#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b80 s ILE -3 N 0.00 5.03 -0.10 2.52 1.01 -1.26 -5.06 121.20 123.35 1b80 s ILE -3 Ca 0.00 0.68 -0.09 0.00 0.00 0.00 0.00 60.65 61.24 1b80 s ILE -3 Cb 0.00 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 1b80 s ILE -3 CO 0.00 -0.05 0.21 -1.61 0.00 0.00 0.00 174.94 173.49 1b80 s GLU -2 N 2.38 3.62 -0.43 2.79 2.02 -1.26 -5.07 118.70 122.75 1b80 s GLU -2 Ca 0.21 0.00 0.01 0.00 0.02 0.00 0.00 54.97 55.21 1b80 s GLU -2 Cb -0.15 -3.22 0.12 0.00 0.10 0.00 0.00 34.13 30.97 1b80 s GLU -2 CO 0.11 0.71 0.18 0.21 0.02 0.00 0.00 175.26 176.50 1b80 s LYS -1 N -0.91 1.86 0.21 1.61 2.20 -1.25 -4.99 119.74 118.47 1b80 s LYS -1 Ca 0.17 -2.07 -0.32 0.00 -0.36 0.00 0.00 55.97 53.38 1b80 s LYS -1 Cb -0.13 -3.41 -0.14 0.00 -1.51 0.00 0.00 37.83 32.64 1b80 s LYS -1 CO 0.06 -1.04 1.43 -2.13 -0.36 0.00 0.00 175.35 173.31 1b80 n ARG 0 N 4.07 1.96 -3.76 4.03 0.63 -1.13 -1.42 116.66 121.03 1b80 n ARG 0 Ca 0.03 0.70 -0.11 0.00 -0.92 0.00 0.00 57.85 57.54 1b80 n ARG 0 Cb 0.40 -2.38 -0.07 0.00 0.45 0.00 0.00 32.46 30.85 1b80 n ARG 0 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1b80 s ALA 1 N 0.22 -0.66 -0.25 5.13 0.00 -0.67 -4.83 121.76 120.70 1b80 s ALA 1 Ca 0.72 -0.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1b80 s ALA 1 Cb -0.69 0.31 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1b80 s ALA 1 CO 0.46 -0.41 0.19 0.99 0.00 0.00 0.00 175.76 177.00 1b80 s THR 2 N -2.53 5.33 0.77 0.00 2.01 -1.26 -0.67 115.64 119.29 1b80 s THR 2 Ca -0.05 0.22 -0.11 0.00 0.31 0.00 0.00 61.69 62.07 1b80 s THR 2 Cb -0.01 -3.53 0.07 0.00 0.01 0.00 0.00 72.50 69.04 1b80 s THR 2 CO -0.03 0.31 1.13 0.00 -0.69 0.00 0.00 174.62 175.34 1b80 h SER 4 N -0.90 0.12 0.34 0.00 4.64 -1.95 0.37 113.55 116.17 1b80 h SER 4 Ca -0.46 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1b80 h SER 4 Cb 1.32 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1b80 h SER 4 CO 0.65 0.08 0.00 -0.46 -0.87 0.00 0.00 176.83 176.22 1b80 n ASN 5 N -4.48 0.00 0.00 4.97 2.04 -1.26 -4.87 115.26 111.66 1b80 n ASN 5 Ca 0.03 -0.11 0.00 0.00 -0.44 0.00 0.00 54.58 54.06 1b80 n ASN 5 Cb 0.25 -0.25 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1b80 n ASN 5 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1b80 n GLY 6 N 0.49 0.69 3.87 4.83 0.00 0.13 -5.06 105.19 110.13 1b80 n GLY 6 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1b80 n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b80 s LYS 7 N -0.73 3.70 -0.06 1.61 -0.14 -1.25 -4.79 119.74 118.08 1b80 s LYS 7 Ca 0.00 0.11 -0.13 0.00 -1.36 0.00 0.00 55.97 54.59 1b80 s LYS 7 Cb 0.00 -3.07 -0.05 0.00 -1.68 0.00 0.00 37.83 33.03 1b80 s LYS 7 CO 0.00 0.62 0.32 0.99 -0.76 0.00 0.00 175.35 176.52 1b80 s THR 8 N -1.30 5.20 0.24 2.17 2.01 -1.26 -0.36 115.64 122.34 1b80 s THR 8 Ca 0.29 0.63 0.04 0.00 0.31 0.00 0.00 61.69 62.97 1b80 s THR 8 Cb -0.14 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1b80 s THR 8 CO 0.16 0.55 -0.03 0.68 -0.69 0.00 0.00 174.62 175.29 1b80 s VAL 9 N -0.74 1.20 0.37 3.82 -7.23 0.15 -4.96 120.40 113.02 1b80 s VAL 9 Ca 0.20 -2.06 0.21 0.00 -1.81 0.00 0.00 61.98 58.53 1b80 s VAL 9 Cb -0.15 -2.33 0.21 0.00 0.56 0.00 0.00 36.38 34.67 1b80 s VAL 9 CO 0.09 -0.35 1.96 1.23 -0.31 0.00 0.00 175.10 177.72 1b80 h GLY 10 N 2.45 0.00 -5.37 2.32 0.00 -1.86 -1.78 103.07 98.82 1b80 h GLY 10 Ca -0.39 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.79 1b80 h GLY 10 CO 0.65 0.00 -0.39 -0.35 0.00 0.00 0.00 176.54 176.45 1b80 s ASP 11 N -6.49 -0.29 0.55 0.19 2.15 -1.25 -2.85 116.67 108.67 1b80 s ASP 11 Ca -0.03 0.57 0.23 0.00 0.43 0.00 0.00 52.55 53.76 1b80 s ASP 11 Cb 0.13 0.57 1.46 0.00 -0.30 0.00 0.00 42.92 44.78 1b80 s ASP 11 CO 0.65 -0.10 2.10 0.00 -0.17 0.00 0.00 175.17 177.64 1b80 h ALA 12 N 5.79 2.05 0.00 3.66 0.00 -1.53 -1.20 119.26 128.03 1b80 h ALA 12 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1b80 h ALA 12 Cb 1.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1b80 h ALA 12 CO 0.33 -0.27 0.00 0.66 0.00 0.00 0.00 179.25 179.97 1b80 h SER 13 N 0.00 0.00 0.96 0.00 4.64 -1.97 -2.53 113.55 114.65 1b80 h SER 13 Ca 0.10 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 1b80 h SER 13 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1b80 h SER 13 CO -0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 176.83 175.71 1b80 h ALA 16 N 1.73 1.38 0.00 0.00 0.00 -1.79 -2.29 119.26 118.28 1b80 h ALA 16 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1b80 h ALA 16 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1b80 h ALA 16 CO -0.05 0.25 0.00 -1.49 0.00 0.00 0.00 179.25 177.96 1b80 h TRP 17 N 0.00 0.00 -0.25 0.00 4.06 -1.45 -2.43 115.95 115.88 1b80 h TRP 17 Ca -0.00 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.86 1b80 h TRP 17 Cb 0.44 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.59 1b80 h TRP 17 CO 0.00 0.00 -0.23 0.74 -3.56 0.00 0.00 178.44 175.39 1b80 h PHE 18 N 0.00 0.52 -0.36 0.49 0.04 -1.54 0.50 116.94 116.60 1b80 h PHE 18 Ca 0.00 -0.10 -0.15 0.00 2.80 0.00 0.00 57.97 60.51 1b80 h PHE 18 Cb 0.32 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 1b80 h PHE 18 CO 0.00 0.67 -0.37 -0.44 -0.60 0.00 0.00 178.31 177.57 1b80 h ASP 19 N 0.42 0.92 -0.42 2.17 3.32 -1.61 -1.87 116.42 119.35 1b80 h ASP 19 Ca 0.07 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 1b80 h ASP 19 Cb 0.63 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1b80 h ASP 19 CO 0.05 1.18 0.23 0.58 -1.72 0.00 0.00 179.24 179.56 1b80 h VAL 20 N 0.71 1.16 0.05 -1.35 2.07 -1.38 -2.20 116.25 115.31 1b80 h VAL 20 Ca 0.06 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.20 1b80 h VAL 20 Cb 0.95 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1b80 h VAL 20 CO 0.09 0.16 -0.23 0.25 0.02 0.00 0.00 177.57 177.86 1b80 h LEU 21 N 0.55 -0.67 -1.13 2.57 5.85 -0.78 -1.11 115.31 120.58 1b80 h LEU 21 Ca 0.15 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.97 1b80 h LEU 21 Cb 0.06 0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1b80 h LEU 21 CO -0.02 -0.31 0.59 0.44 -0.34 0.00 0.00 178.44 178.80 1b80 h ASP 22 N -0.39 1.01 0.19 1.25 3.32 -1.30 -0.99 116.42 119.51 1b80 h ASP 22 Ca 0.05 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1b80 h ASP 22 Cb 0.45 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1b80 h ASP 22 CO -0.18 0.72 -0.09 -0.78 -1.72 0.00 0.00 179.24 177.19 1b80 h ASP 23 N 1.19 -0.21 0.35 6.45 3.58 -0.96 -2.87 116.42 123.95 1b80 h ASP 23 Ca 0.34 -0.16 -0.12 0.00 0.42 0.00 0.00 57.03 57.51 1b80 h ASP 23 Cb -0.09 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 1b80 h ASP 23 CO -0.08 0.04 -0.51 0.16 -2.88 0.00 0.00 179.24 175.97 1b80 h ILE 24 N -0.47 1.36 -0.85 2.25 3.07 -1.15 0.55 117.51 122.27 1b80 h ILE 24 Ca -0.03 -1.76 0.00 0.00 1.55 0.00 0.00 64.86 64.63 1b80 h ILE 24 Cb 0.36 1.87 -0.04 0.00 -0.27 0.00 0.00 36.82 38.74 1b80 h ILE 24 CO 0.04 0.52 0.53 1.56 -1.05 0.00 0.00 178.15 179.75 1b80 h GLN 25 N 0.14 1.14 0.15 0.16 1.08 -1.19 0.17 115.11 116.75 1b80 h GLN 25 Ca 0.00 -0.09 -0.21 0.00 -1.45 0.00 0.00 58.65 56.91 1b80 h GLN 25 Cb 0.95 -0.25 0.02 0.00 -0.05 0.00 0.00 27.48 28.15 1b80 h GLN 25 CO 0.08 0.78 -0.93 0.37 -0.95 0.00 0.00 178.83 178.17 1b80 h GLN 26 N 1.16 0.31 -0.02 1.46 4.15 -1.25 0.84 115.11 121.76 1b80 h GLN 26 Ca 0.31 -0.53 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1b80 h GLN 26 Cb -0.08 0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.80 1b80 h GLN 26 CO -0.06 1.25 -0.35 0.09 -1.93 0.00 0.00 178.83 177.83 1b80 n ASN 27 N -4.07 1.96 0.00 -0.69 3.02 0.16 -3.65 115.26 111.98 1b80 n ASN 27 Ca -0.15 -1.48 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 1b80 n ASN 27 Cb 0.85 0.40 0.00 0.00 -0.61 0.00 0.00 39.78 40.43 1b80 n ASN 27 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1b80 n LEU 28 N 0.11 1.55 -1.87 3.41 7.94 0.43 -4.77 117.00 123.80 1b80 n LEU 28 Ca 0.09 0.00 0.05 0.00 -1.11 0.00 0.00 56.01 55.04 1b80 n LEU 28 Cb 0.42 0.00 0.38 0.00 0.53 0.00 0.00 43.42 44.75 1b80 n LEU 28 CO 0.23 0.25 0.90 0.49 -1.11 0.00 0.00 177.39 178.14 1b80 n PHE 29 N -2.68 2.10 -4.12 1.96 3.72 -0.21 -4.78 117.46 113.45 1b80 n PHE 29 Ca 0.00 -0.82 -0.28 0.00 -0.05 0.00 0.00 57.45 56.30 1b80 n PHE 29 Cb 0.47 -0.54 -0.05 0.00 -0.94 0.00 0.00 39.48 38.42 1b80 n PHE 29 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1b80 n HIS 30 N 0.44 -1.49 -1.26 1.38 8.25 -1.20 -1.05 115.22 120.29 1b80 n HIS 30 Ca 0.30 0.69 0.00 0.00 -0.26 0.00 0.00 57.72 58.45 1b80 n HIS 30 Cb 1.22 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 29.03 1b80 n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b80 n GLY 31 N -2.19 1.02 2.13 -1.41 0.00 0.24 -4.45 105.19 100.52 1b80 n GLY 31 Ca -0.30 -0.39 -0.07 0.00 0.00 0.00 0.00 46.02 45.27 1b80 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b80 n GLY 32 N -0.45 0.32 3.90 -0.02 0.00 -0.90 -5.01 105.19 103.04 1b80 n GLY 32 Ca 0.00 -0.50 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 1b80 n GLY 32 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b80 s GLN 33 N -4.90 3.65 -0.97 1.61 -0.21 -0.21 -4.77 119.66 113.86 1b80 s GLN 33 Ca 0.10 0.18 -0.01 0.00 0.02 0.00 0.00 55.36 55.65 1b80 s GLN 33 Cb -0.04 -2.50 0.33 0.00 1.00 0.00 0.00 33.01 31.79 1b80 s GLN 33 CO 0.12 0.03 1.79 0.00 -2.12 0.00 0.00 175.29 175.11 1b80 n GLY 35 N -0.14 3.17 0.16 0.00 0.00 -1.26 -4.61 105.19 102.51 1b80 n GLY 35 Ca 0.47 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.47 1b80 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b80 h ALA 36 N -0.41 0.09 -0.41 4.61 0.00 -1.93 -0.72 119.26 120.49 1b80 h ALA 36 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1b80 h ALA 36 Cb 0.00 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1b80 h ALA 36 CO 0.00 -0.52 0.03 0.93 0.00 0.00 0.00 179.25 179.69 1b80 h GLU 37 N -0.07 0.64 -0.09 0.00 3.07 -1.94 -0.81 114.58 115.39 1b80 h GLU 37 Ca 0.13 -0.14 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 1b80 h GLU 37 Cb 0.26 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1b80 h GLU 37 CO -0.29 0.64 0.03 0.00 -1.40 0.00 0.00 179.01 177.99 1b80 h ALA 38 N 1.42 0.11 -0.17 3.43 0.00 -1.68 -0.72 119.26 121.65 1b80 h ALA 38 Ca 0.13 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1b80 h ALA 38 Cb 0.34 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1b80 h ALA 38 CO 0.01 -0.29 -0.05 0.45 0.00 0.00 0.00 179.25 179.38 1b80 h HIS 39 N -0.04 -0.10 -1.00 0.00 3.86 -0.78 -1.38 115.15 115.71 1b80 h HIS 39 Ca 0.03 0.02 0.10 0.00 -1.16 0.00 0.00 60.37 59.35 1b80 h HIS 39 Cb 0.20 0.07 -0.08 0.00 1.06 0.00 0.00 27.41 28.66 1b80 h HIS 39 CO -0.01 -0.08 0.64 0.93 0.86 0.00 0.00 177.93 180.27 1b80 h GLU 40 N -0.01 1.04 -0.47 2.45 5.08 -1.06 -1.51 114.58 120.10 1b80 h GLU 40 Ca 0.08 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 1b80 h GLU 40 Cb 0.13 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1b80 h GLU 40 CO -0.18 0.69 -0.00 0.77 -1.00 0.00 0.00 179.01 179.29 1b80 h SER 41 N 1.07 0.74 -0.21 1.42 0.02 -0.53 -0.30 113.55 115.76 1b80 h SER 41 Ca 0.47 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1b80 h SER 41 Cb 0.35 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1b80 h SER 41 CO -0.23 0.81 -0.01 0.40 -1.14 0.00 0.00 176.83 176.66 1b80 h ILE 42 N 0.72 1.26 -0.60 3.27 2.04 -0.78 -2.93 117.51 120.50 1b80 h ILE 42 Ca 0.14 -0.90 0.07 0.00 1.00 0.00 0.00 64.86 65.17 1b80 h ILE 42 Cb 0.44 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.91 1b80 h ILE 42 CO 0.02 0.28 0.28 -0.09 0.00 0.00 0.00 178.15 178.63 1b80 h ARG 43 N 0.12 0.49 -0.77 2.37 2.43 -1.02 -2.67 114.38 115.34 1b80 h ARG 43 Ca 0.06 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 1b80 h ARG 43 Cb 0.41 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.80 1b80 h ARG 43 CO 0.01 0.33 0.50 1.25 -1.51 0.00 0.00 179.97 180.55 1b80 h LEU 44 N 0.51 0.72 -0.40 3.80 5.85 -0.92 -1.44 115.31 123.43 1b80 h LEU 44 Ca 0.28 0.00 0.05 0.00 0.84 0.00 0.00 57.88 59.06 1b80 h LEU 44 Cb 0.26 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1b80 h LEU 44 CO -0.23 0.47 0.13 0.58 -0.34 0.00 0.00 178.44 179.04 1b80 h VAL 45 N 0.82 0.86 -0.53 1.05 2.07 -1.29 0.55 116.25 119.77 1b80 h VAL 45 Ca 0.33 -0.10 -0.11 0.00 0.82 0.00 0.00 66.70 67.64 1b80 h VAL 45 Cb 0.24 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1b80 h VAL 45 CO -0.11 0.05 -0.11 0.15 0.02 0.00 0.00 177.57 177.57 1b80 h PHE 46 N 0.28 1.12 0.00 1.57 3.57 -1.33 -1.22 116.94 120.93 1b80 h PHE 46 Ca 0.19 -0.23 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 1b80 h PHE 46 Cb 0.18 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1b80 h PHE 46 CO -0.16 1.04 -0.40 0.45 -2.23 0.00 0.00 178.31 177.00 1b80 h HIS 47 N 0.89 0.00 0.08 0.41 3.86 -0.98 -1.97 115.15 117.45 1b80 h HIS 47 Ca 0.14 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 1b80 h HIS 47 Cb 0.67 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.14 1b80 h HIS 47 CO 0.04 0.40 -0.04 0.22 0.86 0.00 0.00 177.93 179.42 1b80 h ASP 48 N 0.00 -0.09 -0.20 2.45 3.58 -0.78 -3.40 116.42 117.98 1b80 h ASP 48 Ca -0.00 -0.49 -0.17 0.00 0.42 0.00 0.00 57.03 56.79 1b80 h ASP 48 Cb 0.88 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.95 1b80 h ASP 48 CO 0.05 0.49 -0.54 0.28 -2.88 0.00 0.00 179.24 176.64 1b80 h SER 49 N -0.73 0.82 0.72 2.28 0.02 -1.06 -3.33 113.55 112.28 1b80 h SER 49 Ca -0.01 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1b80 h SER 49 Cb 0.57 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1b80 h SER 49 CO 0.02 1.25 0.00 0.00 -1.14 0.00 0.00 176.83 176.96 1b80 n ILE 50 N -4.11 0.74 -1.56 3.27 0.13 -0.75 -4.05 119.36 113.03 1b80 n ILE 50 Ca -0.06 0.16 -0.42 0.00 -1.10 0.00 0.00 62.75 61.33 1b80 n ILE 50 Cb 0.62 -0.91 -0.01 0.00 -0.84 0.00 0.00 39.64 38.49 1b80 n ILE 50 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1b80 n ALA 51 N -1.58 5.26 -3.46 1.51 0.00 -1.25 -4.77 120.51 116.21 1b80 n ALA 51 Ca 0.04 -3.69 -0.12 0.00 0.00 0.00 0.00 53.44 49.67 1b80 n ALA 51 Cb 0.24 -3.53 -0.10 0.00 0.00 0.00 0.00 19.45 16.05 1b80 n ALA 51 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1b80 s ILE 52 N 3.47 -0.01 -0.31 0.00 2.07 -1.22 -2.66 121.20 122.55 1b80 s ILE 52 Ca 0.51 0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.78 1b80 s ILE 52 Cb 0.14 -0.61 0.14 0.00 0.13 0.00 0.00 42.46 42.26 1b80 s ILE 52 CO -0.05 0.01 0.31 -0.55 -1.91 0.00 0.00 174.94 172.76 1b80 s SER 53 N 0.68 1.62 0.35 4.50 0.15 -0.59 -4.17 113.70 116.23 1b80 s SER 53 Ca -0.04 -0.97 0.03 0.00 0.70 0.00 0.00 55.95 55.67 1b80 s SER 53 Cb -0.05 0.49 0.64 0.00 -1.71 0.00 0.00 66.02 65.39 1b80 s SER 53 CO -0.05 -0.36 1.99 -0.65 1.20 0.00 0.00 173.24 175.37 1b80 h PRO 54 N 7.98 0.85 -0.30 5.44 0.11 -1.90 -1.50 132.00 142.68 1b80 h PRO 54 Ca -0.09 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.02 1b80 h PRO 54 Cb 1.07 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 1b80 h PRO 54 CO 0.31 0.56 0.04 0.00 -0.21 0.00 0.00 178.00 178.70 1b80 h ALA 55 N 1.59 0.30 -0.29 -0.75 0.00 -1.94 -0.27 119.26 117.91 1b80 h ALA 55 Ca 0.27 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1b80 h ALA 55 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1b80 h ALA 55 CO -0.07 -0.37 0.14 0.52 0.00 0.00 0.00 179.25 179.47 1b80 h MET 56 N 0.14 0.41 -0.70 0.00 2.86 -1.61 -2.43 114.93 113.60 1b80 h MET 56 Ca 0.14 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.82 1b80 h MET 56 Cb 0.16 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.70 1b80 h MET 56 CO -0.20 0.39 0.46 0.93 1.06 0.00 0.00 176.91 179.55 1b80 h GLU 57 N 0.33 0.54 0.00 1.72 4.39 -0.91 0.15 114.58 120.80 1b80 h GLU 57 Ca 0.10 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1b80 h GLU 57 Cb 0.11 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1b80 h GLU 57 CO -0.01 0.35 -0.20 0.00 -1.16 0.00 0.00 179.01 177.99 1b80 h ALA 58 N 1.65 1.31 -0.36 3.43 0.00 -0.57 -2.37 119.26 122.35 1b80 h ALA 58 Ca 0.32 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1b80 h ALA 58 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1b80 h ALA 58 CO -0.11 0.25 0.00 1.04 0.00 0.00 0.00 179.25 180.43 1b80 n GLN 59 N -3.78 2.11 -0.91 0.00 6.02 0.51 -4.91 117.38 116.42 1b80 n GLN 59 Ca -0.02 -1.41 0.00 0.00 -0.01 0.00 0.00 57.00 55.57 1b80 n GLN 59 Cb 0.30 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.15 1b80 n GLN 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b80 n GLY 60 N 0.93 0.74 3.63 1.08 0.00 -0.89 -5.04 105.19 105.64 1b80 n GLY 60 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1b80 n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b80 s LYS 61 N -0.09 2.37 0.17 1.61 1.02 -1.05 -5.00 119.74 118.76 1b80 s LYS 61 Ca 0.00 -0.90 -0.32 0.00 0.02 0.00 0.00 55.97 54.78 1b80 s LYS 61 Cb 0.00 -2.44 -0.10 0.00 -0.52 0.00 0.00 37.83 34.77 1b80 s LYS 61 CO 0.00 0.54 1.59 0.12 -0.92 0.00 0.00 175.35 176.68 1b80 s PHE 62 N -1.22 3.01 -1.07 3.18 5.36 -1.26 -2.68 117.98 123.30 1b80 s PHE 62 Ca 0.23 0.58 0.13 0.00 -0.96 0.00 0.00 56.93 56.91 1b80 s PHE 62 Cb -0.11 -3.95 0.39 0.00 -0.34 0.00 0.00 43.02 39.00 1b80 s PHE 62 CO 0.15 -3.55 1.33 0.41 -1.46 0.00 0.00 175.22 172.10 1b80 n GLY 63 N 3.79 2.79 0.00 13.12 0.00 -1.26 -4.75 105.19 118.88 1b80 n GLY 63 Ca 0.14 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1b80 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b80 n GLY 64 N 0.68 1.51 1.39 -0.02 0.00 -1.26 -1.53 105.19 105.95 1b80 n GLY 64 Ca 0.15 -1.80 0.10 0.00 0.00 0.00 0.00 46.02 44.48 1b80 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b80 n GLY 65 N 1.43 2.65 7.00 -0.02 0.00 -1.23 -4.42 105.19 110.59 1b80 n GLY 65 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1b80 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b80 n GLY 66 N 1.35 1.24 3.58 -0.02 0.00 -1.09 -4.22 105.19 106.03 1b80 n GLY 66 Ca 0.24 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 1b80 n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b80 s ALA 67 N -2.00 3.07 0.00 4.61 0.00 0.20 -4.22 121.76 123.42 1b80 s ALA 67 Ca 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 51.96 49.19 1b80 s ALA 67 Cb 0.00 -4.65 0.00 0.00 0.00 0.00 0.00 23.12 18.47 1b80 s ALA 67 CO 0.00 -3.58 0.64 -0.40 0.00 0.00 0.00 175.76 172.42 1b80 n ASP 68 N 9.25 1.05 -0.21 0.00 5.75 -1.26 -4.87 116.55 126.26 1b80 n ASP 68 Ca 0.47 -1.41 -0.03 0.00 -0.01 0.00 0.00 54.79 53.81 1b80 n ASP 68 Cb 0.46 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.54 1b80 n ASP 68 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1b80 n GLY 69 N -0.21 0.56 0.37 6.12 0.00 -1.26 -1.53 105.19 109.24 1b80 n GLY 69 Ca 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 46.02 45.73 1b80 n GLY 69 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1b80 h SER 70 N 0.00 1.11 0.02 1.61 4.64 -1.90 -0.87 113.55 118.16 1b80 h SER 70 Ca -0.06 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1b80 h SER 70 Cb 0.41 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1b80 h SER 70 CO 0.08 0.84 -0.00 -0.29 -0.87 0.00 0.00 176.83 176.59 1b80 h ILE 71 N 1.28 0.23 0.04 0.95 2.10 -1.89 0.74 117.51 120.96 1b80 h ILE 71 Ca 0.34 -0.02 -0.36 0.00 1.08 0.00 0.00 64.86 65.90 1b80 h ILE 71 Cb -0.07 1.01 -0.05 0.00 -1.09 0.00 0.00 36.82 36.62 1b80 h ILE 71 CO -0.07 0.00 -2.06 0.80 -1.08 0.00 0.00 178.15 175.74 1b80 n MET 72 N -3.42 0.65 -0.11 2.19 1.56 -0.44 -3.39 117.12 114.17 1b80 n MET 72 Ca -0.03 0.31 -0.09 0.00 -0.27 0.00 0.00 57.70 57.63 1b80 n MET 72 Cb 0.08 -1.62 -0.01 0.00 2.15 0.00 0.00 33.22 33.82 1b80 n MET 72 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 1b80 h ILE 73 N -0.45 1.10 -1.73 1.12 2.04 -0.87 -3.00 117.51 115.73 1b80 h ILE 73 Ca -0.51 -0.21 -0.68 0.00 1.00 0.00 0.00 64.86 64.45 1b80 h ILE 73 Cb 1.73 0.62 -0.34 0.00 -0.74 0.00 0.00 36.82 38.10 1b80 h ILE 73 CO -0.14 0.10 0.25 0.49 0.00 0.00 0.00 178.15 178.85 1b80 n PHE 74 N -4.83 3.17 -0.33 1.37 3.72 0.22 -4.83 117.46 115.95 1b80 n PHE 74 Ca -0.01 -2.68 0.01 0.00 -0.05 0.00 0.00 57.45 54.72 1b80 n PHE 74 Cb 0.04 -0.71 0.18 0.00 -0.94 0.00 0.00 39.48 38.05 1b80 n PHE 74 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1b80 h ASP 75 N 2.77 1.03 -0.87 4.37 2.03 -1.54 -1.47 116.42 122.74 1b80 h ASP 75 Ca 0.45 -0.01 0.18 0.00 -0.73 0.00 0.00 57.03 56.91 1b80 h ASP 75 Cb 0.47 -0.24 -0.06 0.00 -0.83 0.00 0.00 39.33 38.67 1b80 h ASP 75 CO 1.18 0.71 0.57 -2.24 -1.03 0.00 0.00 179.24 178.43 1b80 h ASP 76 N 1.19 0.47 0.00 4.15 2.03 -1.88 0.06 116.42 122.44 1b80 h ASP 76 Ca 0.37 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.71 1b80 h ASP 76 Cb -0.01 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 38.44 1b80 h ASP 76 CO -0.11 0.21 -0.18 0.40 -1.03 0.00 0.00 179.24 178.53 1b80 h ILE 77 N 0.49 0.00 -0.51 4.15 2.04 -1.79 -3.38 117.51 118.50 1b80 h ILE 77 Ca 0.44 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1b80 h ILE 77 Cb 0.98 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1b80 h ILE 77 CO -0.18 0.00 0.11 -0.33 0.00 0.00 0.00 178.15 177.75 1b80 h GLU 78 N -0.78 0.78 0.00 2.37 5.08 -1.20 -2.72 114.58 118.11 1b80 h GLU 78 Ca 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1b80 h GLU 78 Cb 0.18 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1b80 h GLU 78 CO 0.00 0.72 0.00 0.25 -1.00 0.00 0.00 179.01 178.98 1b80 n THR 79 N -4.28 0.55 0.66 1.13 -2.24 -0.00 -2.14 114.28 107.95 1b80 n THR 79 Ca 0.03 0.13 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 1b80 n THR 79 Cb 0.23 -0.78 0.33 0.00 -2.10 0.00 0.00 70.33 68.02 1b80 n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b80 n ALA 80 N -1.50 2.57 -1.86 6.98 0.00 -1.03 -4.42 120.51 121.25 1b80 n ALA 80 Ca 0.05 -0.12 -0.41 0.00 0.00 0.00 0.00 53.44 52.96 1b80 n ALA 80 Cb 0.25 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 1b80 n ALA 80 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1b80 s PHE 81 N -3.11 3.18 0.24 0.00 0.08 -0.91 -4.94 117.98 112.52 1b80 s PHE 81 Ca 0.09 1.34 -0.05 0.00 0.12 0.00 0.00 56.93 58.43 1b80 s PHE 81 Cb 0.13 -3.62 0.37 0.00 -0.57 0.00 0.00 43.02 39.33 1b80 s PHE 81 CO 0.64 -1.81 1.83 1.25 -0.10 0.00 0.00 175.22 177.03 1b80 h HIS 82 N 4.30 0.91 0.00 0.36 2.76 -1.89 -1.32 115.15 120.27 1b80 h HIS 82 Ca -0.47 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 57.73 1b80 h HIS 82 Cb 1.22 -0.29 -0.00 0.00 1.55 0.00 0.00 27.41 29.89 1b80 h HIS 82 CO 0.59 0.42 -0.01 -1.35 -1.30 0.00 0.00 177.93 176.28 1b80 h PRO 83 N 0.87 0.00 -0.63 5.26 0.11 -1.90 -2.04 132.00 133.67 1b80 h PRO 83 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1b80 h PRO 83 Cb 0.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.39 1b80 h PRO 83 CO -0.21 0.01 0.00 0.09 -0.21 0.00 0.00 178.00 177.67 1b80 n ASN 84 N -3.23 4.85 -4.62 -2.05 3.02 -0.50 -5.00 115.26 107.73 1b80 n ASN 84 Ca -0.03 -2.51 -0.47 0.00 -0.03 0.00 0.00 54.58 51.55 1b80 n ASN 84 Cb 0.10 -0.59 -0.03 0.00 -0.61 0.00 0.00 39.78 38.65 1b80 n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b80 n ILE 85 N 1.04 1.01 -0.39 2.41 3.06 -0.77 -1.62 119.36 124.09 1b80 n ILE 85 Ca 0.26 -0.25 0.00 0.00 -2.50 0.00 0.00 62.75 60.26 1b80 n ILE 85 Cb 0.92 -1.12 0.00 0.00 0.54 0.00 0.00 39.64 39.98 1b80 n ILE 85 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1b80 n GLY 86 N 2.00 1.83 0.09 4.50 0.00 -1.26 -4.91 105.19 107.43 1b80 n GLY 86 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1b80 n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b80 n LEU 87 N 0.00 0.74 0.23 0.99 4.77 -0.64 -3.49 117.00 119.60 1b80 n LEU 87 Ca 0.00 0.45 0.09 0.00 -0.03 0.00 0.00 56.01 56.52 1b80 n LEU 87 Cb 0.00 -0.28 0.57 0.00 -2.33 0.00 0.00 43.42 41.38 1b80 n LEU 87 CO 0.00 -0.13 0.88 -0.78 -1.33 0.00 0.00 177.39 176.03 1b80 h ASP 88 N 0.00 0.00 -0.24 -1.43 3.58 -1.86 -1.89 116.42 114.59 1b80 h ASP 88 Ca 0.00 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.48 1b80 h ASP 88 Cb 0.73 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.75 1b80 h ASP 88 CO 0.00 0.21 0.06 -0.08 -2.88 0.00 0.00 179.24 176.55 1b80 h GLU 89 N 0.00 0.16 -0.10 0.28 4.22 -1.80 0.82 114.58 118.16 1b80 h GLU 89 Ca -0.00 -0.01 -0.20 0.00 0.08 0.00 0.00 59.36 59.23 1b80 h GLU 89 Cb 0.45 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1b80 h GLU 89 CO 0.03 0.11 -0.75 0.97 -2.18 0.00 0.00 179.01 177.19 1b80 h ILE 90 N 0.17 1.35 -0.44 2.32 6.09 -1.69 -2.25 117.51 123.05 1b80 h ILE 90 Ca 0.11 -2.10 0.02 0.00 -1.37 0.00 0.00 64.86 61.53 1b80 h ILE 90 Cb 0.09 2.08 -0.03 0.00 0.47 0.00 0.00 36.82 39.43 1b80 h ILE 90 CO -0.13 0.64 0.25 0.58 -3.07 0.00 0.00 178.15 176.42 1b80 h VAL 91 N 0.35 1.02 -0.16 2.19 2.07 -1.07 -0.28 116.25 120.37 1b80 h VAL 91 Ca -0.04 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1b80 h VAL 91 Cb 1.34 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1b80 h VAL 91 CO 0.14 0.09 -0.10 0.11 0.02 0.00 0.00 177.57 177.83 1b80 h LYS 92 N 0.50 0.24 -0.01 1.57 1.57 -0.73 -0.53 116.57 119.19 1b80 h LYS 92 Ca 0.18 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.76 1b80 h LYS 92 Cb 0.04 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1b80 h LYS 92 CO -0.10 0.35 -0.69 -0.07 -0.57 0.00 0.00 179.45 178.37 1b80 h LEU 93 N 0.23 0.04 0.11 2.94 3.38 -0.78 -3.31 115.31 117.93 1b80 h LEU 93 Ca 0.05 -0.03 -0.28 0.00 0.09 0.00 0.00 57.88 57.71 1b80 h LEU 93 Cb 0.32 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1b80 h LEU 93 CO 0.02 0.72 -1.36 1.56 0.09 0.00 0.00 178.44 179.47 1b80 h GLN 94 N 0.03 0.23 -0.90 1.13 4.20 -0.45 -3.40 115.11 115.95 1b80 h GLN 94 Ca -0.01 -0.39 0.16 0.00 0.06 0.00 0.00 58.65 58.46 1b80 h GLN 94 Cb 1.22 0.15 -0.16 0.00 0.30 0.00 0.00 27.48 28.99 1b80 h GLN 94 CO 0.09 1.13 -0.33 0.87 -0.67 0.00 0.00 178.83 179.92 1b80 h LYS 95 N 0.06 -0.03 -0.87 1.46 1.57 -1.20 -1.87 116.57 115.70 1b80 h LYS 95 Ca -0.17 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.66 1b80 h LYS 95 Cb 1.98 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 34.24 1b80 h LYS 95 CO 0.18 -0.02 0.57 -1.35 -0.57 0.00 0.00 179.45 178.25 1b80 h PRO 96 N -0.03 0.98 -0.44 3.15 0.10 -1.78 -1.80 132.00 132.19 1b80 h PRO 96 Ca 0.36 -0.06 -0.04 0.00 0.10 0.00 0.00 66.00 66.36 1b80 h PRO 96 Cb 0.61 -0.22 -0.02 0.00 0.10 0.00 0.00 31.00 31.47 1b80 h PRO 96 CO -0.92 0.65 0.10 0.74 0.10 0.00 0.00 178.00 178.67 1b80 h PHE 97 N 1.01 0.66 -0.04 0.65 0.04 -1.60 -0.79 116.94 116.88 1b80 h PHE 97 Ca 0.37 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 61.07 1b80 h PHE 97 Cb 0.15 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.10 1b80 h PHE 97 CO -0.00 0.57 -0.01 0.28 -0.60 0.00 0.00 178.31 178.55 1b80 h VAL 98 N 0.64 1.31 -0.33 -0.55 2.07 -1.31 -2.38 116.25 115.69 1b80 h VAL 98 Ca 0.14 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.72 1b80 h VAL 98 Cb 0.25 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1b80 h VAL 98 CO -0.00 0.26 0.21 1.56 0.02 0.00 0.00 177.57 179.61 1b80 h GLN 99 N -0.29 0.41 -0.59 1.57 4.20 -1.26 -1.53 115.11 117.64 1b80 h GLN 99 Ca 0.01 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1b80 h GLN 99 Cb 0.42 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1b80 h GLN 99 CO 0.01 0.27 0.19 -0.22 -0.67 0.00 0.00 178.83 178.41 1b80 h LYS 100 N 0.43 0.88 0.00 1.46 3.64 -1.18 -3.27 116.57 118.52 1b80 h LYS 100 Ca 0.13 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1b80 h LYS 100 Cb -0.03 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 1b80 h LYS 100 CO -0.04 0.75 -0.92 0.72 -2.27 0.00 0.00 179.45 177.69 1b80 n HIS 101 N -4.30 0.06 -3.29 1.91 8.25 -0.90 -4.99 115.22 111.96 1b80 n HIS 101 Ca 0.05 0.02 -0.17 0.00 -0.26 0.00 0.00 57.72 57.35 1b80 n HIS 101 Cb 0.20 -0.19 0.06 0.00 1.12 0.00 0.00 29.99 31.18 1b80 n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b80 n GLY 102 N 1.46 -0.17 3.80 -1.41 0.00 -0.59 -5.03 105.19 103.25 1b80 n GLY 102 Ca 0.04 0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1b80 n GLY 102 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b80 s VAL 103 N -3.24 3.88 0.45 1.61 -7.23 -1.22 -5.10 120.40 109.55 1b80 s VAL 103 Ca 0.39 -1.50 -0.22 0.00 -1.81 0.00 0.00 61.98 58.84 1b80 s VAL 103 Cb -0.17 -3.21 -0.09 0.00 0.56 0.00 0.00 36.38 33.47 1b80 s VAL 103 CO 0.55 -0.28 1.05 0.42 -0.31 0.00 0.00 175.10 176.53 1b80 s THR 104 N -2.24 3.70 0.19 5.32 -4.23 -1.26 -4.83 115.64 112.29 1b80 s THR 104 Ca 0.36 1.17 -0.12 0.00 -1.18 0.00 0.00 61.69 61.92 1b80 s THR 104 Cb -0.06 -3.54 0.10 0.00 1.34 0.00 0.00 72.50 70.33 1b80 s THR 104 CO 0.24 -0.12 1.78 -0.65 -0.54 0.00 0.00 174.62 175.34 1b80 h PRO 105 N 1.97 0.50 -0.54 3.99 0.11 -1.89 -1.22 132.00 134.92 1b80 h PRO 105 Ca -0.49 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1b80 h PRO 105 Cb 1.22 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1b80 h PRO 105 CO 0.60 0.33 0.32 0.78 -0.21 0.00 0.00 178.00 179.83 1b80 h GLY 106 N 0.51 0.78 1.47 -0.55 0.00 -1.82 -0.70 103.07 102.76 1b80 h GLY 106 Ca 0.25 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.16 1b80 h GLY 106 CO -0.18 0.31 -0.19 -0.55 0.00 0.00 0.00 176.54 175.93 1b80 h ASP 107 N 0.72 0.62 -0.63 0.19 3.32 -1.71 -2.43 116.42 116.50 1b80 h ASP 107 Ca 0.19 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1b80 h ASP 107 Cb -0.01 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1b80 h ASP 107 CO -0.04 0.82 0.21 0.15 -1.72 0.00 0.00 179.24 178.66 1b80 h PHE 108 N 0.56 1.00 -0.70 4.55 3.57 -0.94 -0.08 116.94 124.90 1b80 h PHE 108 Ca 0.09 -0.09 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1b80 h PHE 108 Cb 0.63 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1b80 h PHE 108 CO 0.03 0.81 0.22 0.82 -2.23 0.00 0.00 178.31 177.96 1b80 h ILE 109 N 0.90 1.26 -0.22 1.41 2.04 -0.91 0.96 117.51 122.95 1b80 h ILE 109 Ca 0.21 -0.88 -0.12 0.00 1.00 0.00 0.00 64.86 65.07 1b80 h ILE 109 Cb 0.27 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1b80 h ILE 109 CO -0.01 0.34 -0.36 0.00 0.00 0.00 0.00 178.15 178.13 1b80 h ALA 110 N 1.10 0.97 -0.04 1.87 0.00 -1.22 -1.56 119.26 120.37 1b80 h ALA 110 Ca 0.23 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1b80 h ALA 110 Cb 0.30 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1b80 h ALA 110 CO -0.01 0.61 -0.01 0.35 0.00 0.00 0.00 179.25 180.19 1b80 h PHE 111 N 0.41 0.09 -0.46 0.00 3.57 -0.53 -2.31 116.94 117.71 1b80 h PHE 111 Ca 0.04 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1b80 h PHE 111 Cb 0.82 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 1b80 h PHE 111 CO 0.03 0.42 0.12 0.00 -2.23 0.00 0.00 178.31 176.65 1b80 h ALA 112 N 0.66 1.34 -0.54 2.41 0.00 -0.77 -0.64 119.26 121.70 1b80 h ALA 112 Ca 0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1b80 h ALA 112 Cb 0.39 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1b80 h ALA 112 CO 0.00 0.47 0.20 0.78 0.00 0.00 0.00 179.25 180.71 1b80 h GLY 113 N 0.88 0.89 1.03 0.00 0.00 -1.18 0.08 103.07 104.76 1b80 h GLY 113 Ca 0.15 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 1b80 h GLY 113 CO -0.00 0.47 -0.17 0.00 0.00 0.00 0.00 176.54 176.83 1b80 h ALA 114 N 1.05 0.58 -0.43 3.60 0.00 -0.83 -2.12 119.26 121.12 1b80 h ALA 114 Ca 0.18 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1b80 h ALA 114 Cb 0.23 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1b80 h ALA 114 CO -0.01 0.52 0.08 0.28 0.00 0.00 0.00 179.25 180.12 1b80 h VAL 115 N 0.67 1.24 -0.36 0.00 2.07 -1.07 -1.76 116.25 117.04 1b80 h VAL 115 Ca 0.10 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.83 1b80 h VAL 115 Cb 0.72 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 31.39 1b80 h VAL 115 CO 0.05 0.30 -0.18 0.00 0.02 0.00 0.00 177.57 177.77 1b80 h ALA 116 N 0.95 0.10 -0.63 1.67 0.00 -0.91 -1.76 119.26 118.67 1b80 h ALA 116 Ca 0.13 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1b80 h ALA 116 Cb 0.36 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1b80 h ALA 116 CO 0.01 -0.55 0.21 -0.07 0.00 0.00 0.00 179.25 178.84 1b80 h LEU 117 N -0.12 0.88 -2.84 0.00 3.38 -1.21 -1.90 115.31 113.50 1b80 h LEU 117 Ca 0.18 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1b80 h LEU 117 Cb 0.39 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1b80 h LEU 117 CO -0.44 0.81 0.04 0.77 0.09 0.00 0.00 178.44 179.72 1b80 h SER 118 N 0.92 0.00 1.10 -0.43 4.64 -0.46 -1.05 113.55 118.28 1b80 h SER 118 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1b80 h SER 118 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1b80 h SER 118 CO -0.01 0.00 -0.12 0.59 -0.87 0.00 0.00 176.83 176.42 1b80 n ASN 119 N -3.11 0.42 -4.58 4.97 5.03 -0.71 -4.36 115.26 112.91 1b80 n ASN 119 Ca -0.03 0.40 -0.40 0.00 0.87 0.00 0.00 54.58 55.43 1b80 n ASN 119 Cb 0.11 -0.45 -0.09 0.00 -1.02 0.00 0.00 39.78 38.33 1b80 n ASN 119 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1b80 n PRO 121 N 5.35 1.73 0.00 0.00 -0.02 -1.25 -2.28 135.00 138.53 1b80 n PRO 121 Ca -0.09 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1b80 n PRO 121 Cb 0.50 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1b80 n PRO 121 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b80 n GLY 122 N 1.42 1.11 3.76 -1.23 0.00 0.39 -0.70 105.19 109.94 1b80 n GLY 122 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1b80 n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b80 s ALA 123 N -2.27 2.40 1.10 4.61 0.00 -0.97 -4.81 121.76 121.82 1b80 s ALA 123 Ca 0.00 0.63 -0.13 0.00 0.00 0.00 0.00 51.96 52.46 1b80 s ALA 123 Cb 0.00 -3.35 0.25 0.00 0.00 0.00 0.00 23.12 20.02 1b80 s ALA 123 CO 0.00 -1.38 1.06 -2.14 0.00 0.00 0.00 175.76 173.29 1b80 s PRO 124 N -4.01 -0.43 -0.42 0.00 0.02 -1.26 -4.75 135.00 124.15 1b80 s PRO 124 Ca 0.69 0.62 -0.28 0.00 0.02 0.00 0.00 61.00 62.05 1b80 s PRO 124 Cb -0.23 -1.63 0.02 0.00 0.02 0.00 0.00 34.50 32.69 1b80 s PRO 124 CO 0.42 -3.34 1.05 -0.65 -0.33 0.00 0.00 177.00 174.15 1b80 s GLN 125 N -4.72 3.80 0.41 5.54 -1.52 -1.26 -4.67 119.66 117.24 1b80 s GLN 125 Ca 0.67 0.62 -0.13 0.00 -1.95 0.00 0.00 55.36 54.57 1b80 s GLN 125 Cb -0.22 -3.85 -0.07 0.00 -0.22 0.00 0.00 33.01 28.65 1b80 s GLN 125 CO 0.61 -1.16 0.81 -1.64 -0.25 0.00 0.00 175.29 173.66 1b80 s MET 126 N 3.96 3.87 0.32 2.91 -1.94 -1.26 -5.00 119.30 122.16 1b80 s MET 126 Ca 0.44 0.62 0.06 0.00 -1.71 0.00 0.00 55.69 55.10 1b80 s MET 126 Cb -0.10 -2.34 -0.01 0.00 2.01 0.00 0.00 34.83 34.39 1b80 s MET 126 CO 0.24 -0.04 0.45 -0.80 -0.01 0.00 0.00 175.02 174.87 1b80 s ASN 127 N -2.92 6.03 -0.24 3.03 -0.87 -1.26 -4.85 114.94 113.86 1b80 s ASN 127 Ca 0.54 -0.14 -0.03 0.00 -1.57 0.00 0.00 52.86 51.65 1b80 s ASN 127 Cb -0.10 -1.33 0.13 0.00 -0.02 0.00 0.00 41.25 39.92 1b80 s ASN 127 CO 0.28 -0.38 0.39 0.12 -2.57 0.00 0.00 177.10 174.94 1b80 s PHE 128 N -2.15 -0.84 0.03 2.20 5.36 -1.26 -4.85 117.98 116.47 1b80 s PHE 128 Ca 0.43 0.94 0.05 0.00 -0.96 0.00 0.00 56.93 57.39 1b80 s PHE 128 Cb -0.09 0.07 -0.03 0.00 -0.34 0.00 0.00 43.02 42.62 1b80 s PHE 128 CO 0.31 -0.69 -0.11 -0.06 -1.46 0.00 0.00 175.22 173.21 1b80 s PHE 129 N 2.56 2.76 0.33 10.12 0.40 -1.26 -0.31 117.98 132.59 1b80 s PHE 129 Ca 0.11 -0.13 0.08 0.00 -0.60 0.00 0.00 56.93 56.39 1b80 s PHE 129 Cb -0.15 -1.54 -0.03 0.00 0.51 0.00 0.00 43.02 41.80 1b80 s PHE 129 CO -0.16 0.34 0.22 0.95 0.70 0.00 0.00 175.22 177.27 1b80 s THR 130 N -0.99 3.34 0.00 0.64 -4.23 0.60 -4.91 115.64 110.10 1b80 s THR 130 Ca 0.17 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 1b80 s THR 130 Cb -0.11 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.63 1b80 s THR 130 CO 0.07 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1b80 n GLY 131 N -1.26 0.18 3.58 3.99 0.00 -1.26 -1.63 105.19 108.78 1b80 n GLY 131 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1b80 n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b80 s ARG 132 N 0.00 3.65 0.58 1.61 0.52 -1.26 -4.98 118.95 119.07 1b80 s ARG 132 Ca 0.00 0.24 -0.18 0.00 -0.52 0.00 0.00 55.73 55.26 1b80 s ARG 132 Cb 0.00 -3.86 -0.04 0.00 0.52 0.00 0.00 34.95 31.57 1b80 s ARG 132 CO 0.00 -1.00 1.13 0.00 0.02 0.00 0.00 175.30 175.46 1b80 s ALA 133 N 3.33 2.61 0.33 2.13 0.00 -1.26 -4.50 121.76 124.39 1b80 s ALA 133 Ca 0.33 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.77 1b80 s ALA 133 Cb -0.12 -3.36 -0.12 0.00 0.00 0.00 0.00 23.12 19.52 1b80 s ALA 133 CO 0.20 -0.97 1.50 -2.30 0.00 0.00 0.00 175.76 174.20 1b80 n PRO 134 N -1.66 2.56 -1.82 0.00 -0.02 -1.26 -4.79 135.00 128.02 1b80 n PRO 134 Ca 0.12 0.91 -0.38 0.00 -2.02 0.00 0.00 63.50 62.12 1b80 n PRO 134 Cb 0.51 -2.63 0.04 0.00 -0.02 0.00 0.00 33.50 31.40 1b80 n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b80 s ALA 135 N -0.57 2.73 -0.35 3.55 0.00 -0.58 -4.94 121.76 121.59 1b80 s ALA 135 Ca 0.59 1.27 0.10 0.00 0.00 0.00 0.00 51.96 53.92 1b80 s ALA 135 Cb -0.51 -3.55 -0.11 0.00 0.00 0.00 0.00 23.12 18.95 1b80 s ALA 135 CO 0.56 -1.36 0.36 0.25 0.00 0.00 0.00 175.76 175.57 1b80 n THR 136 N -1.20 0.00 -4.08 0.00 -2.24 -1.26 -4.94 114.28 100.55 1b80 n THR 136 Ca 0.11 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.48 1b80 n THR 136 Cb 0.46 0.84 -0.14 0.00 -2.10 0.00 0.00 70.33 69.39 1b80 n THR 136 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b80 s GLN 137 N -2.08 0.32 0.74 -0.78 -0.21 -1.26 -5.15 119.66 111.25 1b80 s GLN 137 Ca 0.02 -0.13 -0.12 0.00 0.02 0.00 0.00 55.36 55.14 1b80 s GLN 137 Cb 0.07 -0.32 0.04 0.00 1.00 0.00 0.00 33.01 33.80 1b80 s GLN 137 CO 0.40 0.08 1.11 -1.25 -2.12 0.00 0.00 175.29 173.50 1b80 s PRO 138 N -0.05 2.35 0.52 2.91 0.04 -1.26 -4.77 135.00 134.74 1b80 s PRO 138 Ca 0.01 1.32 -0.17 0.00 0.04 0.00 0.00 61.00 62.20 1b80 s PRO 138 Cb -0.02 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 1b80 s PRO 138 CO -0.00 -1.59 0.99 0.00 0.04 0.00 0.00 177.00 176.44 1b80 s ALA 139 N -2.62 3.02 0.85 8.56 0.00 -1.26 -4.79 121.76 125.53 1b80 s ALA 139 Ca 0.65 0.23 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 1b80 s ALA 139 Cb -0.20 -3.14 0.10 0.00 0.00 0.00 0.00 23.12 19.89 1b80 s ALA 139 CO 0.50 -0.29 1.09 -1.25 0.00 0.00 0.00 175.76 175.82 1b80 s PRO 140 N -4.01 1.63 0.76 0.00 0.04 -1.26 -4.89 135.00 127.26 1b80 s PRO 140 Ca 0.60 0.77 -0.07 0.00 0.04 0.00 0.00 61.00 62.34 1b80 s PRO 140 Cb -0.11 -1.86 0.11 0.00 0.04 0.00 0.00 34.50 32.69 1b80 s PRO 140 CO 0.31 -1.97 1.06 0.34 0.04 0.00 0.00 177.00 176.78 1b80 s ASP 141 N -3.60 4.33 0.00 6.66 2.15 -1.26 -4.37 116.67 120.58 1b80 s ASP 141 Ca 0.62 0.16 0.00 0.00 0.43 0.00 0.00 52.55 53.76 1b80 s ASP 141 Cb -0.17 -0.62 0.00 0.00 -0.30 0.00 0.00 42.92 41.84 1b80 s ASP 141 CO 0.56 -1.90 0.00 0.61 -0.17 0.00 0.00 175.17 174.27 1b80 n GLY 142 N -3.05 0.56 0.01 2.66 0.00 -1.26 -4.93 105.19 99.18 1b80 n GLY 142 Ca 0.12 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 46.00 1b80 n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b80 n LEU 143 N 0.00 0.00 -4.70 0.99 4.77 -1.26 -4.94 117.00 111.86 1b80 n LEU 143 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.63 1b80 n LEU 143 Cb 0.00 0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 1b80 n LEU 143 CO 0.00 0.03 -0.19 -0.69 -1.33 0.00 0.00 177.39 175.21 1b80 s VAL 144 N -2.97 5.30 0.60 4.08 1.01 -1.26 -4.65 120.40 122.50 1b80 s VAL 144 Ca -0.06 0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.89 1b80 s VAL 144 Cb 0.09 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1b80 s VAL 144 CO 0.62 0.42 1.28 -2.84 0.00 0.00 0.00 175.10 174.57 1b80 s PRO 145 N 0.57 2.87 0.23 2.72 0.02 -1.26 -4.79 135.00 135.36 1b80 s PRO 145 Ca 0.07 2.02 0.08 0.00 0.02 0.00 0.00 61.00 63.18 1b80 s PRO 145 Cb -0.12 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 1b80 s PRO 145 CO 0.00 -1.34 0.10 -1.21 -0.33 0.00 0.00 177.00 174.22 1b80 s GLU 146 N -3.23 2.66 0.46 5.54 0.41 -1.26 -4.88 118.70 118.40 1b80 s GLU 146 Ca 0.78 -1.14 0.31 0.00 -0.41 0.00 0.00 54.97 54.51 1b80 s GLU 146 Cb -0.36 -2.43 1.36 0.00 -1.78 0.00 0.00 34.13 30.93 1b80 s GLU 146 CO 0.39 0.41 1.93 -1.00 -0.49 0.00 0.00 175.26 176.50 1b80 h PRO 147 N 1.94 0.00 -0.47 0.39 0.13 -1.96 -2.23 132.00 129.81 1b80 h PRO 147 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1b80 h PRO 147 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1b80 h PRO 147 CO 0.60 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.34 1b80 n PHE 148 N -2.78 0.61 -2.21 1.56 1.16 -1.26 -1.05 117.46 113.49 1b80 n PHE 148 Ca 0.01 -0.31 -0.33 0.00 -1.87 0.00 0.00 57.45 54.95 1b80 n PHE 148 Cb 0.24 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.10 1b80 n PHE 148 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 1b80 s HIS 149 N -1.39 3.07 0.78 2.97 3.76 -0.84 -5.00 115.29 118.65 1b80 s HIS 149 Ca 0.40 1.52 -0.11 0.00 -0.15 0.00 0.00 55.06 56.71 1b80 s HIS 149 Cb 0.22 -2.98 0.06 0.00 1.11 0.00 0.00 32.58 30.99 1b80 s HIS 149 CO 0.30 -0.93 1.09 0.95 -0.85 0.00 0.00 174.74 175.30 1b80 s THR 150 N -2.38 3.24 0.18 1.30 -4.23 -1.26 -4.67 115.64 107.82 1b80 s THR 150 Ca 0.64 0.40 -0.13 0.00 -1.18 0.00 0.00 61.69 61.42 1b80 s THR 150 Cb -0.15 -3.11 0.09 0.00 1.34 0.00 0.00 72.50 70.67 1b80 s THR 150 CO 0.32 -0.52 1.85 0.58 -0.54 0.00 0.00 174.62 176.31 1b80 h VAL 151 N -1.06 1.15 -0.63 2.29 2.07 -1.95 -1.72 116.25 116.40 1b80 h VAL 151 Ca -0.46 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1b80 h VAL 151 Cb 1.26 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1b80 h VAL 151 CO 0.58 0.14 0.41 0.44 0.02 0.00 0.00 177.57 179.17 1b80 h ASP 152 N 0.79 0.71 -0.53 0.57 3.32 -1.99 -1.33 116.42 117.95 1b80 h ASP 152 Ca 0.22 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.31 1b80 h ASP 152 Cb -0.09 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.24 1b80 h ASP 152 CO -0.05 0.51 0.25 1.56 -1.72 0.00 0.00 179.24 179.79 1b80 h GLN 153 N 0.84 0.46 -0.34 3.56 4.20 -1.80 -0.75 115.11 121.29 1b80 h GLN 153 Ca 0.24 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.79 1b80 h GLN 153 Cb -0.07 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 1b80 h GLN 153 CO -0.06 0.31 -0.29 0.82 -0.67 0.00 0.00 178.83 178.94 1b80 h ILE 154 N 0.48 1.29 -0.38 2.54 2.04 -1.06 -1.56 117.51 120.85 1b80 h ILE 154 Ca 0.24 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 64.68 1b80 h ILE 154 Cb 0.19 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1b80 h ILE 154 CO -0.19 0.47 0.18 0.40 0.00 0.00 0.00 178.15 179.02 1b80 h ILE 155 N 0.56 0.97 -0.36 -0.67 2.04 -1.09 -1.37 117.51 117.60 1b80 h ILE 155 Ca 0.06 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.70 1b80 h ILE 155 Cb 0.86 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1b80 h ILE 155 CO 0.07 0.07 -0.17 0.78 0.00 0.00 0.00 178.15 178.91 1b80 h ASN 156 N 0.38 0.65 -0.18 1.72 -0.26 -1.11 -1.29 115.58 115.48 1b80 h ASN 156 Ca 0.16 -0.20 -0.02 0.00 -0.56 0.00 0.00 56.30 55.68 1b80 h ASN 156 Cb 0.07 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.15 1b80 h ASN 156 CO -0.12 0.83 0.04 -0.09 -1.06 0.00 0.00 177.43 177.04 1b80 h ARG 157 N 0.59 0.29 0.00 0.81 9.65 -0.78 -1.69 114.38 123.26 1b80 h ARG 157 Ca 0.10 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 58.85 1b80 h ARG 157 Cb 0.62 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.15 1b80 h ARG 157 CO 0.04 0.43 -0.24 -0.39 2.80 0.00 0.00 179.97 182.62 1b80 h VAL 158 N 0.11 0.47 -0.26 0.20 -1.51 -1.15 -1.88 116.25 112.23 1b80 h VAL 158 Ca 0.06 -1.36 -0.11 0.00 -1.23 0.00 0.00 66.70 64.06 1b80 h VAL 158 Cb 0.27 1.99 -0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1b80 h VAL 158 CO 0.00 0.23 -0.26 -1.13 -1.23 0.00 0.00 177.57 175.19 1b80 h ASN 159 N 0.00 0.67 0.43 4.19 -1.24 -1.13 -2.51 115.58 115.98 1b80 h ASN 159 Ca -0.00 -0.47 -0.02 0.00 0.71 0.00 0.00 56.30 56.51 1b80 h ASN 159 Cb 0.97 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 39.84 1b80 h ASN 159 CO 0.03 1.00 -0.21 -0.78 -1.29 0.00 0.00 177.43 176.19 1b80 h ASP 160 N 0.34 -0.49 -0.56 1.15 3.58 -1.13 0.12 116.42 119.44 1b80 h ASP 160 Ca 0.04 0.01 0.06 0.00 0.42 0.00 0.00 57.03 57.55 1b80 h ASP 160 Cb 0.82 0.13 -0.05 0.00 1.72 0.00 0.00 39.33 41.94 1b80 h ASP 160 CO 0.06 -0.33 0.27 0.00 -2.88 0.00 0.00 179.24 176.36 1b80 h ALA 161 N -0.03 0.72 0.00 -0.78 0.00 -1.34 -3.38 119.26 114.46 1b80 h ALA 161 Ca -0.06 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1b80 h ALA 161 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1b80 h ALA 161 CO 0.10 -0.09 -0.30 0.41 0.00 0.00 0.00 179.25 179.37 1b80 n GLY 162 N -1.27 -0.22 2.53 0.00 0.00 -0.96 -4.83 105.19 100.44 1b80 n GLY 162 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 1b80 n GLY 162 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b80 n GLU 163 N 0.00 -2.38 -2.91 1.61 1.02 0.43 -4.98 120.64 113.44 1b80 n GLU 163 Ca 0.00 0.94 -0.37 0.00 -0.02 0.00 0.00 57.16 57.71 1b80 n GLU 163 Cb 0.62 -5.60 -0.06 0.00 -0.02 0.00 0.00 31.44 26.38 1b80 n GLU 163 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1b80 s PHE 164 N -3.04 3.73 0.20 -0.32 0.08 -1.16 -4.94 117.98 112.53 1b80 s PHE 164 Ca 0.07 1.65 0.01 0.00 0.12 0.00 0.00 56.93 58.78 1b80 s PHE 164 Cb -0.03 -2.81 0.04 0.00 -0.57 0.00 0.00 43.02 39.65 1b80 s PHE 164 CO 0.09 0.31 0.27 -0.40 -0.10 0.00 0.00 175.22 175.39 1b80 n ASP 165 N 0.81 0.44 0.20 1.36 5.68 -1.26 -3.50 116.55 120.29 1b80 n ASP 165 Ca -0.01 -1.36 0.07 0.00 -0.50 0.00 0.00 54.79 53.00 1b80 n ASP 165 Cb 0.50 -0.17 0.40 0.00 -1.14 0.00 0.00 41.12 40.72 1b80 n ASP 165 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1b80 h GLU 166 N 0.00 0.00 -0.16 0.11 4.11 -1.96 -2.61 114.58 114.06 1b80 h GLU 166 Ca -0.09 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.30 1b80 h GLU 166 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1b80 h GLU 166 CO 0.10 0.32 -0.05 -0.07 0.07 0.00 0.00 179.01 179.39 1b80 h LEU 167 N 0.00 0.32 -1.76 3.06 3.38 -1.95 -3.02 115.31 115.35 1b80 h LEU 167 Ca -0.00 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 1b80 h LEU 167 Cb 0.79 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1b80 h LEU 167 CO 0.04 0.63 -0.16 -0.33 0.09 0.00 0.00 178.44 178.71 1b80 h GLU 168 N 0.02 0.00 -0.58 1.13 5.08 -1.87 -1.68 114.58 116.68 1b80 h GLU 168 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1b80 h GLU 168 Cb 0.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1b80 h GLU 168 CO 0.02 0.16 0.33 1.25 -1.00 0.00 0.00 179.01 179.77 1b80 h LEU 169 N 0.00 0.72 -1.65 1.33 5.85 -1.38 -1.41 115.31 118.76 1b80 h LEU 169 Ca -0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1b80 h LEU 169 Cb 0.32 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1b80 h LEU 169 CO 0.02 0.59 0.00 0.52 -0.34 0.00 0.00 178.44 179.23 1b80 n VAL 170 N -4.60 0.09 0.00 1.05 0.31 -0.63 -2.33 118.33 112.21 1b80 n VAL 170 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1b80 n VAL 170 Cb 0.08 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.61 1b80 n VAL 170 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1b80 n MET 172 N 0.76 0.00 0.00 5.55 0.00 -0.53 -3.42 117.12 119.48 1b80 n MET 172 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.70 57.79 1b80 n MET 172 Cb 0.05 0.00 0.47 0.00 0.00 0.00 0.00 33.22 33.74 1b80 n MET 172 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1b80 n LEU 173 N 0.00 0.00 0.23 3.17 4.77 -0.99 -2.80 117.00 121.38 1b80 n LEU 173 Ca 0.00 0.26 0.15 0.00 -0.03 0.00 0.00 56.01 56.39 1b80 n LEU 173 Cb 0.00 -0.26 0.81 0.00 -2.33 0.00 0.00 43.42 41.65 1b80 n LEU 173 CO 0.00 -0.10 1.13 0.28 -1.33 0.00 0.00 177.39 177.37 1b80 h SER 174 N 0.00 0.00 -0.00 -1.43 0.02 -1.87 -0.94 113.55 109.33 1b80 h SER 174 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1b80 h SER 174 Cb 0.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1b80 h SER 174 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1b80 h ALA 175 N 1.89 1.17 0.00 3.77 0.00 -1.89 -1.11 119.26 123.09 1b80 h ALA 175 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1b80 h ALA 175 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1b80 h ALA 175 CO -0.00 -0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.96 1b80 n HIS 176 N -3.32 0.00 0.52 0.00 -0.00 -0.36 -1.67 115.22 110.39 1b80 n HIS 176 Ca -0.03 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.81 1b80 n HIS 176 Cb 0.08 0.00 0.45 0.00 -0.00 0.00 0.00 29.99 30.52 1b80 n HIS 176 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1b80 n SER 177 N -0.92 0.70 -3.28 0.41 2.88 -0.42 -3.86 113.62 109.12 1b80 n SER 177 Ca 0.12 0.62 -0.25 0.00 -1.33 0.00 0.00 58.87 58.03 1b80 n SER 177 Cb 0.06 -0.79 -0.08 0.00 -0.75 0.00 0.00 64.21 62.65 1b80 n SER 177 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1b80 n VAL 178 N -2.21 0.18 -3.53 2.46 0.24 -0.67 -4.24 118.33 110.55 1b80 n VAL 178 Ca 0.04 -4.33 -0.12 0.00 -2.04 0.00 0.00 64.34 57.88 1b80 n VAL 178 Cb 0.32 -1.99 -0.04 0.00 -1.47 0.00 0.00 33.84 30.66 1b80 n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b80 s ALA 179 N -1.47 -1.84 0.14 2.33 0.00 -1.25 -4.69 121.76 114.98 1b80 s ALA 179 Ca 0.36 1.30 -0.01 0.00 0.00 0.00 0.00 51.96 53.62 1b80 s ALA 179 Cb 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1b80 s ALA 179 CO -0.09 -0.44 0.06 0.00 0.00 0.00 0.00 175.76 175.29 1b80 s ALA 180 N -1.75 0.93 -0.20 0.00 0.00 -1.26 -2.07 121.76 117.40 1b80 s ALA 180 Ca -0.03 -1.51 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 1b80 s ALA 180 Cb -0.00 0.91 0.00 0.00 0.00 0.00 0.00 23.12 24.03 1b80 s ALA 180 CO 0.01 -0.49 -0.11 0.08 0.00 0.00 0.00 175.76 175.25 1b80 s VAL 181 N -4.04 2.85 -0.04 0.00 1.01 0.40 -4.88 120.40 115.69 1b80 s VAL 181 Ca 0.26 -0.68 0.15 0.00 0.00 0.00 0.00 61.98 61.72 1b80 s VAL 181 Cb 0.07 -2.26 -0.23 0.00 0.00 0.00 0.00 36.38 33.96 1b80 s VAL 181 CO 0.03 0.47 0.30 0.59 0.00 0.00 0.00 175.10 176.49 1b80 n ASN 182 N 4.64 1.41 -0.08 3.32 3.02 -1.26 -1.67 115.26 124.65 1b80 n ASN 182 Ca -0.19 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.37 1b80 n ASN 182 Cb 0.51 1.59 0.01 0.00 -0.61 0.00 0.00 39.78 41.28 1b80 n ASN 182 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1b80 n ASP 183 N -2.12 1.41 0.03 6.41 8.00 -1.26 -4.57 116.55 124.46 1b80 n ASP 183 Ca -0.06 -1.32 -0.22 0.00 0.71 0.00 0.00 54.79 53.90 1b80 n ASP 183 Cb 0.49 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.44 1b80 n ASP 183 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1b80 h VAL 184 N 0.33 1.03 -3.79 2.53 2.07 -1.91 -3.42 116.25 113.10 1b80 h VAL 184 Ca 0.00 -2.45 -0.66 0.00 0.82 0.00 0.00 66.70 64.41 1b80 h VAL 184 Cb 0.20 2.77 -0.18 0.00 -1.52 0.00 0.00 31.29 32.55 1b80 h VAL 184 CO 0.00 0.76 -0.47 -0.62 0.02 0.00 0.00 177.57 177.25 1b80 s ASP 185 N -7.13 6.06 0.00 0.57 -1.08 -1.26 -4.75 116.67 109.08 1b80 s ASP 185 Ca -0.18 -0.21 0.21 0.00 -0.52 0.00 0.00 52.55 51.84 1b80 s ASP 185 Cb 0.04 -2.14 0.94 0.00 -1.46 0.00 0.00 42.92 40.31 1b80 s ASP 185 CO 0.80 -0.16 1.67 -0.81 0.52 0.00 0.00 175.17 177.18 1b80 n PRO 186 N 5.11 0.10 0.01 4.34 -0.04 -1.26 -2.78 135.00 140.48 1b80 n PRO 186 Ca -0.13 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1b80 n PRO 186 Cb 0.51 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.57 1b80 n PRO 186 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1b80 n THR 187 N -1.43 0.07 -3.66 0.52 -2.24 -1.26 -4.93 114.28 101.35 1b80 n THR 187 Ca 0.07 -0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 1b80 n THR 187 Cb 0.22 0.37 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 1b80 n THR 187 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1b80 s VAL 188 N -3.07 -0.00 0.10 2.28 0.11 -1.12 -5.04 120.40 113.66 1b80 s VAL 188 Ca 0.08 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.19 1b80 s VAL 188 Cb 0.16 -0.86 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 1b80 s VAL 188 CO 0.77 0.01 0.06 -1.10 -3.33 0.00 0.00 175.10 171.50 1b80 s GLN 189 N 0.91 2.74 0.00 1.54 -0.21 -1.26 -4.58 119.66 118.79 1b80 s GLN 189 Ca -0.05 -0.80 0.00 0.00 0.02 0.00 0.00 55.36 54.53 1b80 s GLN 189 Cb -0.05 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.33 1b80 s GLN 189 CO -0.08 0.54 0.00 0.41 -2.12 0.00 0.00 175.29 174.04 1b80 n GLY 190 N 0.32 0.92 3.69 3.09 0.00 -0.67 -4.59 105.19 107.95 1b80 n GLY 190 Ca -0.09 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1b80 n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b80 s LEU 191 N 0.00 4.26 0.57 0.99 1.43 -0.90 -0.38 118.68 124.66 1b80 s LEU 191 Ca 0.00 1.52 -0.16 0.00 -1.03 0.00 0.00 54.13 54.46 1b80 s LEU 191 Cb 0.00 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.64 1b80 s LEU 191 CO 0.00 -0.41 1.04 -2.84 0.23 0.00 0.00 176.35 174.36 1b80 s PRO 192 N 1.87 3.50 0.31 1.29 0.02 -1.25 -0.45 135.00 140.28 1b80 s PRO 192 Ca 0.48 1.12 0.16 0.00 0.02 0.00 0.00 61.00 62.78 1b80 s PRO 192 Cb -0.18 -2.06 0.11 0.00 0.02 0.00 0.00 34.50 32.38 1b80 s PRO 192 CO 0.19 -0.65 1.47 0.74 -0.33 0.00 0.00 177.00 178.41 1b80 h PHE 193 N 0.54 0.00 -4.33 6.54 0.04 -1.64 -1.59 116.94 116.50 1b80 h PHE 193 Ca -0.47 0.00 -0.37 0.00 2.80 0.00 0.00 57.97 59.94 1b80 h PHE 193 Cb 1.21 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.22 1b80 h PHE 193 CO 0.60 0.41 -0.57 0.16 -0.60 0.00 0.00 178.31 178.32 1b80 s ASP 194 N -6.40 1.10 0.00 2.17 1.47 -1.26 -4.79 116.67 108.96 1b80 s ASP 194 Ca 0.04 -1.53 0.25 0.00 1.18 0.00 0.00 52.55 52.49 1b80 s ASP 194 Cb 0.07 0.40 1.51 0.00 -0.34 0.00 0.00 42.92 44.57 1b80 s ASP 194 CO 0.73 -0.90 1.94 -1.54 0.68 0.00 0.00 175.17 176.09 1b80 n SER 195 N -0.82 0.00 -3.12 2.11 3.41 -1.26 -4.02 113.62 109.93 1b80 n SER 195 Ca 0.03 -1.10 -0.22 0.00 -0.26 0.00 0.00 58.87 57.31 1b80 n SER 195 Cb 0.65 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.56 1b80 n SER 195 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1b80 n THR 196 N -0.92 1.11 0.40 6.66 -2.24 -1.26 -4.96 114.28 113.07 1b80 n THR 196 Ca 0.19 -4.93 0.05 0.00 -2.27 0.00 0.00 64.05 57.10 1b80 n THR 196 Cb 0.09 -0.98 0.24 0.00 -2.10 0.00 0.00 70.33 67.58 1b80 n THR 196 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1b80 n PRO 197 N 0.26 0.02 -0.20 -0.78 -0.04 -1.26 -1.44 135.00 131.56 1b80 n PRO 197 Ca 0.27 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 1b80 n PRO 197 Cb 0.53 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.71 1b80 n PRO 197 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b80 n GLY 198 N -0.36 1.77 3.05 0.55 0.00 -1.26 -3.92 105.19 105.02 1b80 n GLY 198 Ca 0.03 -0.73 -0.24 0.00 0.00 0.00 0.00 46.02 45.08 1b80 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b80 s ILE 199 N -1.43 1.16 -0.65 -0.61 1.01 -0.52 -3.91 121.20 116.25 1b80 s ILE 199 Ca 0.38 -0.53 -0.23 0.00 0.00 0.00 0.00 60.65 60.28 1b80 s ILE 199 Cb 0.22 -1.03 0.06 0.00 0.01 0.00 0.00 42.46 41.73 1b80 s ILE 199 CO 0.31 0.35 0.98 0.12 0.00 0.00 0.00 174.94 176.70 1b80 s PHE 200 N 0.40 2.66 0.06 3.97 5.36 0.12 -4.61 117.98 125.94 1b80 s PHE 200 Ca -0.09 -0.45 0.00 0.00 -0.96 0.00 0.00 56.93 55.43 1b80 s PHE 200 Cb -0.13 -4.28 -0.00 0.00 -0.34 0.00 0.00 43.02 38.26 1b80 s PHE 200 CO 0.03 -1.64 0.07 -0.40 -1.46 0.00 0.00 175.22 171.82 1b80 n ASP 201 N 7.79 -0.19 -1.41 6.13 5.68 -1.26 -4.42 116.55 128.87 1b80 n ASP 201 Ca -0.03 -1.36 0.09 0.00 -0.50 0.00 0.00 54.79 52.99 1b80 n ASP 201 Cb 0.46 0.38 0.31 0.00 -1.14 0.00 0.00 41.12 41.13 1b80 n ASP 201 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1b80 n SER 202 N -2.36 4.14 0.13 -1.12 7.64 -1.26 -4.44 113.62 116.36 1b80 n SER 202 Ca 0.01 -2.34 0.04 0.00 1.01 0.00 0.00 58.87 57.59 1b80 n SER 202 Cb 0.10 -0.53 0.46 0.00 -1.01 0.00 0.00 64.21 63.24 1b80 n SER 202 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1b80 h GLN 203 N 3.65 0.24 -0.75 1.43 1.08 -1.93 -1.73 115.11 117.08 1b80 h GLN 203 Ca 0.00 -0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.24 1b80 h GLN 203 Cb 1.25 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 28.57 1b80 h GLN 203 CO 0.18 0.28 0.42 0.35 -0.95 0.00 0.00 178.83 179.11 1b80 h PHE 204 N 0.23 0.77 -0.07 2.96 3.57 -1.88 0.17 116.94 122.69 1b80 h PHE 204 Ca 0.06 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.44 1b80 h PHE 204 Cb 0.19 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1b80 h PHE 204 CO 0.00 0.34 -0.60 0.74 -2.23 0.00 0.00 178.31 176.56 1b80 h PHE 205 N 0.74 0.32 0.06 0.41 0.04 -1.67 -2.38 116.94 114.47 1b80 h PHE 205 Ca 0.35 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.99 1b80 h PHE 205 Cb 0.27 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1b80 h PHE 205 CO -0.07 0.79 -0.03 0.28 -0.60 0.00 0.00 178.31 178.68 1b80 h VAL 206 N 0.19 1.23 0.00 -0.55 2.07 -0.81 -3.30 116.25 115.09 1b80 h VAL 206 Ca -0.01 -1.16 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 1b80 h VAL 206 Cb 1.11 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 1b80 h VAL 206 CO 0.09 0.28 -0.28 -0.33 0.02 0.00 0.00 177.57 177.35 1b80 h GLU 207 N -0.62 0.00 0.00 1.57 5.08 -0.72 -2.09 114.58 117.80 1b80 h GLU 207 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1b80 h GLU 207 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1b80 h GLU 207 CO 0.01 0.28 0.00 1.79 -1.00 0.00 0.00 179.01 180.10 1b80 h THR 208 N 0.00 0.00 -0.00 1.13 1.35 -1.57 -2.86 112.91 110.96 1b80 h THR 208 Ca -0.00 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1b80 h THR 208 Cb 0.91 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 1b80 h THR 208 CO 0.04 0.00 -0.49 1.67 -0.25 0.00 0.00 175.52 176.48 1b80 n GLN 209 N -2.56 0.08 -1.75 4.72 -0.06 -0.79 -4.89 117.38 112.12 1b80 n GLN 209 Ca 0.03 -0.05 -0.31 0.00 -2.00 0.00 0.00 57.00 54.67 1b80 n GLN 209 Cb 0.36 -1.50 0.03 0.00 -4.06 0.00 0.00 30.24 25.07 1b80 n GLN 209 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1b80 s LEU 210 N -2.95 3.21 0.17 1.69 1.43 -1.08 -0.54 118.68 120.61 1b80 s LEU 210 Ca 0.12 1.55 -0.31 0.00 -1.03 0.00 0.00 54.13 54.46 1b80 s LEU 210 Cb 0.18 -4.49 -0.09 0.00 0.03 0.00 0.00 46.19 41.82 1b80 s LEU 210 CO 0.69 -1.16 1.45 -0.60 0.23 0.00 0.00 176.35 176.95 1b80 s ARG 211 N -5.00 4.28 0.10 1.70 3.52 0.23 -4.74 118.95 119.04 1b80 s ARG 211 Ca 0.57 2.22 -0.30 0.00 -0.13 0.00 0.00 55.73 58.09 1b80 s ARG 211 Cb -0.13 -3.18 -0.06 0.00 -1.56 0.00 0.00 34.95 30.02 1b80 s ARG 211 CO 0.52 -0.47 1.13 0.20 -0.81 0.00 0.00 175.30 175.88 1b80 s GLY 212 N 0.85 2.65 0.00 8.12 0.00 -1.26 -4.24 107.32 113.43 1b80 s GLY 212 Ca 0.64 0.80 0.00 0.00 0.00 0.00 0.00 44.72 46.16 1b80 s GLY 212 CO 0.35 1.84 0.00 -1.30 0.00 0.00 0.00 173.10 173.99 1b80 n THR 213 N 3.30 0.00 -3.47 0.90 -2.24 -0.01 -4.81 114.28 107.94 1b80 n THR 213 Ca 0.06 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.41 1b80 n THR 213 Cb 0.47 0.90 -0.02 0.00 -2.10 0.00 0.00 70.33 69.58 1b80 n THR 213 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b80 s ALA 214 N -0.89 -1.66 0.07 6.98 0.00 -0.94 -4.95 121.76 120.36 1b80 s ALA 214 Ca 0.00 0.63 -0.17 0.00 0.00 0.00 0.00 51.96 52.42 1b80 s ALA 214 Cb 0.00 0.72 -0.06 0.00 0.00 0.00 0.00 23.12 23.78 1b80 s ALA 214 CO 0.00 -0.76 0.51 -0.06 0.00 0.00 0.00 175.76 175.46 1b80 s PHE 215 N -3.53 3.73 -0.12 0.00 0.08 -1.26 -0.94 117.98 115.94 1b80 s PHE 215 Ca 0.03 1.13 0.23 0.00 0.12 0.00 0.00 56.93 58.44 1b80 s PHE 215 Cb -0.01 -2.40 0.58 0.00 -0.57 0.00 0.00 43.02 40.61 1b80 s PHE 215 CO -0.10 0.57 1.68 -1.00 -0.10 0.00 0.00 175.22 176.26 1b80 h PRO 216 N 4.34 0.00 0.00 0.24 0.13 -1.88 -3.46 132.00 131.37 1b80 h PRO 216 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1b80 h PRO 216 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1b80 h PRO 216 CO 0.63 0.20 0.00 0.41 -0.23 0.00 0.00 178.00 179.02 1b80 n GLY 217 N 0.71 3.44 3.84 1.56 0.00 -1.26 -4.65 105.19 108.83 1b80 n GLY 217 Ca 0.02 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1b80 n GLY 217 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b80 s SER 218 N 1.00 6.67 0.46 1.61 1.04 -1.26 -5.06 113.70 118.16 1b80 s SER 218 Ca 0.00 1.52 -0.02 0.00 0.48 0.00 0.00 55.95 57.93 1b80 s SER 218 Cb 0.00 -2.48 -0.02 0.00 0.10 0.00 0.00 66.02 63.62 1b80 s SER 218 CO 0.00 -0.51 0.71 -0.83 0.98 0.00 0.00 173.24 173.60 1b80 s GLY 219 N -2.90 1.50 -1.57 7.32 0.00 -1.26 -4.60 107.32 105.82 1b80 s GLY 219 Ca 0.58 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 44.48 1b80 s GLY 219 CO 0.28 -0.66 0.00 0.61 0.00 0.00 0.00 173.10 173.33 1b80 n GLY 220 N -2.14 0.90 3.77 0.20 0.00 -1.26 -5.02 105.19 101.64 1b80 n GLY 220 Ca 0.00 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1b80 n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b80 s ASN 221 N -2.62 6.12 0.16 1.61 0.01 -1.26 -4.92 114.94 114.03 1b80 s ASN 221 Ca 0.00 2.22 -0.32 0.00 -0.71 0.00 0.00 52.86 54.05 1b80 s ASN 221 Cb 0.00 -2.59 -0.12 0.00 0.41 0.00 0.00 41.25 38.95 1b80 s ASN 221 CO 0.00 -0.95 1.74 1.67 -1.51 0.00 0.00 177.10 178.05 1b80 n GLN 222 N -0.70 2.62 -0.75 -0.60 7.27 -1.26 -1.54 117.38 122.41 1b80 n GLN 222 Ca 0.08 0.95 0.00 0.00 0.07 0.00 0.00 57.00 58.10 1b80 n GLN 222 Cb 0.49 -2.79 0.00 0.00 2.41 0.00 0.00 30.24 30.35 1b80 n GLN 222 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1b80 n GLY 223 N 3.96 0.78 3.58 1.69 0.00 -1.26 -4.92 105.19 109.01 1b80 n GLY 223 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1b80 n GLY 223 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b80 s GLU 224 N -0.25 2.53 0.36 1.61 2.12 -0.59 -0.69 118.70 123.79 1b80 s GLU 224 Ca 0.00 -0.72 0.05 0.00 0.36 0.00 0.00 54.97 54.65 1b80 s GLU 224 Cb 0.00 -2.48 -0.07 0.00 0.26 0.00 0.00 34.13 31.84 1b80 s GLU 224 CO 0.00 0.60 0.04 0.14 -0.54 0.00 0.00 175.26 175.51 1b80 s VAL 225 N -0.96 1.47 0.54 3.70 -7.23 -0.67 -4.71 120.40 112.54 1b80 s VAL 225 Ca 0.16 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.12 1b80 s VAL 225 Cb -0.11 -2.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.92 1b80 s VAL 225 CO 0.06 0.00 1.30 -1.61 -0.31 0.00 0.00 175.10 174.54 1b80 s GLU 226 N -3.83 3.21 0.36 4.82 2.02 -1.26 -4.18 118.70 119.84 1b80 s GLU 226 Ca 0.36 2.09 0.08 0.00 0.02 0.00 0.00 54.97 57.52 1b80 s GLU 226 Cb 0.09 -2.23 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 1b80 s GLU 226 CO 0.16 -1.09 0.07 -1.54 0.02 0.00 0.00 175.26 172.89 1b80 s SER 227 N -1.12 4.32 0.00 -0.19 1.04 -0.12 -4.43 113.70 113.20 1b80 s SER 227 Ca 0.71 -0.98 0.25 0.00 0.48 0.00 0.00 55.95 56.41 1b80 s SER 227 Cb -0.37 -0.56 0.50 0.00 0.10 0.00 0.00 66.02 65.69 1b80 s SER 227 CO 0.43 -0.32 1.41 -0.81 0.98 0.00 0.00 173.24 174.94 1b80 n PRO 228 N -1.05 0.06 -4.06 4.02 -0.04 -1.26 -0.83 135.00 131.84 1b80 n PRO 228 Ca -0.03 -0.04 -0.14 0.00 -0.04 0.00 0.00 63.50 63.25 1b80 n PRO 228 Cb 0.63 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.46 1b80 n PRO 228 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1b80 s LEU 229 N -2.96 2.10 0.25 1.53 1.43 -1.26 -4.83 118.68 114.94 1b80 s LEU 229 Ca 0.12 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.67 1b80 s LEU 229 Cb 0.18 -0.15 -0.13 0.00 0.03 0.00 0.00 46.19 46.11 1b80 s LEU 229 CO 0.69 -0.06 1.51 -2.65 0.23 0.00 0.00 176.35 176.08 1b80 n PRO 230 N 2.43 2.35 0.00 1.29 -0.02 -1.26 -2.28 135.00 137.51 1b80 n PRO 230 Ca -0.17 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1b80 n PRO 230 Cb 0.57 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1b80 n PRO 230 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b80 n GLY 231 N 2.35 2.25 3.88 -1.23 0.00 -1.26 -0.67 105.19 110.51 1b80 n GLY 231 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1b80 n GLY 231 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b80 s GLU 232 N -0.39 3.42 0.10 1.61 2.12 -0.97 -3.94 118.70 120.65 1b80 s GLU 232 Ca 0.00 -0.18 0.05 0.00 0.36 0.00 0.00 54.97 55.19 1b80 s GLU 232 Cb 0.00 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.20 1b80 s GLU 232 CO 0.00 0.76 0.03 -1.50 -0.54 0.00 0.00 175.26 174.01 1b80 s ILE 233 N -1.08 4.18 -0.06 -3.70 2.07 -0.60 -4.47 121.20 117.54 1b80 s ILE 233 Ca 0.17 -0.97 0.03 0.00 -1.41 0.00 0.00 60.65 58.47 1b80 s ILE 233 Cb -0.12 -3.02 0.01 0.00 0.13 0.00 0.00 42.46 39.46 1b80 s ILE 233 CO 0.07 0.09 -0.13 -0.60 -1.91 0.00 0.00 174.94 172.46 1b80 s ARG 234 N -2.44 1.62 0.18 3.50 3.52 -1.26 -4.47 118.95 119.59 1b80 s ARG 234 Ca 0.27 -0.44 0.03 0.00 -0.13 0.00 0.00 55.73 55.47 1b80 s ARG 234 Cb -0.12 -1.36 -0.03 0.00 -1.56 0.00 0.00 34.95 31.88 1b80 s ARG 234 CO 0.20 0.08 0.29 0.96 -0.81 0.00 0.00 175.30 176.02 1b80 s ILE 235 N 0.48 5.24 0.25 4.11 -4.36 -1.26 -1.68 121.20 123.98 1b80 s ILE 235 Ca -0.11 -0.80 -0.06 0.00 -0.26 0.00 0.00 60.65 59.42 1b80 s ILE 235 Cb -0.14 -3.74 0.26 0.00 1.25 0.00 0.00 42.46 40.09 1b80 s ILE 235 CO 0.03 -0.16 1.92 -0.61 0.24 0.00 0.00 174.94 176.36 1b80 h GLN 236 N 1.89 1.28 -0.27 0.37 4.15 -1.03 -1.92 115.11 119.58 1b80 h GLN 236 Ca -0.49 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 58.84 1b80 h GLN 236 Cb 1.20 -0.29 -0.01 0.00 0.21 0.00 0.00 27.48 28.59 1b80 h GLN 236 CO 0.66 0.85 0.13 0.66 -1.93 0.00 0.00 178.83 179.20 1b80 h SER 237 N 1.32 0.36 -0.69 -0.69 4.64 -1.35 -1.66 113.55 115.48 1b80 h SER 237 Ca 0.38 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.54 1b80 h SER 237 Cb -0.10 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.86 1b80 h SER 237 CO -0.09 0.39 0.33 0.44 -0.87 0.00 0.00 176.83 177.02 1b80 h ASP 238 N 0.31 0.90 -0.43 4.97 3.32 -1.82 -0.82 116.42 122.85 1b80 h ASP 238 Ca 0.09 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.04 1b80 h ASP 238 Cb 0.12 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1b80 h ASP 238 CO -0.01 0.78 0.23 -0.74 -1.72 0.00 0.00 179.24 177.78 1b80 h HIS 239 N 0.96 0.42 -0.00 4.55 2.76 -1.16 -2.23 115.15 120.46 1b80 h HIS 239 Ca 0.24 0.02 -0.19 0.00 -2.20 0.00 0.00 60.37 58.24 1b80 h HIS 239 Cb 0.12 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 1b80 h HIS 239 CO 0.01 0.23 -0.84 1.79 -1.30 0.00 0.00 177.93 177.81 1b80 h THR 240 N 0.46 1.51 -0.24 6.26 1.35 -1.02 -3.17 112.91 118.06 1b80 h THR 240 Ca 0.18 -2.62 -0.08 0.00 -0.55 0.00 0.00 66.41 63.34 1b80 h THR 240 Cb 0.06 2.45 -0.01 0.00 -1.73 0.00 0.00 68.15 68.91 1b80 h THR 240 CO -0.11 0.76 -0.21 0.40 -0.25 0.00 0.00 175.52 176.10 1b80 h ILE 241 N 0.08 1.25 0.00 6.82 2.04 -1.08 -0.68 117.51 125.94 1b80 h ILE 241 Ca -0.03 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 1b80 h ILE 241 Cb 1.46 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1b80 h ILE 241 CO 0.12 0.37 -0.04 0.00 0.00 0.00 0.00 178.15 178.60 1b80 h ALA 242 N 1.38 1.05 0.00 1.87 0.00 -1.38 -3.17 119.26 119.01 1b80 h ALA 242 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1b80 h ALA 242 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1b80 h ALA 242 CO 0.04 0.06 -0.48 0.54 0.00 0.00 0.00 179.25 179.41 1b80 n ARG 243 N -3.21 3.77 -2.32 0.00 1.74 -0.78 -4.43 116.66 111.42 1b80 n ARG 243 Ca -0.01 -0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 1b80 n ARG 243 Cb 0.26 -0.95 -0.03 0.00 -1.02 0.00 0.00 32.46 30.71 1b80 n ARG 243 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1b80 s ASP 244 N -1.93 7.05 0.60 0.55 -1.08 -0.33 -4.81 116.67 116.71 1b80 s ASP 244 Ca 0.03 2.37 0.30 0.00 -0.52 0.00 0.00 52.55 54.73 1b80 s ASP 244 Cb 0.07 -2.62 1.72 0.00 -1.46 0.00 0.00 42.92 40.63 1b80 s ASP 244 CO 0.38 -0.36 2.13 0.77 0.52 0.00 0.00 175.17 178.61 1b80 h SER 245 N 4.43 0.00 0.82 -0.34 4.64 -1.91 0.24 113.55 121.43 1b80 h SER 245 Ca -0.46 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.69 1b80 h SER 245 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1b80 h SER 245 CO 0.71 0.00 -0.82 0.03 -0.87 0.00 0.00 176.83 175.87 1b80 h ARG 246 N 0.00 0.00 0.00 4.77 3.08 -1.94 -3.39 114.38 116.91 1b80 h ARG 246 Ca 0.07 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1b80 h ARG 246 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1b80 h ARG 246 CO -0.00 0.82 -0.10 0.25 -1.07 0.00 0.00 179.97 179.87 1b80 n THR 247 N -3.56 0.00 -0.24 2.04 -2.24 -0.74 -4.77 114.28 104.77 1b80 n THR 247 Ca -0.01 -0.41 -0.02 0.00 -2.27 0.00 0.00 64.05 61.34 1b80 n THR 247 Cb 0.79 0.94 0.10 0.00 -2.10 0.00 0.00 70.33 70.05 1b80 n THR 247 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b80 h ALA 248 N 0.00 0.91 -0.12 6.98 0.00 -0.66 -1.03 119.26 125.34 1b80 h ALA 248 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1b80 h ALA 248 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1b80 h ALA 248 CO 0.00 0.08 -0.38 0.00 0.00 0.00 0.00 179.25 178.96 1b80 h GLU 250 N 0.21 0.66 -0.31 0.00 4.57 -1.73 -1.72 114.58 116.26 1b80 h GLU 250 Ca 0.02 -0.38 -0.02 0.00 -1.18 0.00 0.00 59.36 57.81 1b80 h GLU 250 Cb 0.77 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.37 1b80 h GLU 250 CO 0.06 0.99 0.13 2.35 -1.18 0.00 0.00 179.01 181.36 1b80 h TRP 251 N 0.52 0.46 0.00 0.92 2.91 -1.07 -2.39 115.95 117.31 1b80 h TRP 251 Ca 0.03 -0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.00 1b80 h TRP 251 Cb 1.02 -0.14 -0.00 0.00 -0.51 0.00 0.00 29.16 29.52 1b80 h TRP 251 CO 0.05 0.44 -0.09 0.37 -1.03 0.00 0.00 178.44 178.18 1b80 h GLN 252 N 0.36 0.00 0.00 2.65 4.15 -1.25 -3.14 115.11 117.88 1b80 h GLN 252 Ca 0.10 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.52 1b80 h GLN 252 Cb 0.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.85 1b80 h GLN 252 CO -0.01 0.09 0.00 0.66 -1.93 0.00 0.00 178.83 177.64 1b80 h SER 253 N 0.00 0.00 1.05 -0.69 4.64 -0.76 -1.12 113.55 116.67 1b80 h SER 253 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b80 h SER 253 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1b80 h SER 253 CO 0.01 0.00 -0.26 0.49 -0.87 0.00 0.00 176.83 176.20 1b80 n PHE 254 N -2.79 0.50 -2.03 4.77 3.72 -1.19 -4.55 117.46 115.89 1b80 n PHE 254 Ca -0.01 0.14 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 1b80 n PHE 254 Cb 0.18 -0.67 -0.03 0.00 -0.94 0.00 0.00 39.48 38.02 1b80 n PHE 254 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1b80 s VAL 255 N -3.09 3.44 -1.39 -4.37 1.01 -0.43 -2.19 120.40 113.39 1b80 s VAL 255 Ca 0.10 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.81 1b80 s VAL 255 Cb 0.15 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 33.06 1b80 s VAL 255 CO 0.64 -0.03 0.00 -3.20 0.00 0.00 0.00 175.10 172.51 1b80 n ASN 256 N 6.23 -4.74 -3.32 3.32 5.15 -1.26 -4.93 115.26 115.70 1b80 n ASN 256 Ca 0.16 0.04 -0.25 0.00 -0.60 0.00 0.00 54.58 53.92 1b80 n ASN 256 Cb 0.42 -3.84 -0.09 0.00 -0.53 0.00 0.00 39.78 35.75 1b80 n ASN 256 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1b80 n ASN 257 N -0.95 -0.51 -0.24 1.20 2.85 -0.93 -4.97 115.26 111.72 1b80 n ASN 257 Ca -0.18 -2.46 -0.05 0.00 -0.11 0.00 0.00 54.58 51.77 1b80 n ASN 257 Cb 0.63 -0.46 0.05 0.00 1.24 0.00 0.00 39.78 41.24 1b80 n ASN 257 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1b80 h GLN 258 N 5.28 0.87 -0.19 1.20 4.15 -1.92 -2.24 115.11 122.26 1b80 h GLN 258 Ca 0.22 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.52 1b80 h GLN 258 Cb 0.91 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 1b80 h GLN 258 CO 0.37 0.57 -0.19 0.66 -1.93 0.00 0.00 178.83 178.32 1b80 h SER 259 N 0.89 0.32 -0.24 -0.69 4.64 -1.97 -1.29 113.55 115.22 1b80 h SER 259 Ca 0.25 -0.08 -0.16 0.00 -0.47 0.00 0.00 61.79 61.32 1b80 h SER 259 Cb -0.09 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 1b80 h SER 259 CO -0.06 0.53 -0.48 0.50 -0.87 0.00 0.00 176.83 176.45 1b80 h LYS 260 N 0.30 0.74 -0.14 4.77 3.64 -1.90 -1.70 116.57 122.28 1b80 h LYS 260 Ca 0.05 -0.49 0.05 0.00 -1.27 0.00 0.00 60.65 58.99 1b80 h LYS 260 Cb 0.51 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.34 1b80 h LYS 260 CO 0.03 1.11 -0.19 1.25 -2.27 0.00 0.00 179.45 179.38 1b80 h LEU 261 N 0.47 -0.59 -0.23 5.20 5.85 -1.04 -1.11 115.31 123.86 1b80 h LEU 261 Ca 0.01 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 1b80 h LEU 261 Cb 1.09 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 1b80 h LEU 261 CO 0.11 -0.24 0.03 0.58 -0.34 0.00 0.00 178.44 178.58 1b80 h VAL 262 N -0.24 1.23 -0.61 1.05 2.07 -1.19 -1.84 116.25 116.72 1b80 h VAL 262 Ca 0.10 -0.78 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 1b80 h VAL 262 Cb 0.39 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1b80 h VAL 262 CO -0.28 0.25 0.07 0.44 0.02 0.00 0.00 177.57 178.07 1b80 h ASP 263 N 0.18 0.99 -0.33 0.57 3.32 -1.29 -0.84 116.42 119.02 1b80 h ASP 263 Ca 0.07 -0.27 -0.14 0.00 0.02 0.00 0.00 57.03 56.70 1b80 h ASP 263 Cb 0.34 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 1b80 h ASP 263 CO 0.01 1.02 -0.36 0.44 -1.72 0.00 0.00 179.24 178.63 1b80 h ASP 264 N 0.93 0.89 -0.12 6.45 3.32 -1.21 -2.73 116.42 123.96 1b80 h ASP 264 Ca 0.18 -0.48 -0.15 0.00 0.02 0.00 0.00 57.03 56.60 1b80 h ASP 264 Cb 0.47 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1b80 h ASP 264 CO 0.02 1.19 -0.46 0.15 -1.72 0.00 0.00 179.24 178.41 1b80 h PHE 265 N 0.62 0.82 -0.47 4.55 3.57 -1.17 -1.62 116.94 123.24 1b80 h PHE 265 Ca 0.05 -0.26 0.06 0.00 3.53 0.00 0.00 57.97 61.35 1b80 h PHE 265 Cb 0.94 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.47 1b80 h PHE 265 CO 0.07 1.01 0.18 0.37 -2.23 0.00 0.00 178.31 177.71 1b80 h GLN 266 N 0.54 0.35 0.23 1.11 4.15 -1.10 0.62 115.11 121.01 1b80 h GLN 266 Ca 0.03 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 1b80 h GLN 266 Cb 1.01 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.62 1b80 h GLN 266 CO 0.09 0.23 -0.11 0.35 -1.93 0.00 0.00 178.83 177.46 1b80 h PHE 267 N 0.36 -0.29 0.00 3.99 3.04 -1.27 -2.59 116.94 120.17 1b80 h PHE 267 Ca 0.22 -0.01 -0.15 0.00 3.98 0.00 0.00 57.97 62.02 1b80 h PHE 267 Cb 0.21 0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.80 1b80 h PHE 267 CO -0.15 -0.17 -0.70 0.97 -2.02 0.00 0.00 178.31 176.23 1b80 h ILE 268 N -0.32 1.44 -0.24 1.41 6.09 -1.02 -2.29 117.51 122.58 1b80 h ILE 268 Ca -0.03 -2.47 -0.05 0.00 -1.37 0.00 0.00 64.86 60.95 1b80 h ILE 268 Cb 0.25 2.35 -0.01 0.00 0.47 0.00 0.00 36.82 39.88 1b80 h ILE 268 CO 0.05 0.69 -0.03 0.15 -3.07 0.00 0.00 178.15 175.94 1b80 h PHE 269 N 0.00 0.50 -0.24 2.19 3.57 -0.89 -1.01 116.94 121.07 1b80 h PHE 269 Ca -0.01 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.43 1b80 h PHE 269 Cb 1.30 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.88 1b80 h PHE 269 CO 0.00 0.65 0.03 1.25 -2.23 0.00 0.00 178.31 178.02 1b80 h LEU 270 N 0.20 -0.01 -0.67 0.59 5.85 -1.26 -2.06 115.31 117.94 1b80 h LEU 270 Ca 0.06 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.92 1b80 h LEU 270 Cb 0.48 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 1b80 h LEU 270 CO 0.02 0.02 0.30 0.00 -0.34 0.00 0.00 178.44 178.45 1b80 h ALA 271 N 1.18 0.91 -0.48 1.25 0.00 -1.22 -2.00 119.26 118.90 1b80 h ALA 271 Ca 0.11 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1b80 h ALA 271 Cb 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1b80 h ALA 271 CO -0.15 -0.12 0.27 -0.07 0.00 0.00 0.00 179.25 179.18 1b80 h LEU 272 N 0.52 0.43 -0.62 0.00 3.38 -0.54 -2.00 115.31 116.47 1b80 h LEU 272 Ca 0.34 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1b80 h LEU 272 Cb 0.39 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1b80 h LEU 272 CO -0.29 0.30 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1b80 n THR 273 N -4.84 1.03 0.50 0.22 -2.24 -0.79 -2.06 114.28 106.10 1b80 n THR 273 Ca 0.03 0.36 0.10 0.00 -2.27 0.00 0.00 64.05 62.28 1b80 n THR 273 Cb 0.09 -1.28 0.15 0.00 -2.10 0.00 0.00 70.33 67.19 1b80 n THR 273 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b80 n GLN 274 N -2.01 2.16 -1.75 -0.78 6.02 -0.76 -4.79 117.38 115.47 1b80 n GLN 274 Ca 0.01 -1.98 -0.42 0.00 -0.01 0.00 0.00 57.00 54.60 1b80 n GLN 274 Cb 0.15 -1.43 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 1b80 n GLN 274 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1b80 s LEU 275 N -1.51 4.35 0.00 1.08 1.43 -0.88 -1.71 118.68 121.44 1b80 s LEU 275 Ca 0.30 2.95 0.00 0.00 -1.03 0.00 0.00 54.13 56.35 1b80 s LEU 275 Cb 0.19 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1b80 s LEU 275 CO 0.27 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.52 1b80 n GLY 276 N 2.57 0.83 3.55 -3.19 0.00 -1.26 -0.63 105.19 107.06 1b80 n GLY 276 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1b80 n GLY 276 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b80 s GLN 277 N -0.10 1.83 -0.36 1.61 -1.52 -0.70 -4.92 119.66 115.50 1b80 s GLN 277 Ca 0.00 -1.98 -0.11 0.00 -1.95 0.00 0.00 55.36 51.32 1b80 s GLN 277 Cb 0.00 -1.56 0.02 0.00 -0.22 0.00 0.00 33.01 31.25 1b80 s GLN 277 CO 0.00 0.04 0.20 0.34 -0.25 0.00 0.00 175.29 175.62 1b80 s ASP 278 N -3.62 5.72 0.31 5.90 2.15 -1.26 -4.97 116.67 120.90 1b80 s ASP 278 Ca 0.33 -0.88 0.04 0.00 0.43 0.00 0.00 52.55 52.47 1b80 s ASP 278 Cb 0.06 -2.03 0.65 0.00 -0.30 0.00 0.00 42.92 41.30 1b80 s ASP 278 CO 0.16 -0.35 1.86 -0.65 -0.17 0.00 0.00 175.17 176.03 1b80 h PRO 279 N 8.43 0.86 0.00 4.34 0.11 -1.96 -0.47 132.00 143.30 1b80 h PRO 279 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1b80 h PRO 279 Cb 1.11 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1b80 h PRO 279 CO 0.66 0.57 0.00 0.09 -0.21 0.00 0.00 178.00 179.11 1b80 n ASN 280 N -4.58 0.11 -1.10 -2.05 3.02 -1.26 -1.82 115.26 107.58 1b80 n ASN 280 Ca 0.17 0.53 0.11 0.00 -0.03 0.00 0.00 54.58 55.36 1b80 n ASN 280 Cb 0.37 -0.55 0.22 0.00 -0.61 0.00 0.00 39.78 39.21 1b80 n ASN 280 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b80 n ALA 281 N -1.54 2.39 -2.94 5.41 0.00 -0.19 -4.64 120.51 119.00 1b80 n ALA 281 Ca 0.04 -1.04 -0.23 0.00 0.00 0.00 0.00 53.44 52.21 1b80 n ALA 281 Cb 0.20 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1b80 n ALA 281 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1b80 s MET 282 N -1.33 3.36 -0.17 0.00 -1.94 -0.76 -4.91 119.30 113.55 1b80 s MET 282 Ca 0.37 -0.76 -0.07 0.00 -1.71 0.00 0.00 55.69 53.52 1b80 s MET 282 Cb 0.21 -2.86 -0.04 0.00 2.01 0.00 0.00 34.83 34.15 1b80 s MET 282 CO 0.30 0.45 0.08 0.99 -0.01 0.00 0.00 175.02 176.82 1b80 s THR 283 N -1.93 4.95 -0.53 2.05 2.01 -0.64 -4.91 115.64 116.63 1b80 s THR 283 Ca 0.34 0.02 -0.26 0.00 0.31 0.00 0.00 61.69 62.10 1b80 s THR 283 Cb -0.09 -3.21 0.03 0.00 0.01 0.00 0.00 72.50 69.24 1b80 s THR 283 CO 0.28 0.49 1.01 -0.62 -0.69 0.00 0.00 174.62 175.09 1b80 s ASP 284 N 0.07 6.42 -0.29 3.53 -1.08 -1.26 -0.29 116.67 123.76 1b80 s ASP 284 Ca 0.06 -0.09 0.09 0.00 -0.52 0.00 0.00 52.55 52.09 1b80 s ASP 284 Cb -0.12 -2.47 0.51 0.00 -1.46 0.00 0.00 42.92 39.38 1b80 s ASP 284 CO 0.00 -1.25 1.48 0.00 0.52 0.00 0.00 175.17 175.92 1b80 h SER 286 N 1.03 0.00 0.24 0.00 0.02 -1.68 -2.48 113.55 110.68 1b80 h SER 286 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1b80 h SER 286 Cb 1.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.23 1b80 h SER 286 CO 0.41 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.57 1b80 n ASP 287 N -4.01 0.17 0.05 3.07 8.00 -1.26 -1.45 116.55 121.13 1b80 n ASP 287 Ca -0.01 0.56 -0.05 0.00 0.71 0.00 0.00 54.79 55.99 1b80 n ASP 287 Cb 0.16 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 40.57 1b80 n ASP 287 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1b80 h VAL 288 N 0.00 1.27 -3.25 2.53 2.07 -1.81 -3.45 116.25 113.60 1b80 h VAL 288 Ca 0.00 -2.94 -0.53 0.00 0.82 0.00 0.00 66.70 64.06 1b80 h VAL 288 Cb 0.12 2.61 0.03 0.00 -1.52 0.00 0.00 31.29 32.52 1b80 h VAL 288 CO 0.00 0.72 0.67 -0.63 0.02 0.00 0.00 177.57 178.35 1b80 s ILE 289 N -2.74 3.31 0.84 4.57 -1.09 -0.53 -4.97 121.20 120.58 1b80 s ILE 289 Ca -0.00 1.02 -0.12 0.00 -2.23 0.00 0.00 60.65 59.31 1b80 s ILE 289 Cb 0.09 -3.65 0.10 0.00 -1.58 0.00 0.00 42.46 37.42 1b80 s ILE 289 CO 0.81 0.12 1.19 -2.84 -1.23 0.00 0.00 174.94 172.99 1b80 s PRO 290 N 0.36 1.47 0.15 2.79 0.02 -1.26 -4.95 135.00 133.58 1b80 s PRO 290 Ca 0.59 1.70 -0.30 0.00 0.02 0.00 0.00 61.00 63.01 1b80 s PRO 290 Cb -0.36 -1.76 -0.07 0.00 0.02 0.00 0.00 34.50 32.33 1b80 s PRO 290 CO 0.35 -2.33 1.15 -0.65 -0.33 0.00 0.00 177.00 175.19 1b80 s GLN 291 N -4.28 4.53 0.56 5.54 1.11 -1.26 -4.74 119.66 121.11 1b80 s GLN 291 Ca 0.71 1.78 -0.18 0.00 0.01 0.00 0.00 55.36 57.68 1b80 s GLN 291 Cb -0.27 -3.28 -0.05 0.00 -1.01 0.00 0.00 33.01 28.40 1b80 s GLN 291 CO 0.53 -0.05 1.07 -1.12 0.01 0.00 0.00 175.29 175.73 1b80 s SER 292 N 0.23 5.85 0.14 5.90 0.01 -1.26 -4.98 113.70 119.57 1b80 s SER 292 Ca 0.52 1.94 -0.01 0.00 1.31 0.00 0.00 55.95 59.72 1b80 s SER 292 Cb -0.30 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.33 1b80 s SER 292 CO 0.34 -1.12 0.31 -1.59 0.41 0.00 0.00 173.24 171.59 1b80 s LYS 293 N -3.67 3.50 0.79 12.44 -2.85 -1.26 -4.98 119.74 123.71 1b80 s LYS 293 Ca 0.67 -0.37 -0.12 0.00 -1.00 0.00 0.00 55.97 55.15 1b80 s LYS 293 Cb -0.18 -2.93 0.07 0.00 -2.06 0.00 0.00 37.83 32.73 1b80 s LYS 293 CO 0.31 0.50 1.11 -1.25 0.10 0.00 0.00 175.35 176.12 1b80 s PRO 294 N -2.92 2.12 -0.09 1.78 0.04 -1.26 -0.46 135.00 134.21 1b80 s PRO 294 Ca 0.37 0.47 -0.30 0.00 0.04 0.00 0.00 61.00 61.58 1b80 s PRO 294 Cb -0.12 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 1b80 s PRO 294 CO 0.28 -1.55 1.19 0.42 0.04 0.00 0.00 177.00 177.38 1b80 s ILE 295 N -3.28 4.31 0.84 0.56 1.01 -1.26 -4.34 121.20 119.04 1b80 s ILE 295 Ca 0.61 1.62 -0.11 0.00 0.00 0.00 0.00 60.65 62.77 1b80 s ILE 295 Cb -0.13 -4.05 0.10 0.00 0.01 0.00 0.00 42.46 38.39 1b80 s ILE 295 CO 0.53 -0.03 1.09 -2.16 0.00 0.00 0.00 174.94 174.37 1b80 s PRO 296 N 2.49 1.72 0.52 2.79 0.04 -1.26 -4.93 135.00 136.38 1b80 s PRO 296 Ca 0.55 0.76 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1b80 s PRO 296 Cb -0.23 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1b80 s PRO 296 CO 0.20 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 175.74 1b80 n GLY 297 N -1.59 -2.11 0.91 0.56 0.00 -1.26 -4.75 105.19 96.95 1b80 n GLY 297 Ca 0.07 -1.69 0.05 0.00 0.00 0.00 0.00 46.02 44.45 1b80 n GLY 297 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1b80 n ASN 298 N 0.43 1.18 -4.83 1.61 6.94 -1.26 -5.07 115.26 114.27 1b80 n ASN 298 Ca 0.00 -2.67 -0.31 0.00 -0.02 0.00 0.00 54.58 51.58 1b80 n ASN 298 Cb 0.00 -0.36 0.04 0.00 -2.36 0.00 0.00 39.78 37.10 1b80 n ASN 298 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1b80 s LEU 299 N -1.25 3.13 0.83 -4.53 1.43 -1.26 -5.03 118.68 112.00 1b80 s LEU 299 Ca 0.29 1.56 -0.12 0.00 -1.03 0.00 0.00 54.13 54.82 1b80 s LEU 299 Cb 0.30 -4.46 0.09 0.00 0.03 0.00 0.00 46.19 42.15 1b80 s LEU 299 CO -0.09 -1.34 1.18 -2.84 0.23 0.00 0.00 176.35 173.50 1b80 s PRO 300 N -5.08 1.55 0.09 1.29 0.02 -1.26 -4.95 135.00 126.67 1b80 s PRO 300 Ca 0.57 1.67 -0.19 0.00 0.02 0.00 0.00 61.00 63.07 1b80 s PRO 300 Cb -0.13 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.53 1b80 s PRO 300 CO 0.55 -2.26 1.60 0.35 -0.33 0.00 0.00 177.00 176.90 1b80 h PHE 301 N -1.11 0.37 -3.97 6.54 3.57 -1.99 -3.42 116.94 116.93 1b80 h PHE 301 Ca -0.45 -0.04 -0.69 0.00 3.53 0.00 0.00 57.97 60.32 1b80 h PHE 301 Cb 1.28 -0.11 -0.23 0.00 2.79 0.00 0.00 35.95 39.69 1b80 h PHE 301 CO 0.48 0.44 -0.87 -1.12 -2.23 0.00 0.00 178.31 175.01 1b80 s SER 302 N -5.72 3.27 0.19 0.41 0.01 -1.26 -4.70 113.70 105.91 1b80 s SER 302 Ca -0.14 -0.73 -0.21 0.00 1.31 0.00 0.00 55.95 56.19 1b80 s SER 302 Cb 0.07 -0.23 0.05 0.00 0.21 0.00 0.00 66.02 66.13 1b80 s SER 302 CO 0.72 0.19 0.60 0.72 0.41 0.00 0.00 173.24 175.88 1b80 s PHE 303 N -1.03 -0.37 0.08 2.43 -0.12 -1.26 -4.65 117.98 113.07 1b80 s PHE 303 Ca 0.13 0.07 -0.22 0.00 -0.05 0.00 0.00 56.93 56.86 1b80 s PHE 303 Cb -0.10 0.55 -0.07 0.00 -0.63 0.00 0.00 43.02 42.77 1b80 s PHE 303 CO 0.05 -0.94 0.68 -0.06 -0.05 0.00 0.00 175.22 174.90 1b80 s PHE 304 N -3.81 3.80 0.82 3.49 0.08 0.31 -4.97 117.98 117.69 1b80 s PHE 304 Ca 0.05 1.41 -0.14 0.00 0.12 0.00 0.00 56.93 58.37 1b80 s PHE 304 Cb -0.02 -2.66 0.04 0.00 -0.57 0.00 0.00 43.02 39.81 1b80 s PHE 304 CO -0.07 0.46 0.87 -2.30 -0.10 0.00 0.00 175.22 174.09 1b80 n PRO 305 N 2.07 0.10 -1.72 0.24 -0.02 -1.26 -1.92 135.00 132.49 1b80 n PRO 305 Ca -0.07 0.10 -0.41 0.00 -2.02 0.00 0.00 63.50 61.10 1b80 n PRO 305 Cb 0.50 -2.17 0.01 0.00 -0.02 0.00 0.00 33.50 31.83 1b80 n PRO 305 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b80 n ALA 306 N -3.15 1.51 -0.50 3.55 0.00 -1.26 -2.21 120.51 118.46 1b80 n ALA 306 Ca 0.11 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.82 1b80 n ALA 306 Cb 0.51 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1b80 n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b80 n GLY 307 N 0.74 0.89 3.32 0.00 0.00 -1.26 -4.25 105.19 104.64 1b80 n GLY 307 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1b80 n GLY 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b80 s LYS 308 N -0.43 1.58 0.35 1.61 -0.14 -0.94 -4.98 119.74 116.79 1b80 s LYS 308 Ca 0.00 -1.10 0.07 0.00 -1.36 0.00 0.00 55.97 53.58 1b80 s LYS 308 Cb 0.00 -1.79 -0.03 0.00 -1.68 0.00 0.00 37.83 34.34 1b80 s LYS 308 CO 0.00 0.45 0.25 0.25 -0.76 0.00 0.00 175.35 175.54 1b80 n THR 309 N 1.63 0.00 0.08 2.17 -2.24 -1.26 -4.71 114.28 109.94 1b80 n THR 309 Ca -0.17 -2.39 0.19 0.00 -2.27 0.00 0.00 64.05 59.40 1b80 n THR 309 Cb 0.53 1.12 0.74 0.00 -2.10 0.00 0.00 70.33 70.61 1b80 n THR 309 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1b80 h ILE 310 N 1.97 0.58 0.00 2.28 6.09 -1.95 -0.17 117.51 126.31 1b80 h ILE 310 Ca -0.25 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.23 1b80 h ILE 310 Cb 1.19 0.74 -0.00 0.00 0.47 0.00 0.00 36.82 39.22 1b80 h ILE 310 CO 0.37 0.00 -0.05 0.11 -3.07 0.00 0.00 178.15 175.52 1b80 h LYS 311 N 0.00 0.00 -0.01 2.19 1.57 -2.03 -2.15 116.57 116.14 1b80 h LYS 311 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1b80 h LYS 311 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1b80 h LYS 311 CO -0.00 0.05 -0.07 -0.25 -0.57 0.00 0.00 179.45 178.61 1b80 n ASP 312 N -3.59 1.25 -4.75 0.86 8.00 -0.08 -4.88 116.55 113.36 1b80 n ASP 312 Ca -0.02 -1.28 -0.40 0.00 0.71 0.00 0.00 54.79 53.80 1b80 n ASP 312 Cb 0.15 0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.23 1b80 n ASP 312 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b80 s VAL 313 N -2.15 4.68 -0.69 2.53 1.01 -0.81 -0.60 120.40 124.38 1b80 s VAL 313 Ca 0.35 1.63 -0.19 0.00 0.00 0.00 0.00 61.98 63.77 1b80 s VAL 313 Cb 0.21 -4.11 0.11 0.00 0.00 0.00 0.00 36.38 32.59 1b80 s VAL 313 CO 0.39 0.39 0.84 -1.61 0.00 0.00 0.00 175.10 175.10 1b80 s GLU 314 N -0.21 3.21 0.00 2.72 2.02 0.30 -4.88 118.70 121.87 1b80 s GLU 314 Ca 0.38 -1.43 -0.30 0.00 0.02 0.00 0.00 54.97 53.64 1b80 s GLU 314 Cb -0.21 -4.40 -0.07 0.00 0.10 0.00 0.00 34.13 29.55 1b80 s GLU 314 CO 0.23 -1.61 1.69 -1.14 0.02 0.00 0.00 175.26 174.45 1b80 s GLN 315 N 2.68 4.18 0.00 1.61 2.00 -1.26 -4.85 119.66 124.02 1b80 s GLN 315 Ca 0.18 2.29 0.00 0.00 -2.00 0.00 0.00 55.36 55.83 1b80 s GLN 315 Cb -0.18 -3.86 0.00 0.00 0.80 0.00 0.00 33.01 29.77 1b80 s GLN 315 CO 0.02 -0.81 0.00 0.00 -0.50 0.00 0.00 175.29 174.00 1b80 n ALA 316 N 6.59 1.81 -2.58 1.58 0.00 -1.26 -4.97 120.51 121.67 1b80 n ALA 316 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.19 1b80 n ALA 316 Cb 0.42 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.81 1b80 n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b80 h ALA 318 N 8.52 1.00 0.00 0.00 0.00 -1.96 -3.30 119.26 123.52 1b80 h ALA 318 Ca -0.25 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 1b80 h ALA 318 Cb 1.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1b80 h ALA 318 CO 0.90 0.00 -1.33 0.93 0.00 0.00 0.00 179.25 179.75 1b80 h GLU 319 N 0.00 0.00 -3.16 0.00 5.08 -2.01 -3.47 114.58 111.01 1b80 h GLU 319 Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 1b80 h GLU 319 Cb 0.65 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 29.60 1b80 h GLU 319 CO 0.00 0.42 -0.54 0.99 -1.00 0.00 0.00 179.01 178.87 1b80 s THR 320 N -2.84 -0.04 0.43 1.13 2.01 -1.24 -5.15 115.64 109.94 1b80 s THR 320 Ca -0.02 0.15 -0.25 0.00 0.31 0.00 0.00 61.69 61.89 1b80 s THR 320 Cb 0.08 -0.30 -0.08 0.00 0.01 0.00 0.00 72.50 72.21 1b80 s THR 320 CO 0.81 0.06 1.21 -2.16 -0.69 0.00 0.00 174.62 173.85 1b80 s PRO 321 N 1.13 3.90 0.31 4.92 0.04 -1.26 -4.73 135.00 139.32 1b80 s PRO 321 Ca -0.09 1.91 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 1b80 s PRO 321 Cb -0.10 -2.60 -0.12 0.00 0.04 0.00 0.00 34.50 31.72 1b80 s PRO 321 CO -0.07 -0.47 1.51 0.34 0.04 0.00 0.00 177.00 178.35 1b80 n PHE 322 N -0.13 2.70 -1.77 0.56 -0.00 -1.26 -4.92 117.46 112.65 1b80 n PHE 322 Ca 0.05 0.36 -0.39 0.00 -0.00 0.00 0.00 57.45 57.47 1b80 n PHE 322 Cb 0.46 -2.54 0.03 0.00 -0.00 0.00 0.00 39.48 37.44 1b80 n PHE 322 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 1b80 s PRO 323 N -0.99 3.34 -0.85 -7.13 0.02 -1.26 -4.93 135.00 123.20 1b80 s PRO 323 Ca 0.61 2.33 -0.24 0.00 0.02 0.00 0.00 61.00 63.72 1b80 s PRO 323 Cb -0.53 -2.41 0.05 0.00 0.02 0.00 0.00 34.50 31.63 1b80 s PRO 323 CO 0.54 -1.06 1.29 0.99 -0.33 0.00 0.00 177.00 178.42 1b80 s THR 324 N -1.25 3.96 0.45 0.99 2.01 -1.26 -5.00 115.64 115.53 1b80 s THR 324 Ca 0.68 -0.30 -0.00 0.00 0.31 0.00 0.00 61.69 62.37 1b80 s THR 324 Cb -0.42 -4.93 -0.01 0.00 0.01 0.00 0.00 72.50 67.15 1b80 s THR 324 CO 0.52 -1.81 0.68 -0.76 -0.69 0.00 0.00 174.62 172.56 1b80 s LEU 325 N 4.96 3.66 0.67 4.42 1.43 -1.26 -5.08 118.68 127.48 1b80 s LEU 325 Ca 0.37 0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 53.71 1b80 s LEU 325 Cb -0.06 -3.23 -0.01 0.00 0.03 0.00 0.00 46.19 42.93 1b80 s LEU 325 CO 0.03 -0.68 1.05 0.42 0.23 0.00 0.00 176.35 177.41 1b80 s THR 326 N -2.56 4.16 -0.13 5.49 -4.23 -1.26 -4.75 115.64 112.36 1b80 s THR 326 Ca 0.48 0.73 -0.03 0.00 -1.18 0.00 0.00 61.69 61.69 1b80 s THR 326 Cb -0.10 -3.50 -0.03 0.00 1.34 0.00 0.00 72.50 70.21 1b80 s THR 326 CO 0.38 -0.89 -0.03 -0.89 -0.54 0.00 0.00 174.62 172.65 1b80 s THR 327 N -3.03 3.94 0.53 3.99 2.01 -1.26 -0.53 115.64 121.29 1b80 s THR 327 Ca 0.58 -0.35 -0.21 0.00 0.31 0.00 0.00 61.69 62.01 1b80 s THR 327 Cb -0.13 -2.70 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 1b80 s THR 327 CO 0.53 0.52 1.24 -0.76 -0.69 0.00 0.00 174.62 175.47 1b80 s LEU 328 N 0.00 3.85 0.81 4.42 1.43 -0.81 -4.96 118.68 123.43 1b80 s LEU 328 Ca 0.01 2.47 -0.12 0.00 -1.03 0.00 0.00 54.13 55.47 1b80 s LEU 328 Cb -0.13 -4.36 0.08 0.00 0.03 0.00 0.00 46.19 41.80 1b80 s LEU 328 CO 0.03 -1.33 1.10 -2.16 0.23 0.00 0.00 176.35 174.21 1b80 s PRO 329 N -2.96 1.95 0.66 1.29 0.04 -1.26 -4.08 135.00 130.64 1b80 s PRO 329 Ca 0.70 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1b80 s PRO 329 Cb -0.33 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1b80 s PRO 329 CO 0.38 -1.71 0.00 0.41 0.04 0.00 0.00 177.00 176.12 1b80 n GLY 330 N -2.06 -2.09 3.77 0.56 0.00 -1.26 -4.79 105.19 99.32 1b80 n GLY 330 Ca 0.07 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 1b80 n GLY 330 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b80 s PRO 331 N -0.12 2.90 0.24 1.61 0.04 -1.26 -4.11 135.00 134.31 1b80 s PRO 331 Ca 0.00 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.11 1b80 s PRO 331 Cb 0.00 -1.96 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 1b80 s PRO 331 CO 0.00 -1.17 1.59 -1.91 0.04 0.00 0.00 177.00 175.55 1b80 n GLU 332 N -2.29 2.50 -4.37 4.56 2.13 -1.26 -4.72 120.64 117.19 1b80 n GLU 332 Ca 0.10 0.90 -0.27 0.00 0.66 0.00 0.00 57.16 58.55 1b80 n GLU 332 Cb 0.52 -2.67 -0.13 0.00 0.27 0.00 0.00 31.44 29.43 1b80 n GLU 332 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 1b80 s THR 333 N 0.43 1.98 0.36 6.31 -1.32 -1.26 -5.05 115.64 117.09 1b80 s THR 333 Ca 0.70 -1.62 -0.24 0.00 -1.21 0.00 0.00 61.69 59.32 1b80 s THR 333 Cb -0.56 -1.77 -0.10 0.00 -1.51 0.00 0.00 72.50 68.56 1b80 s THR 333 CO 0.43 0.04 0.93 -0.94 -2.21 0.00 0.00 174.62 172.87 1b80 s SER 334 N -1.92 7.15 -0.03 8.08 1.04 -1.26 -4.68 113.70 122.08 1b80 s SER 334 Ca 0.10 1.75 -0.30 0.00 0.48 0.00 0.00 55.95 57.98 1b80 s SER 334 Cb -0.10 -2.55 -0.03 0.00 0.10 0.00 0.00 66.02 63.44 1b80 s SER 334 CO 0.05 -0.19 1.09 -0.69 0.98 0.00 0.00 173.24 174.48 1b80 s VAL 335 N -1.85 4.51 0.36 5.02 1.01 0.16 -4.96 120.40 124.64 1b80 s VAL 335 Ca 0.55 1.80 -0.25 0.00 0.00 0.00 0.00 61.98 64.08 1b80 s VAL 335 Cb -0.14 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 31.99 1b80 s VAL 335 CO 0.19 0.07 1.02 -1.10 0.00 0.00 0.00 175.10 175.29 1b80 s GLN 336 N 1.56 4.36 0.66 2.72 -1.52 -1.26 -4.47 119.66 121.72 1b80 s GLN 336 Ca 0.54 1.49 -0.11 0.00 -1.95 0.00 0.00 55.36 55.33 1b80 s GLN 336 Cb -0.23 -2.71 -0.01 0.00 -0.22 0.00 0.00 33.01 29.83 1b80 s GLN 336 CO 0.24 0.04 1.05 -0.98 -0.25 0.00 0.00 175.29 175.39 1b80 s ARG 337 N -2.21 3.25 -0.43 2.91 1.70 -1.26 -4.71 118.95 118.19 1b80 s ARG 337 Ca 0.54 0.83 0.00 0.00 -0.47 0.00 0.00 55.73 56.63 1b80 s ARG 337 Cb -0.22 -2.03 0.12 0.00 -0.57 0.00 0.00 34.95 32.24 1b80 s ARG 337 CO 0.28 -0.84 0.20 0.42 -1.08 0.00 0.00 175.30 174.27 1b80 s ILE 338 N -3.13 2.91 0.19 4.99 1.01 0.49 -5.02 121.20 122.64 1b80 s ILE 338 Ca 0.57 -2.47 -0.31 0.00 0.00 0.00 0.00 60.65 58.43 1b80 s ILE 338 Cb -0.12 -3.03 -0.11 0.00 0.01 0.00 0.00 42.46 39.21 1b80 s ILE 338 CO 0.54 -0.70 1.60 -2.84 0.00 0.00 0.00 174.94 173.54 1b80 s PRO 339 N 0.67 4.19 0.63 2.79 0.02 -1.26 -4.02 135.00 138.02 1b80 s PRO 339 Ca 0.12 2.43 -0.06 0.00 0.02 0.00 0.00 61.00 63.51 1b80 s PRO 339 Cb -0.22 -3.13 0.03 0.00 0.02 0.00 0.00 34.50 31.21 1b80 s PRO 339 CO -0.05 -0.63 0.93 -1.25 -0.33 0.00 0.00 177.00 175.67 1b80 s PRO 340 N 0.96 2.64 0.79 5.54 0.04 -1.26 -4.82 135.00 138.88 1b80 s PRO 340 Ca 0.70 -0.16 -0.11 0.00 0.04 0.00 0.00 61.00 61.48 1b80 s PRO 340 Cb -0.45 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 31.90 1b80 s PRO 340 CO 0.33 -0.88 1.09 -2.14 0.04 0.00 0.00 177.00 175.44 1b80 s PRO 341 N -5.06 2.15 0.28 0.56 0.02 -1.26 -4.95 135.00 126.74 1b80 s PRO 341 Ca 0.56 1.16 -0.28 0.00 0.02 0.00 0.00 61.00 62.46 1b80 s PRO 341 Cb -0.11 -1.88 -0.14 0.00 0.02 0.00 0.00 34.50 32.39 1b80 s PRO 341 CO 0.44 -1.72 1.01 -2.30 -0.33 0.00 0.00 177.00 174.10 1b80 n PRO 342 N -3.57 1.29 -0.22 5.54 -0.02 -1.26 -2.84 135.00 133.92 1b80 n PRO 342 Ca 0.09 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1b80 n PRO 342 Cb 0.53 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1b80 n PRO 342 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b80 n GLY 343 N 1.33 0.94 0.00 -1.23 0.00 -1.26 -4.95 105.19 100.03 1b80 n GLY 343 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 1b80 n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32