09 -0.67 0.00 0.00 178.83 179.02 1mro h ARG 236 N 0.53 0.59 -0.50 1.46 2.43 -0.74 -1.64 114.38 116.50 1mro h ARG 236 Ca 0.09 -0.08 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1mro h ARG 236 Cb 0.61 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 1mro h ARG 236 CO 0.04 0.50 0.29 0.82 -1.51 0.00 0.00 179.97 180.11 1mro h ILE 237 N 0.53 1.03 -0.18 1.20 2.04 -0.84 -0.48 117.51 120.81 1mro h ILE 237 Ca 0.14 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.84 1mro h ILE 237 Cb 0.10 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 1mro h ILE 237 CO -0.02 0.10 -0.05 -0.74 0.00 0.00 0.00 178.15 177.45 1mro h HIS 238 N 0.57 -0.11 -0.52 1.37 2.76 -1.09 -0.57 115.15 117.56 1mro h HIS 238 Ca 0.21 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.34 1mro h HIS 238 Cb 0.05 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 1mro h HIS 238 CO -0.08 -0.08 0.10 0.28 -1.30 0.00 0.00 177.93 176.86 1mro h VAL 239 N -0.01 1.25 -0.16 5.26 2.07 -0.93 -1.10 116.25 122.63 1mro h VAL 239 Ca 0.09 -0.90 -0.16 0.00 0.82 0.00 0.00 66.70 66.54 1mro h VAL 239 Cb 0.14 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1mro h VAL 239 CO -0.19 0.33 -0.58 -0.07 0.02 0.00 0.00 177.57 177.08 1mro h LEU 240 N 0.73 0.56 -0.48 2.57 3.38 -0.93 -0.95 115.31 120.19 1mro h LEU 240 Ca 0.16 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1mro h LEU 240 Cb 0.37 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1mro h LEU 240 CO 0.01 1.01 0.21 0.03 0.09 0.00 0.00 178.44 179.78 1mro h ARG 241 N 0.38 0.72 -0.27 1.13 3.08 -1.00 -1.23 114.38 117.19 1mro h ARG 241 Ca 0.00 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1mro h ARG 241 Cb 1.12 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 1mro h ARG 241 CO 0.10 0.63 0.14 0.77 -1.07 0.00 0.00 179.97 180.54 1mro h SER 242 N 0.64 0.35 -0.44 7.04 0.02 -0.86 -1.97 113.55 118.33 1mro h SER 242 Ca 0.16 -0.11 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 1mro h SER 242 Cb 0.17 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1mro h SER 242 CO -0.02 0.35 -0.11 1.56 -1.14 0.00 0.00 176.83 177.48 1mro h GLN 243 N 0.31 0.90 -0.24 3.45 4.20 -1.17 -3.11 115.11 119.45 1mro h GLN 243 Ca 0.09 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.38 1mro h GLN 243 Cb 0.09 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1mro h GLN 243 CO -0.01 0.96 -0.31 0.78 -0.67 0.00 0.00 178.83 179.58 1mro h GLY 244 N 0.96 0.53 2.00 3.46 0.00 -1.04 -1.54 103.07 107.44 1mro h GLY 244 Ca 0.13 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 1mro h GLY 244 CO 0.04 0.42 -0.25 -1.33 0.00 0.00 0.00 176.54 175.42 1mro h GLY 245 N 1.05 0.00 0.00 4.60 0.00 -1.31 -3.28 103.07 104.13 1mro h GLY 245 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 1mro h GLY 245 CO 0.06 0.00 -0.15 -2.75 0.00 0.00 0.00 176.54 173.70 1mro h PHE 246 N 0.00 0.00 -3.71 5.60 3.57 -1.36 -3.50 116.94 117.54 1mro h PHE 246 Ca -0.00 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 1mro h PHE 246 Cb 0.61 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.28 1mro h PHE 246 CO 0.00 0.46 -0.06 0.54 -2.23 0.00 0.00 178.31 177.02 1mro s ASN 247 N -5.90 0.39 0.00 0.41 2.20 -0.63 -5.13 114.94 106.27 1mro s ASN 247 Ca -0.10 -1.22 0.00 0.00 -0.94 0.00 0.00 52.86 50.59 1mro s ASN 247 Cb -0.00 0.68 0.00 0.00 -2.00 0.00 0.00 41.25 39.93 1mro s ASN 247 CO 0.31 -1.34 0.45 0.18 -2.94 0.00 0.00 177.10 173.75