#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fbe n PRO 2 N 0.00 1.02 -1.84 1.61 -0.04 -1.26 -4.80 135.00 129.68 2fbe n PRO 2 Ca 0.00 -0.05 -0.38 0.00 -0.04 0.00 0.00 63.50 63.03 2fbe n PRO 2 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2fbe n PRO 2 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2fbe s LEU 3 N -2.02 3.36 0.46 1.53 1.98 -1.26 -4.86 118.68 117.88 2fbe s LEU 3 Ca 0.47 0.79 0.22 0.00 -2.89 0.00 0.00 54.13 52.73 2fbe s LEU 3 Cb 0.22 -2.69 1.11 0.00 0.66 0.00 0.00 46.19 45.49 2fbe s LEU 3 CO 0.37 -2.46 1.94 1.23 -1.89 0.00 0.00 176.35 175.54 2fbe h GLY 4 N 17.18 0.00 -7.59 7.98 0.00 -2.07 -3.38 103.07 115.19 2fbe h GLY 4 Ca -0.27 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.35 2fbe h GLY 4 CO 1.16 0.00 -0.28 -0.56 0.00 0.00 0.00 176.54 176.86 2fbe s SER 5 N -6.40 5.49 0.53 0.19 0.01 -1.26 -4.98 113.70 107.29 2fbe s SER 5 Ca -0.02 -2.85 0.33 0.00 1.31 0.00 0.00 55.95 54.72 2fbe s SER 5 Cb 0.13 -1.91 1.50 0.00 0.21 0.00 0.00 66.02 65.94 2fbe s SER 5 CO 0.64 -0.40 1.85 1.55 0.41 0.00 0.00 173.24 177.30 2fbe h PRO 6 N 7.13 0.02 -0.01 12.44 0.13 -2.02 -2.69 132.00 147.00 2fbe h PRO 6 Ca 0.01 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2fbe h PRO 6 Cb 0.96 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.09 2fbe h PRO 6 CO 0.72 0.01 0.40 0.93 -0.23 0.00 0.00 178.00 179.83 2fbe h GLU 7 N 0.02 0.00 -0.01 0.86 3.07 -1.97 0.50 114.58 117.05 2fbe h GLU 7 Ca 0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.34 2fbe h GLU 7 Cb 1.91 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.82 2fbe h GLU 7 CO -0.02 0.00 -0.25 1.19 -1.40 0.00 0.00 179.01 178.53 2fbe n PHE 8 N -2.86 0.00 -2.01 4.33 3.72 -1.01 -4.87 117.46 114.76 2fbe n PHE 8 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.96 2fbe n PHE 8 Cb 0.45 -0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 2fbe n PHE 8 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2fbe s GLN 9 N -2.52 3.76 -0.97 -1.08 -1.52 0.16 -0.92 119.66 116.57 2fbe s GLN 9 Ca 0.24 1.82 -0.13 0.00 -1.95 0.00 0.00 55.36 55.34 2fbe s GLN 9 Cb 0.19 -4.09 0.22 0.00 -0.22 0.00 0.00 33.01 29.12 2fbe s GLN 9 CO 0.52 -1.34 0.99 0.08 -0.25 0.00 0.00 175.29 175.29 2fbe s VAL 10 N 5.45 5.58 0.25 1.09 1.01 0.17 -4.92 120.40 129.03 2fbe s VAL 10 Ca 0.77 -2.70 -0.31 0.00 0.00 0.00 0.00 61.98 59.73 2fbe s VAL 10 Cb -0.28 -4.60 -0.13 0.00 0.00 0.00 0.00 36.38 31.38 2fbe s VAL 10 CO 0.31 -1.20 1.54 -0.67 0.00 0.00 0.00 175.10 175.08 2fbe n ASP 11 N 4.02 3.36 -3.68 3.32 2.03 -1.26 -4.84 116.55 119.49 2fbe n ASP 11 Ca 0.21 1.13 -0.03 0.00 0.52 0.00 0.00 54.79 56.61 2fbe n ASP 11 Cb 0.44 -1.51 -0.01 0.00 -0.72 0.00 0.00 41.12 39.33 2fbe n ASP 11 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2fbe s THR 13 N 0.23 0.00 0.46 5.18 -4.23 -1.26 -5.09 115.64 110.93 2fbe s THR 13 Ca 0.69 -0.65 -0.12 0.00 -1.18 0.00 0.00 61.69 60.42 2fbe s THR 13 Cb -0.58 -2.13 -0.07 0.00 1.34 0.00 0.00 72.50 71.06 2fbe s THR 13 CO 0.46 0.00 0.86 -0.36 -0.54 0.00 0.00 174.62 175.03 2fbe s PHE 14 N -3.10 3.48 -0.46 3.99 0.40 -0.79 -0.72 117.98 120.79 2fbe s PHE 14 Ca 0.14 1.18 -0.13 0.00 -0.60 0.00 0.00 56.93 57.52 2fbe s PHE 14 Cb -0.01 -2.57 0.08 0.00 0.51 0.00 0.00 43.02 41.03 2fbe s PHE 14 CO 0.03 -0.24 0.35 0.34 0.70 0.00 0.00 175.22 176.39 2fbe s ASP 15 N -3.25 5.92 0.54 1.36 2.15 0.03 -4.58 116.67 118.84 2fbe s ASP 15 Ca 0.54 -1.46 0.25 0.00 0.43 0.00 0.00 52.55 52.30 2fbe s ASP 15 Cb -0.10 -2.10 1.42 0.00 -0.30 0.00 0.00 42.92 41.84 2fbe s ASP 15 CO 0.34 -0.62 2.03 0.58 -0.17 0.00 0.00 175.17 177.32 2fbe h VAL 16 N 5.92 0.72 0.00 1.11 2.07 -1.97 -1.55 116.25 122.55 2fbe h VAL 16 Ca -0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2fbe h VAL 16 Cb 1.10 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2fbe h VAL 16 CO 0.84 0.00 0.00 0.44 0.02 0.00 0.00 177.57 178.87 2fbe h ASP 17 N 0.00 0.00 0.12 0.57 3.32 -1.93 -3.01 116.42 115.49 2fbe h ASP 17 Ca 0.19 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.93 2fbe h ASP 17 Cb 0.80 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.29 2fbe h ASP 17 CO -0.00 0.00 -2.18 0.35 -1.72 0.00 0.00 179.24 175.68 2fbe n THR 18 N -2.54 1.30 -1.56 0.35 -2.24 -0.59 -2.86 114.28 106.14 2fbe n THR 18 Ca 0.00 -0.81 -0.40 0.00 -2.27 0.00 0.00 64.05 60.57 2fbe n THR 18 Cb 0.17 -0.54 0.02 0.00 -2.10 0.00 0.00 70.33 67.89 2fbe n THR 18 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fbe n ALA 19 N -2.65 -0.29 -2.06 6.98 0.00 -1.14 -2.41 120.51 118.93 2fbe n ALA 19 Ca -0.26 0.13 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 2fbe n ALA 19 Cb 1.07 -2.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 2fbe n ALA 19 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2fbe s ASN 20 N -0.96 6.34 0.34 0.00 3.84 -1.13 -4.38 114.94 118.99 2fbe s ASN 20 Ca 0.67 1.22 0.09 0.00 0.21 0.00 0.00 52.86 55.05 2fbe s ASN 20 Cb -0.51 -2.37 0.82 0.00 -0.55 0.00 0.00 41.25 38.64 2fbe s ASN 20 CO 0.54 -0.65 1.83 0.78 -2.79 0.00 0.00 177.10 176.81 2fbe h ASN 21 N 0.31 0.68 -0.29 -4.21 -0.26 -1.80 -2.13 115.58 107.89 2fbe h ASN 21 Ca -0.46 0.06 -0.04 0.00 -0.56 0.00 0.00 56.30 55.30 2fbe h ASN 21 Cb 1.19 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 38.37 2fbe h ASN 21 CO 0.62 0.29 0.05 -1.22 -1.06 0.00 0.00 177.43 176.11 2fbe n TYR 22 N -4.63 1.00 -3.93 1.19 4.02 -1.26 -0.45 117.16 113.10 2fbe n TYR 22 Ca 0.20 -0.45 -0.35 0.00 -0.01 0.00 0.00 57.90 57.29 2fbe n TYR 22 Cb 0.55 -0.33 -0.14 0.00 -0.02 0.00 0.00 39.34 39.40 2fbe n TYR 22 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2fbe s LEU 23 N -1.26 3.27 -0.21 7.72 1.43 -0.80 -0.69 118.68 128.13 2fbe s LEU 23 Ca 0.24 -0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 52.34 2fbe s LEU 23 Cb 0.19 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 2fbe s LEU 23 CO 0.07 -0.13 0.47 -0.51 0.23 0.00 0.00 176.35 176.48 2fbe s ILE 24 N 1.35 5.13 0.09 -0.59 2.07 -0.50 -4.84 121.20 123.91 2fbe s ILE 24 Ca 0.01 0.85 0.03 0.00 -1.41 0.00 0.00 60.65 60.12 2fbe s ILE 24 Cb -0.17 -3.80 -0.04 0.00 0.13 0.00 0.00 42.46 38.59 2fbe s ILE 24 CO -0.03 0.19 0.12 -0.63 -1.91 0.00 0.00 174.94 172.67 2fbe s ILE 25 N 1.65 4.73 1.10 2.00 1.09 -1.26 -2.27 121.20 128.24 2fbe s ILE 25 Ca 0.22 -0.72 -0.17 0.00 -1.10 0.00 0.00 60.65 58.88 2fbe s ILE 25 Cb -0.15 -3.30 0.24 0.00 -1.06 0.00 0.00 42.46 38.18 2fbe s ILE 25 CO 0.09 0.10 1.15 -0.94 -0.10 0.00 0.00 174.94 175.24 2fbe s SER 26 N -2.51 1.85 0.21 3.58 1.04 -0.58 -4.94 113.70 112.34 2fbe s SER 26 Ca 0.31 0.68 0.05 0.00 0.48 0.00 0.00 55.95 57.47 2fbe s SER 26 Cb -0.12 -0.98 0.16 0.00 0.10 0.00 0.00 66.02 65.18 2fbe s SER 26 CO 0.24 -3.56 1.49 1.05 0.98 0.00 0.00 173.24 173.44 2fbe h GLU 27 N -2.19 0.16 -0.04 4.02 9.09 -2.00 -2.90 114.58 120.72 2fbe h GLU 27 Ca -0.47 -0.13 0.00 0.00 0.05 0.00 0.00 59.36 58.81 2fbe h GLU 27 Cb 1.29 0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.42 2fbe h GLU 27 CO 0.41 0.81 0.00 -0.40 0.05 0.00 0.00 179.01 179.88 2fbe n ASP 28 N -3.76 0.77 -3.66 3.06 5.75 -1.26 -4.92 116.55 112.53 2fbe n ASP 28 Ca -0.02 -1.38 -0.24 0.00 -0.01 0.00 0.00 54.79 53.13 2fbe n ASP 28 Cb 0.70 -0.02 0.06 0.00 -1.03 0.00 0.00 41.12 40.83 2fbe n ASP 28 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2fbe n LEU 29 N -0.35 -3.26 -1.08 -2.12 4.77 -1.10 -4.90 117.00 108.97 2fbe n LEU 29 Ca 0.19 -0.63 0.02 0.00 -0.03 0.00 0.00 56.01 55.56 2fbe n LEU 29 Cb 0.21 -2.90 0.01 0.00 -2.33 0.00 0.00 43.42 38.41 2fbe n LEU 29 CO 0.15 0.55 0.14 0.54 -1.33 0.00 0.00 177.39 177.44 2fbe n ARG 30 N -4.75 0.00 -3.51 3.23 1.74 -1.26 -1.89 116.66 110.21 2fbe n ARG 30 Ca -0.05 -1.56 -0.17 0.00 -0.77 0.00 0.00 57.85 55.30 2fbe n ARG 30 Cb 0.58 -0.19 -0.05 0.00 -1.02 0.00 0.00 32.46 31.77 2fbe n ARG 30 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2fbe s SER 31 N -1.56 -0.63 0.23 0.55 0.01 -1.26 -0.53 113.70 110.51 2fbe s SER 31 Ca 0.19 0.62 -0.22 0.00 1.31 0.00 0.00 55.95 57.85 2fbe s SER 31 Cb 0.22 0.53 0.05 0.00 0.21 0.00 0.00 66.02 67.03 2fbe s SER 31 CO -0.10 -0.63 0.85 0.72 0.41 0.00 0.00 173.24 174.50 2fbe s PHE 32 N -1.46 -0.11 -0.24 2.43 -0.12 -0.03 -1.53 117.98 116.93 2fbe s PHE 32 Ca -0.09 -0.31 -0.27 0.00 -0.05 0.00 0.00 56.93 56.21 2fbe s PHE 32 Cb -0.00 0.70 0.14 0.00 -0.63 0.00 0.00 43.02 43.22 2fbe s PHE 32 CO 0.07 -1.09 1.10 -0.98 -0.05 0.00 0.00 175.22 174.27 2fbe s ARG 33 N -3.33 0.45 1.11 1.99 1.70 -0.96 -1.88 118.95 118.02 2fbe s ARG 33 Ca 0.13 0.30 -0.17 0.00 -0.47 0.00 0.00 55.73 55.53 2fbe s ARG 33 Cb -0.04 0.21 0.24 0.00 -0.57 0.00 0.00 34.95 34.80 2fbe s ARG 33 CO 0.05 -0.10 1.12 -1.54 -1.08 0.00 0.00 175.30 173.76 2fbe s SER 34 N -0.43 1.75 0.12 -2.89 1.04 -1.26 -1.41 113.70 110.62 2fbe s SER 34 Ca 0.02 0.77 -0.15 0.00 0.48 0.00 0.00 55.95 57.08 2fbe s SER 34 Cb -0.03 -1.14 0.05 0.00 0.10 0.00 0.00 66.02 65.00 2fbe s SER 34 CO -0.04 -3.63 0.70 0.61 0.98 0.00 0.00 173.24 171.86 2fbe n GLY 35 N -1.32 0.82 0.00 7.32 0.00 0.13 -4.75 105.19 107.39 2fbe n GLY 35 Ca 0.10 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2fbe n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fbe n ASP 36 N -1.06 0.00 -4.00 1.61 10.43 -1.26 -4.89 116.55 117.38 2fbe n ASP 36 Ca -0.01 0.64 -0.29 0.00 2.57 0.00 0.00 54.79 57.70 2fbe n ASP 36 Cb 0.39 -0.19 0.26 0.00 1.84 0.00 0.00 41.12 43.43 2fbe n ASP 36 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2fbe n LEU 37 N -1.06 -1.42 -4.01 0.64 -0.00 -1.26 -5.01 117.00 104.87 2fbe n LEU 37 Ca 0.00 -0.44 -0.31 0.00 -0.00 0.00 0.00 56.01 55.26 2fbe n LEU 37 Cb 0.00 -1.12 -0.15 0.00 -0.00 0.00 0.00 43.42 42.16 2fbe n LEU 37 CO 0.00 -3.78 -0.30 -0.55 -0.00 0.00 0.00 177.39 172.76 2fbe s SER 38 N -2.54 4.72 -0.86 1.45 0.15 -1.26 -4.57 113.70 110.78 2fbe s SER 38 Ca 0.66 -2.29 -0.26 0.00 0.70 0.00 0.00 55.95 54.76 2fbe s SER 38 Cb -0.19 -1.64 -0.14 0.00 -1.71 0.00 0.00 66.02 62.34 2fbe s SER 38 CO 0.62 -0.36 2.30 -1.10 1.20 0.00 0.00 173.24 175.89 2fbe s GLN 39 N 0.71 1.66 -0.51 5.44 1.11 0.41 -4.84 119.66 123.64 2fbe s GLN 39 Ca 0.12 0.21 -0.26 0.00 0.01 0.00 0.00 55.36 55.44 2fbe s GLN 39 Cb -0.20 -4.86 -0.07 0.00 -1.01 0.00 0.00 33.01 26.86 2fbe s GLN 39 CO -0.07 -4.49 2.41 -0.80 0.01 0.00 0.00 175.29 172.35 2fbe s ASN 40 N 10.07 4.38 0.29 5.90 0.01 -1.26 -4.56 114.94 129.78 2fbe s ASN 40 Ca 0.88 1.02 0.09 0.00 -0.71 0.00 0.00 52.86 54.13 2fbe s ASN 40 Cb -0.11 -2.50 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 2fbe s ASN 40 CO 0.09 -2.96 0.07 -0.13 -1.51 0.00 0.00 177.10 172.66 2fbe s ARG 41 N 8.33 2.39 -0.83 -0.60 0.52 -1.26 -5.01 118.95 122.48 2fbe s ARG 41 Ca 0.97 -1.42 -0.24 0.00 -0.52 0.00 0.00 55.73 54.52 2fbe s ARG 41 Cb -0.17 -2.21 -0.20 0.00 0.52 0.00 0.00 34.95 32.90 2fbe s ARG 41 CO 0.25 0.28 2.45 1.63 0.02 0.00 0.00 175.30 179.92 2fbe n LYS 42 N -1.02 0.36 -1.67 3.54 4.01 -1.26 -4.84 118.16 117.28 2fbe n LYS 42 Ca -0.05 -0.16 -0.45 0.00 -0.51 0.00 0.00 58.31 57.14 2fbe n LYS 42 Cb 0.60 -2.27 -0.03 0.00 -0.51 0.00 0.00 35.03 32.82 2fbe n LYS 42 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 2fbe n GLU 43 N 7.97 2.04 -3.55 1.97 0.00 -1.26 -4.96 120.64 122.86 2fbe n GLU 43 Ca 0.56 0.73 -0.08 0.00 0.00 0.00 0.00 57.16 58.37 2fbe n GLU 43 Cb 0.26 -2.41 -0.02 0.00 0.00 0.00 0.00 31.44 29.27 2fbe n GLU 43 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 2fbe s GLN 44 N -0.16 1.03 0.42 5.31 -2.07 -1.26 -5.05 119.66 117.89 2fbe s GLN 44 Ca 0.70 -0.43 0.11 0.00 -1.82 0.00 0.00 55.36 53.93 2fbe s GLN 44 Cb -0.66 0.44 0.96 0.00 -1.09 0.00 0.00 33.01 32.66 2fbe s GLN 44 CO 0.47 -0.45 2.00 0.00 -1.32 0.00 0.00 175.29 175.99 2fbe h ALA 45 N 2.00 1.91 0.00 2.60 0.00 -1.93 -0.74 119.26 123.10 2fbe h ALA 45 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2fbe h ALA 45 Cb 1.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2fbe h ALA 45 CO 0.31 -0.01 0.00 0.39 0.00 0.00 0.00 179.25 179.94 2fbe n GLU 46 N -4.47 0.34 -4.47 0.00 4.71 -1.26 -4.60 120.64 110.88 2fbe n GLU 46 Ca 0.08 0.08 -0.34 0.00 -0.01 0.00 0.00 57.16 56.97 2fbe n GLU 46 Cb 0.27 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.09 2fbe n GLU 46 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 2fbe s ARG 47 N -2.49 3.37 0.05 3.49 3.52 -0.29 -3.56 118.95 123.04 2fbe s ARG 47 Ca 0.21 -0.52 -0.31 0.00 -0.13 0.00 0.00 55.73 54.98 2fbe s ARG 47 Cb 0.14 -2.81 -0.06 0.00 -1.56 0.00 0.00 34.95 30.66 2fbe s ARG 47 CO 0.30 0.39 1.24 -0.06 -0.81 0.00 0.00 175.30 176.36 2fbe s PHE 48 N -0.05 3.35 -0.06 5.12 0.40 -1.01 -4.68 117.98 121.05 2fbe s PHE 48 Ca 0.01 1.22 0.12 0.00 -0.60 0.00 0.00 56.93 57.68 2fbe s PHE 48 Cb -0.13 -3.47 -0.23 0.00 0.51 0.00 0.00 43.02 39.70 2fbe s PHE 48 CO 0.03 -1.50 0.62 -0.40 0.70 0.00 0.00 175.22 174.66 2fbe n ASP 49 N 4.14 0.89 -0.07 1.36 3.85 -1.20 -4.22 116.55 121.31 2fbe n ASP 49 Ca 0.10 0.38 -0.07 0.00 -0.71 0.00 0.00 54.79 54.49 2fbe n ASP 49 Cb 0.46 -0.05 -0.02 0.00 -1.35 0.00 0.00 41.12 40.15 2fbe n ASP 49 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 2fbe n THR 50 N -3.05 1.15 -2.43 2.12 -1.04 -1.26 -4.80 114.28 104.96 2fbe n THR 50 Ca -0.18 0.23 -0.36 0.00 -2.04 0.00 0.00 64.05 61.70 2fbe n THR 50 Cb 1.06 -2.16 -0.03 0.00 -1.82 0.00 0.00 70.33 67.39 2fbe n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fbe s ALA 51 N -2.92 2.94 -1.27 2.41 0.00 -1.26 -4.96 121.76 116.70 2fbe s ALA 51 Ca -0.21 0.75 -0.19 0.00 0.00 0.00 0.00 51.96 52.31 2fbe s ALA 51 Cb 0.03 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 19.91 2fbe s ALA 51 CO 0.31 -0.43 1.72 -0.51 0.00 0.00 0.00 175.76 176.85 2fbe s LEU 52 N -3.14 3.79 0.05 0.00 1.43 -1.26 -4.62 118.68 114.93 2fbe s LEU 52 Ca 0.64 -2.33 0.02 0.00 -1.03 0.00 0.00 54.13 51.43 2fbe s LEU 52 Cb -0.22 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.39 2fbe s LEU 52 CO 0.27 -1.25 -0.06 0.00 0.23 0.00 0.00 176.35 175.53 2fbe s VAL 54 N -1.90 0.67 -0.02 0.00 1.01 -0.82 -2.84 120.40 116.51 2fbe s VAL 54 Ca -0.07 -1.87 0.07 0.00 0.00 0.00 0.00 61.98 60.12 2fbe s VAL 54 Cb -0.07 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 2fbe s VAL 54 CO -0.01 -0.84 -0.24 -0.76 0.00 0.00 0.00 175.10 173.24 2fbe s LEU 55 N -2.94 2.05 0.77 3.92 1.43 -1.26 -2.02 118.68 120.63 2fbe s LEU 55 Ca 0.10 -0.44 -0.14 0.00 -1.03 0.00 0.00 54.13 52.63 2fbe s LEU 55 Cb 0.04 -1.25 0.06 0.00 0.03 0.00 0.00 46.19 45.08 2fbe s LEU 55 CO -0.04 0.30 1.18 -0.83 0.23 0.00 0.00 176.35 177.18 2fbe s GLY 56 N -0.56 2.14 0.26 -3.19 0.00 0.74 -0.79 107.32 105.92 2fbe s GLY 56 Ca 0.09 0.76 0.01 0.00 0.00 0.00 0.00 44.72 45.58 2fbe s GLY 56 CO -0.01 1.16 1.66 -0.84 0.00 0.00 0.00 173.10 175.07 2fbe h THR 57 N -0.71 1.29 -2.50 0.90 2.02 -1.17 -3.40 112.91 109.33 2fbe h THR 57 Ca -0.46 -1.44 -0.50 0.00 0.77 0.00 0.00 66.41 64.78 2fbe h THR 57 Cb 1.28 1.49 0.23 0.00 -1.74 0.00 0.00 68.15 69.42 2fbe h THR 57 CO 0.48 0.45 -1.19 -2.65 0.37 0.00 0.00 175.52 172.98 2fbe n PRO 58 N -4.06 -0.81 -3.36 6.66 -0.02 -1.26 -4.98 135.00 127.16 2fbe n PRO 58 Ca -0.01 -0.21 -0.17 0.00 -2.02 0.00 0.00 63.50 61.09 2fbe n PRO 58 Cb 0.47 -1.60 -0.08 0.00 -0.02 0.00 0.00 33.50 32.27 2fbe n PRO 58 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2fbe s ARG 59 N -3.19 0.59 -0.15 -0.52 0.52 -1.26 -4.55 118.95 110.39 2fbe s ARG 59 Ca 0.52 -0.74 -0.25 0.00 -0.52 0.00 0.00 55.73 54.74 2fbe s ARG 59 Cb -0.13 -0.70 -0.02 0.00 0.52 0.00 0.00 34.95 34.62 2fbe s ARG 59 CO 0.68 -1.17 0.82 -0.06 0.02 0.00 0.00 175.30 175.60 2fbe s PHE 60 N 1.59 3.44 0.00 -0.53 2.99 -0.92 -4.81 117.98 119.74 2fbe s PHE 60 Ca 0.16 1.26 0.00 0.00 0.00 0.00 0.00 56.93 58.35 2fbe s PHE 60 Cb -0.15 -2.99 0.00 0.00 0.00 0.00 0.00 43.02 39.88 2fbe s PHE 60 CO -0.08 -0.20 0.13 0.25 -0.00 0.00 0.00 175.22 175.32 2fbe n THR 61 N 4.62 0.00 -3.64 0.64 -2.24 -1.26 -0.29 114.28 112.11 2fbe n THR 61 Ca 0.04 -0.46 -0.01 0.00 -2.27 0.00 0.00 64.05 61.35 2fbe n THR 61 Cb 0.49 1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 69.73 2fbe n THR 61 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2fbe s SER 62 N -0.65 -0.12 0.00 3.42 1.04 -1.26 -4.98 113.70 111.15 2fbe s SER 62 Ca 0.00 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2fbe s SER 62 Cb 0.00 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.37 2fbe s SER 62 CO 0.00 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.39 2fbe n GLY 63 N -0.39 -0.63 3.58 7.32 0.00 -1.26 -4.87 105.19 108.94 2fbe n GLY 63 Ca -0.06 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 2fbe n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fbe s ARG 64 N -1.16 3.86 -0.03 1.61 0.52 -1.26 -2.09 118.95 120.39 2fbe s ARG 64 Ca 0.00 -0.41 0.01 0.00 -0.52 0.00 0.00 55.73 54.81 2fbe s ARG 64 Cb 0.00 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.37 2fbe s ARG 64 CO 0.00 0.23 -0.02 -1.01 0.02 0.00 0.00 175.30 174.53 2fbe s HIS 65 N 0.45 0.45 -0.02 -0.53 3.76 0.15 -4.83 115.29 114.73 2fbe s HIS 65 Ca 0.01 -0.07 0.06 0.00 -0.15 0.00 0.00 55.06 54.91 2fbe s HIS 65 Cb -0.13 -0.47 -0.01 0.00 1.11 0.00 0.00 32.58 33.07 2fbe s HIS 65 CO 0.01 -0.14 -0.20 -0.47 -0.85 0.00 0.00 174.74 173.09 2fbe s TYR 66 N 0.89 1.83 0.04 1.40 6.14 -0.09 0.17 117.35 127.73 2fbe s TYR 66 Ca -0.10 -0.37 -0.19 0.00 0.64 0.00 0.00 57.07 57.06 2fbe s TYR 66 Cb -0.13 -1.18 0.04 0.00 0.42 0.00 0.00 41.96 41.10 2fbe s TYR 66 CO -0.01 -0.05 0.42 1.67 0.64 0.00 0.00 175.55 178.22 2fbe s TRP 67 N -0.43 -0.28 0.05 4.97 -2.14 -0.66 -0.66 118.94 119.80 2fbe s TRP 67 Ca 0.07 0.27 0.07 0.00 2.66 0.00 0.00 56.10 59.17 2fbe s TRP 67 Cb -0.08 0.22 -0.03 0.00 -3.10 0.00 0.00 33.47 30.48 2fbe s TRP 67 CO -0.00 -0.56 -0.17 -1.21 -2.66 0.00 0.00 176.95 172.34 2fbe s GLU 68 N -2.35 2.06 -0.08 3.25 2.02 -1.26 -1.03 118.70 121.30 2fbe s GLU 68 Ca -0.06 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 53.96 2fbe s GLU 68 Cb -0.01 -2.20 0.01 0.00 0.10 0.00 0.00 34.13 32.04 2fbe s GLU 68 CO -0.01 0.53 -0.14 0.08 0.02 0.00 0.00 175.26 175.74 2fbe s VAL 69 N -0.96 1.32 -0.25 2.63 1.01 -0.60 -1.90 120.40 121.64 2fbe s VAL 69 Ca 0.15 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 2fbe s VAL 69 Cb -0.11 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2fbe s VAL 69 CO 0.06 0.40 0.27 -0.62 0.00 0.00 0.00 175.10 175.21 2fbe s ASP 70 N 0.76 6.18 0.00 3.32 2.15 -0.26 -1.13 116.67 127.68 2fbe s ASP 70 Ca -0.12 0.19 0.23 0.00 0.43 0.00 0.00 52.55 53.28 2fbe s ASP 70 Cb -0.16 -2.16 0.38 0.00 -0.30 0.00 0.00 42.92 40.69 2fbe s ASP 70 CO 0.03 -0.06 1.36 1.33 -0.17 0.00 0.00 175.17 177.65 2fbe n VAL 71 N 4.75 0.45 0.00 1.11 0.24 0.13 -1.58 118.33 123.43 2fbe n VAL 71 Ca -0.12 -0.72 0.00 0.00 -2.04 0.00 0.00 64.34 61.46 2fbe n VAL 71 Cb 0.51 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.93 2fbe n VAL 71 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fbe n GLY 72 N 1.43 2.11 0.91 7.63 0.00 -1.15 -0.92 105.19 115.19 2fbe n GLY 72 Ca 0.18 0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.36 2fbe n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fbe n THR 73 N 0.00 0.60 -1.63 2.61 -2.24 -1.26 -4.69 114.28 107.66 2fbe n THR 73 Ca 0.00 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.72 2fbe n THR 73 Cb 0.00 0.41 0.01 0.00 -2.10 0.00 0.00 70.33 68.65 2fbe n THR 73 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2fbe n SER 74 N 0.95 1.60 -0.02 3.42 2.88 -0.09 -4.93 113.62 117.43 2fbe n SER 74 Ca 0.17 1.07 0.08 0.00 -1.33 0.00 0.00 58.87 58.87 2fbe n SER 74 Cb 0.43 -1.38 -0.15 0.00 -0.75 0.00 0.00 64.21 62.36 2fbe n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2fbe n GLN 75 N 0.21 0.63 -3.79 -1.46 6.02 -1.26 -4.90 117.38 112.83 2fbe n GLN 75 Ca 0.09 -0.16 -0.25 0.00 -0.01 0.00 0.00 57.00 56.66 2fbe n GLN 75 Cb 0.38 -1.46 -0.17 0.00 1.02 0.00 0.00 30.24 30.01 2fbe n GLN 75 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2fbe s VAL 76 N -3.27 0.57 0.28 5.09 1.01 -1.26 -3.71 120.40 119.11 2fbe s VAL 76 Ca -0.07 -0.21 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 2fbe s VAL 76 Cb 0.12 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.69 2fbe s VAL 76 CO 0.80 0.12 0.68 -1.66 0.00 0.00 0.00 175.10 175.04 2fbe s TRP 77 N 1.87 -0.07 -0.14 5.22 1.48 -0.59 -2.75 118.94 123.96 2fbe s TRP 77 Ca 0.03 -0.39 -0.11 0.00 -1.06 0.00 0.00 56.10 54.57 2fbe s TRP 77 Cb -0.14 0.62 0.04 0.00 -1.16 0.00 0.00 33.47 32.84 2fbe s TRP 77 CO -0.07 -1.22 0.37 -0.51 -4.06 0.00 0.00 176.95 171.46 2fbe s ASP 78 N -2.95 -0.41 0.06 -2.66 1.01 -1.12 -0.67 116.67 109.94 2fbe s ASP 78 Ca 0.13 0.76 0.01 0.00 0.71 0.00 0.00 52.55 54.16 2fbe s ASP 78 Cb -0.05 0.72 -0.03 0.00 1.01 0.00 0.00 42.92 44.56 2fbe s ASP 78 CO 0.08 -0.15 -0.05 -0.69 0.21 0.00 0.00 175.17 174.56 2fbe s VAL 79 N 0.68 0.46 -0.10 -1.27 1.01 0.25 -1.62 120.40 119.81 2fbe s VAL 79 Ca -0.04 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.35 2fbe s VAL 79 Cb -0.05 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.10 2fbe s VAL 79 CO -0.05 -0.76 0.00 0.61 0.00 0.00 0.00 175.10 174.91 2fbe n GLY 80 N 0.53 0.34 3.11 4.51 0.00 -1.14 -0.49 105.19 112.05 2fbe n GLY 80 Ca -0.16 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.59 2fbe n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fbe s VAL 81 N -4.00 0.44 0.05 1.61 -7.23 -0.91 0.84 120.40 111.20 2fbe s VAL 81 Ca 0.00 -1.67 -0.01 0.00 -1.81 0.00 0.00 61.98 58.49 2fbe s VAL 81 Cb 0.00 -1.34 -0.04 0.00 0.56 0.00 0.00 36.38 35.57 2fbe s VAL 81 CO 0.00 -0.82 -0.02 0.00 -0.31 0.00 0.00 175.10 173.95 2fbe s LYS 83 N -3.70 4.15 0.64 0.00 1.02 -0.55 -0.74 119.74 120.56 2fbe s LYS 83 Ca 0.05 1.66 0.41 0.00 0.02 0.00 0.00 55.97 58.11 2fbe s LYS 83 Cb 0.06 -2.64 2.19 0.00 -0.52 0.00 0.00 37.83 36.92 2fbe s LYS 83 CO -0.09 -0.19 2.29 1.49 -0.92 0.00 0.00 175.35 177.94 2fbe h GLU 84 N 2.65 0.00 -0.67 1.68 4.57 -1.81 -2.00 114.58 119.00 2fbe h GLU 84 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2fbe h GLU 84 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2fbe h GLU 84 CO 0.63 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 177.33 2fbe n SER 85 N -3.15 4.42 -4.79 1.04 3.41 -1.26 -4.97 113.62 108.32 2fbe n SER 85 Ca -0.02 -2.34 -0.34 0.00 -0.26 0.00 0.00 58.87 55.91 2fbe n SER 85 Cb 0.12 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 2fbe n SER 85 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2fbe s VAL 86 N -1.68 3.73 0.09 -3.33 -7.23 -0.75 -4.99 120.40 106.24 2fbe s VAL 86 Ca 0.49 1.09 -0.30 0.00 -1.81 0.00 0.00 61.98 61.45 2fbe s VAL 86 Cb 0.30 -3.45 -0.06 0.00 0.56 0.00 0.00 36.38 33.74 2fbe s VAL 86 CO 0.25 -0.22 1.07 0.21 -0.31 0.00 0.00 175.10 176.10 2fbe s ASN 87 N -1.94 7.29 0.00 4.85 2.47 -1.26 -4.94 114.94 121.41 2fbe s ASN 87 Ca 0.67 1.91 0.22 0.00 0.42 0.00 0.00 52.86 56.08 2fbe s ASN 87 Cb -0.17 -2.59 0.09 0.00 -1.45 0.00 0.00 41.25 37.13 2fbe s ASN 87 CO 0.21 -0.26 1.12 0.54 -3.72 0.00 0.00 177.10 174.99 2fbe n ARG 88 N 3.21 1.73 -4.06 0.43 1.74 -1.26 -4.95 116.66 113.50 2fbe n ARG 88 Ca 0.05 -1.41 -0.36 0.00 -0.77 0.00 0.00 57.85 55.37 2fbe n ARG 88 Cb 0.48 -1.43 -0.08 0.00 -1.02 0.00 0.00 32.46 30.41 2fbe n ARG 88 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2fbe s GLN 89 N -2.09 3.41 2.17 5.56 1.11 -1.26 -3.22 119.66 125.33 2fbe s GLN 89 Ca 0.22 -0.26 0.00 0.00 0.01 0.00 0.00 55.36 55.32 2fbe s GLN 89 Cb 0.18 -3.07 0.00 0.00 -1.01 0.00 0.00 33.01 29.11 2fbe s GLN 89 CO 0.40 0.65 0.00 0.41 0.01 0.00 0.00 175.29 176.76 2fbe n GLY 90 N 2.36 0.54 3.68 3.09 0.00 -1.26 -4.84 105.19 108.76 2fbe n GLY 90 Ca -0.19 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2fbe n GLY 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fbe s LYS 91 N 0.00 4.37 -0.45 1.61 2.20 -1.26 -4.27 119.74 121.94 2fbe s LYS 91 Ca 0.00 1.30 -0.14 0.00 -0.36 0.00 0.00 55.97 56.77 2fbe s LYS 91 Cb 0.00 -3.56 0.07 0.00 -1.51 0.00 0.00 37.83 32.83 2fbe s LYS 91 CO 0.00 -0.35 0.35 0.42 -0.36 0.00 0.00 175.35 175.41 2fbe s ILE 92 N 2.17 4.94 -0.41 5.43 -1.09 -1.26 -5.04 121.20 125.93 2fbe s ILE 92 Ca 0.45 -1.12 -0.23 0.00 -2.23 0.00 0.00 60.65 57.52 2fbe s ILE 92 Cb -0.17 -3.95 0.02 0.00 -1.58 0.00 0.00 42.46 36.77 2fbe s ILE 92 CO 0.15 -0.53 0.76 -0.70 -1.23 0.00 0.00 174.94 173.39 2fbe s GLU 93 N 1.58 3.53 -1.08 2.79 2.12 -1.26 -4.96 118.70 121.42 2fbe s GLU 93 Ca 0.04 0.03 -0.24 0.00 0.36 0.00 0.00 54.97 55.16 2fbe s GLU 93 Cb -0.23 -3.89 -0.13 0.00 0.26 0.00 0.00 34.13 30.14 2fbe s GLU 93 CO 0.06 -1.00 1.95 1.28 -0.54 0.00 0.00 175.26 177.01 2fbe n LEU 94 N 6.55 2.85 -3.97 2.70 4.77 -1.26 -4.79 117.00 123.84 2fbe n LEU 94 Ca 0.02 -2.98 -0.21 0.00 -0.03 0.00 0.00 56.01 52.81 2fbe n LEU 94 Cb 0.48 -1.62 -0.16 0.00 -2.33 0.00 0.00 43.42 39.79 2fbe n LEU 94 CO 0.56 -1.96 -0.44 -0.55 -1.33 0.00 0.00 177.39 173.68 2fbe s SER 95 N 6.64 1.24 0.39 -1.43 0.15 -1.26 -4.60 113.70 114.83 2fbe s SER 95 Ca 0.69 -0.19 0.27 0.00 0.70 0.00 0.00 55.95 57.42 2fbe s SER 95 Cb 0.01 -0.47 1.42 0.00 -1.71 0.00 0.00 66.02 65.27 2fbe s SER 95 CO 0.15 0.02 1.82 0.77 1.20 0.00 0.00 173.24 177.20 2fbe h SER 96 N 6.75 0.00 0.13 5.45 4.64 -0.34 0.30 113.55 130.48 2fbe h SER 96 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2fbe h SER 96 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2fbe h SER 96 CO 0.48 0.00 -0.14 -0.62 -0.87 0.00 0.00 176.83 175.68 2fbe n GLU 97 N -2.44 1.18 -0.07 4.77 1.02 -1.26 -3.06 120.64 120.78 2fbe n GLU 97 Ca -0.01 -0.68 0.05 0.00 -0.02 0.00 0.00 57.16 56.49 2fbe n GLU 97 Cb 0.06 -1.49 0.08 0.00 -0.02 0.00 0.00 31.44 30.07 2fbe n GLU 97 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2fbe n HIS 98 N -0.32 0.17 -0.27 -0.32 8.25 0.94 -4.96 115.22 118.72 2fbe n HIS 98 Ca 0.15 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2fbe n HIS 98 Cb 0.35 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2fbe n HIS 98 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fbe n GLY 99 N 0.43 0.85 3.31 -1.41 0.00 -0.99 -4.85 105.19 102.53 2fbe n GLY 99 Ca 0.07 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 2fbe n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fbe s PHE 100 N -2.00 2.96 -0.76 1.61 0.40 -0.52 -1.49 117.98 118.18 2fbe s PHE 100 Ca 0.00 -0.94 0.01 0.00 -0.60 0.00 0.00 56.93 55.40 2fbe s PHE 100 Cb 0.00 -2.10 0.19 0.00 0.51 0.00 0.00 43.02 41.61 2fbe s PHE 100 CO 0.00 -0.55 0.59 -0.51 0.70 0.00 0.00 175.22 175.45 2fbe s LEU 101 N 1.47 5.18 0.21 -0.37 1.43 -0.15 -1.80 118.68 124.65 2fbe s LEU 101 Ca 0.06 -3.55 0.05 0.00 -1.03 0.00 0.00 54.13 49.66 2fbe s LEU 101 Cb -0.14 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2fbe s LEU 101 CO -0.03 -0.19 -0.06 0.42 0.23 0.00 0.00 176.35 176.71 2fbe s THR 102 N -1.06 1.32 -0.10 5.49 -4.23 -1.26 -2.14 115.64 113.65 2fbe s THR 102 Ca 0.24 -2.09 0.04 0.00 -1.18 0.00 0.00 61.69 58.69 2fbe s THR 102 Cb -0.10 -2.19 -0.00 0.00 1.34 0.00 0.00 72.50 71.55 2fbe s THR 102 CO -0.11 -0.48 -0.23 -0.69 -0.54 0.00 0.00 174.62 172.57 2fbe s VAL 103 N -3.23 2.13 0.07 2.29 1.01 0.36 0.99 120.40 124.01 2fbe s VAL 103 Ca 0.25 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2fbe s VAL 103 Cb 0.03 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2fbe s VAL 103 CO 0.07 0.56 -0.06 -0.83 0.00 0.00 0.00 175.10 174.84 2fbe s GLY 104 N 0.35 0.60 -0.03 4.51 0.00 0.55 -0.58 107.32 112.72 2fbe s GLY 104 Ca -0.18 -1.16 0.07 0.00 0.00 0.00 0.00 44.72 43.45 2fbe s GLY 104 CO 0.09 -1.25 -0.23 0.00 0.00 0.00 0.00 173.10 171.71 2fbe s ARG 106 N -0.64 1.95 0.16 0.00 1.81 -0.22 -1.54 118.95 120.48 2fbe s ARG 106 Ca 0.10 -2.19 -0.34 0.00 -1.72 0.00 0.00 55.73 51.59 2fbe s ARG 106 Cb -0.10 -0.90 -0.15 0.00 -0.45 0.00 0.00 34.95 33.34 2fbe s ARG 106 CO -0.01 -0.39 1.32 -1.91 -0.68 0.00 0.00 175.30 173.64 2fbe n GLU 107 N -0.96 1.51 -0.28 3.54 2.13 -1.24 -1.71 120.64 123.62 2fbe n GLU 107 Ca -0.09 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.27 2fbe n GLU 107 Cb 0.66 -2.15 0.00 0.00 0.27 0.00 0.00 31.44 30.22 2fbe n GLU 107 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fbe n GLY 108 N 2.38 0.85 3.76 8.31 0.00 -1.26 -4.18 105.19 115.04 2fbe n GLY 108 Ca 0.15 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 2fbe n GLY 108 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fbe n LYS 109 N -2.28 -6.38 -3.37 1.61 5.02 -0.69 -4.95 118.16 107.12 2fbe n LYS 109 Ca 0.00 0.69 -0.38 0.00 -2.02 0.00 0.00 58.31 56.61 2fbe n LYS 109 Cb 0.00 -5.62 -0.07 0.00 -0.02 0.00 0.00 35.03 29.33 2fbe n LYS 109 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2fbe s VAL 110 N -3.35 5.20 -0.06 -0.18 1.01 -1.06 -4.89 120.40 117.07 2fbe s VAL 110 Ca 0.52 0.79 -0.01 0.00 0.00 0.00 0.00 61.98 63.28 2fbe s VAL 110 Cb -0.25 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2fbe s VAL 110 CO 0.79 0.28 0.02 -0.36 0.00 0.00 0.00 175.10 175.83 2fbe s PHE 111 N 1.04 3.17 -0.06 5.22 0.40 -1.26 -1.05 117.98 125.44 2fbe s PHE 111 Ca 0.21 0.18 -0.23 0.00 -0.60 0.00 0.00 56.93 56.49 2fbe s PHE 111 Cb -0.15 -1.76 0.05 0.00 0.51 0.00 0.00 43.02 41.67 2fbe s PHE 111 CO 0.08 0.49 0.52 0.00 0.70 0.00 0.00 175.22 177.01 2fbe s ALA 112 N -0.98 -1.33 0.03 5.36 0.00 0.88 -1.84 121.76 123.88 2fbe s ALA 112 Ca 0.16 0.96 0.01 0.00 0.00 0.00 0.00 51.96 53.10 2fbe s ALA 112 Cb -0.11 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 2fbe s ALA 112 CO 0.06 -0.31 0.05 0.00 0.00 0.00 0.00 175.76 175.55 2fbe s ALA 113 N -1.03 3.46 -0.55 0.00 0.00 -0.66 0.20 121.76 123.18 2fbe s ALA 113 Ca -0.10 -0.95 -0.07 0.00 0.00 0.00 0.00 51.96 50.83 2fbe s ALA 113 Cb -0.03 -1.43 -0.20 0.00 0.00 0.00 0.00 23.12 21.46 2fbe s ALA 113 CO 0.06 0.69 3.28 -1.13 0.00 0.00 0.00 175.76 178.66 2fbe n SER 114 N 1.02 6.21 -3.62 0.00 3.41 0.28 -2.67 113.62 118.24 2fbe n SER 114 Ca -0.12 -2.48 -0.19 0.00 -0.26 0.00 0.00 58.87 55.82 2fbe n SER 114 Cb 0.52 -1.41 0.12 0.00 -0.26 0.00 0.00 64.21 63.18 2fbe n SER 114 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2fbe n THR 115 N 2.92 0.00 -3.83 6.66 -2.24 -1.26 -1.18 114.28 115.34 2fbe n THR 115 Ca 0.53 -0.93 -0.30 0.00 -2.27 0.00 0.00 64.05 61.08 2fbe n THR 115 Cb 0.65 -1.33 -0.14 0.00 -2.10 0.00 0.00 70.33 67.41 2fbe n THR 115 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fbe s VAL 116 N -2.66 1.95 0.00 2.28 1.01 -1.26 -4.60 120.40 117.13 2fbe s VAL 116 Ca 0.52 -2.86 0.00 0.00 0.00 0.00 0.00 61.98 59.64 2fbe s VAL 116 Cb -0.02 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.99 2fbe s VAL 116 CO 0.35 -0.83 0.00 -2.65 0.00 0.00 0.00 175.10 171.97 2fbe n PRO 117 N 3.41 0.00 -3.69 2.72 -0.02 -1.26 -5.13 135.00 131.04 2fbe n PRO 117 Ca 0.06 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.41 2fbe n PRO 117 Cb 0.34 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.68 2fbe n PRO 117 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2fbe s THR 119 N 0.00 -0.27 0.36 3.45 2.01 -1.09 -5.00 115.64 115.10 2fbe s THR 119 Ca 0.00 0.25 -0.24 0.00 0.31 0.00 0.00 61.69 62.01 2fbe s THR 119 Cb 0.00 -0.39 -0.10 0.00 0.01 0.00 0.00 72.50 72.02 2fbe s THR 119 CO 0.00 0.10 0.97 -2.84 -0.69 0.00 0.00 174.62 172.17 2fbe s PRO 120 N 2.02 4.40 0.07 4.92 0.02 -1.26 -1.65 135.00 143.51 2fbe s PRO 120 Ca -0.02 1.33 0.08 0.00 0.02 0.00 0.00 61.00 62.41 2fbe s PRO 120 Cb -0.12 -2.60 -0.03 0.00 0.02 0.00 0.00 34.50 31.77 2fbe s PRO 120 CO -0.08 0.11 -0.21 -0.51 -0.33 0.00 0.00 177.00 175.97 2fbe s LEU 121 N -2.44 2.21 -0.34 -5.54 2.01 -0.77 -4.93 118.68 108.89 2fbe s LEU 121 Ca 0.55 -0.59 0.00 0.00 0.01 0.00 0.00 54.13 54.10 2fbe s LEU 121 Cb -0.18 -0.97 0.08 0.00 0.01 0.00 0.00 46.19 45.13 2fbe s LEU 121 CO 0.23 0.14 0.06 0.26 1.01 0.00 0.00 176.35 178.04 2fbe s TRP 122 N -0.92 3.50 0.36 0.29 0.52 -1.26 -4.24 118.94 117.18 2fbe s TRP 122 Ca 0.08 -2.42 0.08 0.00 0.02 0.00 0.00 56.10 53.86 2fbe s TRP 122 Cb -0.09 -2.63 -0.05 0.00 -1.15 0.00 0.00 33.47 29.54 2fbe s TRP 122 CO 0.03 -0.91 0.10 0.14 0.02 0.00 0.00 176.95 176.33 2fbe s VAL 123 N 1.10 2.72 0.40 4.03 -7.23 -1.26 -5.08 120.40 115.07 2fbe s VAL 123 Ca 0.03 -1.80 -0.27 0.00 -1.81 0.00 0.00 61.98 58.12 2fbe s VAL 123 Cb -0.20 -2.91 -0.10 0.00 0.56 0.00 0.00 36.38 33.72 2fbe s VAL 123 CO -0.05 -0.15 1.49 -0.55 -0.31 0.00 0.00 175.10 175.53 2fbe s SER 124 N -3.81 6.20 0.36 4.85 0.15 -1.26 -4.89 113.70 115.31 2fbe s SER 124 Ca 0.37 3.05 0.27 0.00 0.70 0.00 0.00 55.95 60.34 2fbe s SER 124 Cb -0.00 -2.67 1.25 0.00 -1.71 0.00 0.00 66.02 62.89 2fbe s SER 124 CO 0.21 -0.97 1.80 -0.65 1.20 0.00 0.00 173.24 174.84 2fbe h PRO 125 N 2.82 0.00 -0.65 5.44 0.11 -2.00 -2.36 132.00 135.36 2fbe h PRO 125 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2fbe h PRO 125 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2fbe h PRO 125 CO 0.63 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.46 2fbe n GLN 126 N -2.45 2.82 -1.74 1.05 6.02 -1.26 -5.01 117.38 116.82 2fbe n GLN 126 Ca 0.00 -2.56 -0.42 0.00 -0.01 0.00 0.00 57.00 54.01 2fbe n GLN 126 Cb 0.16 -1.53 -0.01 0.00 1.02 0.00 0.00 30.24 29.88 2fbe n GLN 126 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2fbe n LEU 127 N 1.38 4.23 0.00 1.08 7.94 -0.89 -4.85 117.00 125.88 2fbe n LEU 127 Ca 0.22 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.28 2fbe n LEU 127 Cb 0.60 -1.57 0.00 0.00 0.53 0.00 0.00 43.42 42.98 2fbe n LEU 127 CO 0.15 0.04 0.00 0.00 -1.11 0.00 0.00 177.39 176.48 2fbe n HIS 128 N 1.79 0.00 -3.74 1.96 1.44 -1.26 -4.92 115.22 110.50 2fbe n HIS 128 Ca 0.08 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.56 2fbe n HIS 128 Cb 0.36 0.01 -0.18 0.00 0.12 0.00 0.00 29.99 30.31 2fbe n HIS 128 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2fbe s ARG 129 N 0.00 0.43 -0.22 -1.40 3.52 -1.26 0.21 118.95 120.24 2fbe s ARG 129 Ca 0.00 0.11 -0.09 0.00 -0.13 0.00 0.00 55.73 55.62 2fbe s ARG 129 Cb 0.00 -1.01 -0.04 0.00 -1.56 0.00 0.00 34.95 32.33 2fbe s ARG 129 CO 0.00 -0.36 0.11 0.08 -0.81 0.00 0.00 175.30 174.32 2fbe s VAL 130 N 2.01 4.99 -0.17 7.11 1.01 -0.29 -0.25 120.40 134.82 2fbe s VAL 130 Ca 0.04 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 2fbe s VAL 130 Cb -0.13 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 2fbe s VAL 130 CO -0.05 0.39 0.20 -0.83 0.00 0.00 0.00 175.10 174.82 2fbe s GLY 131 N 0.83 2.13 -0.08 4.51 0.00 0.32 -1.55 107.32 113.49 2fbe s GLY 131 Ca 0.06 -0.58 0.04 0.00 0.00 0.00 0.00 44.72 44.24 2fbe s GLY 131 CO 0.02 0.20 -0.21 -0.42 0.00 0.00 0.00 173.10 172.69 2fbe s ILE 132 N 0.20 1.82 -0.30 0.90 1.01 -0.20 0.48 121.20 125.11 2fbe s ILE 132 Ca 0.13 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.90 2fbe s ILE 132 Cb -0.12 -1.57 0.09 0.00 0.01 0.00 0.00 42.46 40.87 2fbe s ILE 132 CO 0.01 0.51 0.04 0.12 0.00 0.00 0.00 174.94 175.63 2fbe s PHE 133 N 0.27 2.71 -0.27 3.97 5.36 -0.22 -1.65 117.98 128.16 2fbe s PHE 133 Ca -0.14 -2.26 -0.20 0.00 -0.96 0.00 0.00 56.93 53.37 2fbe s PHE 133 Cb -0.16 -2.18 -0.02 0.00 -0.34 0.00 0.00 43.02 40.33 2fbe s PHE 133 CO 0.06 -0.88 0.64 -1.17 -1.46 0.00 0.00 175.22 172.41 2fbe s LEU 134 N 1.27 4.09 -0.53 6.12 2.96 0.13 -1.72 118.68 130.99 2fbe s LEU 134 Ca 0.07 0.63 0.04 0.00 -0.22 0.00 0.00 54.13 54.65 2fbe s LEU 134 Cb -0.18 -2.85 0.13 0.00 0.50 0.00 0.00 46.19 43.79 2fbe s LEU 134 CO -0.14 -0.41 0.28 -0.62 -1.32 0.00 0.00 176.35 174.14 2fbe s ASP 135 N 1.52 4.35 0.38 3.68 -1.08 -0.07 0.35 116.67 125.81 2fbe s ASP 135 Ca 0.26 -3.09 0.08 0.00 -0.52 0.00 0.00 52.55 49.29 2fbe s ASP 135 Cb -0.15 -1.64 0.83 0.00 -1.46 0.00 0.00 42.92 40.50 2fbe s ASP 135 CO 0.10 -0.22 1.97 0.58 0.52 0.00 0.00 175.17 178.12 2fbe h VAL 136 N 5.40 0.99 0.00 1.11 2.07 -1.64 -0.23 116.25 123.96 2fbe h VAL 136 Ca -0.06 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2fbe h VAL 136 Cb 0.88 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2fbe h VAL 136 CO 0.69 0.12 0.00 0.61 0.02 0.00 0.00 177.57 179.01 2fbe n GLY 137 N -1.47 0.36 2.42 2.17 0.00 -1.26 -4.71 105.19 102.70 2fbe n GLY 137 Ca 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 2fbe n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fbe n ARG 139 N 0.51 0.58 -4.00 1.61 1.74 -0.14 -5.15 116.66 111.82 2fbe n ARG 139 Ca 0.00 -0.89 -0.08 0.00 -0.77 0.00 0.00 57.85 56.11 2fbe n ARG 139 Cb 0.07 0.07 -0.09 0.00 -1.02 0.00 0.00 32.46 31.49 2fbe n ARG 139 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2fbe s SER 140 N -0.54 0.26 -0.09 0.55 1.04 -0.93 -0.91 113.70 113.08 2fbe s SER 140 Ca 0.08 -0.90 -0.04 0.00 0.48 0.00 0.00 55.95 55.57 2fbe s SER 140 Cb 0.19 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.66 2fbe s SER 140 CO -0.05 -0.71 0.19 -0.51 0.98 0.00 0.00 173.24 173.14 2fbe s ILE 141 N -3.93 -0.23 0.13 -1.02 2.07 -0.67 -0.89 121.20 116.66 2fbe s ILE 141 Ca 0.11 0.28 0.08 0.00 -1.41 0.00 0.00 60.65 59.71 2fbe s ILE 141 Cb 0.06 -0.33 -0.04 0.00 0.13 0.00 0.00 42.46 42.28 2fbe s ILE 141 CO -0.07 0.12 -0.10 0.00 -1.91 0.00 0.00 174.94 172.99 2fbe s ALA 142 N 2.00 2.96 -0.03 1.50 0.00 -0.70 -0.41 121.76 127.08 2fbe s ALA 142 Ca -0.01 -1.33 0.08 0.00 0.00 0.00 0.00 51.96 50.70 2fbe s ALA 142 Cb -0.12 -0.84 -0.02 0.00 0.00 0.00 0.00 23.12 22.14 2fbe s ALA 142 CO -0.07 0.57 -0.26 -0.06 0.00 0.00 0.00 175.76 175.95 2fbe s PHE 143 N -1.40 2.35 0.05 0.00 0.40 -0.03 -1.05 117.98 118.31 2fbe s PHE 143 Ca 0.23 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 56.08 2fbe s PHE 143 Cb -0.10 -1.52 -0.03 0.00 0.51 0.00 0.00 43.02 41.88 2fbe s PHE 143 CO 0.14 -0.07 -0.06 0.71 0.70 0.00 0.00 175.22 176.64 2fbe s TYR 144 N -0.54 0.64 -0.32 0.36 1.51 0.18 -0.55 117.35 118.63 2fbe s TYR 144 Ca 0.08 -0.69 -0.25 0.00 -1.01 0.00 0.00 57.07 55.20 2fbe s TYR 144 Cb -0.11 -0.39 0.01 0.00 -0.11 0.00 0.00 41.96 41.36 2fbe s TYR 144 CO -0.00 -0.16 0.86 1.21 -1.11 0.00 0.00 175.55 176.35 2fbe s ASN 145 N -2.12 6.72 0.23 2.29 3.84 0.09 0.12 114.94 126.10 2fbe s ASN 145 Ca -0.03 0.72 0.21 0.00 0.21 0.00 0.00 52.86 53.97 2fbe s ASN 145 Cb -0.04 -2.44 0.93 0.00 -0.55 0.00 0.00 41.25 39.16 2fbe s ASN 145 CO -0.03 -0.70 1.64 0.52 -2.79 0.00 0.00 177.10 175.74 2fbe n VAL 146 N 5.66 0.93 0.37 -5.21 0.31 0.65 -0.46 118.33 120.59 2fbe n VAL 146 Ca 0.06 0.34 0.13 0.00 -0.01 0.00 0.00 64.34 64.85 2fbe n VAL 146 Cb 0.48 -1.26 0.33 0.00 -0.91 0.00 0.00 33.84 32.47 2fbe n VAL 146 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2fbe h SER 147 N 0.00 0.00 0.00 4.52 0.02 -1.92 -3.39 113.55 112.78 2fbe h SER 147 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2fbe h SER 147 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2fbe h SER 147 CO 0.00 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 174.79 2fbe n ASP 148 N -2.77 0.00 -0.09 3.07 3.85 -1.12 -5.02 116.55 114.47 2fbe n ASP 148 Ca 0.04 -1.00 -0.01 0.00 -0.71 0.00 0.00 54.79 53.11 2fbe n ASP 148 Cb 0.45 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 40.22 2fbe n ASP 148 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2fbe n GLY 149 N 0.00 0.43 3.74 6.12 0.00 0.39 -4.98 105.19 110.90 2fbe n GLY 149 Ca 0.00 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2fbe n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fbe s HIS 151 N -0.20 3.52 -0.18 0.00 5.65 -1.26 -0.73 115.29 122.10 2fbe s HIS 151 Ca 0.54 1.48 -0.17 0.00 0.25 0.00 0.00 55.06 57.16 2fbe s HIS 151 Cb -0.37 -3.34 -0.06 0.00 -1.18 0.00 0.00 32.58 27.64 2fbe s HIS 151 CO 0.41 -0.88 -0.33 -0.89 -0.65 0.00 0.00 174.74 172.39 2fbe n ILE 152 N 3.06 1.48 -3.52 0.89 5.41 0.29 -4.90 119.36 122.06 2fbe n ILE 152 Ca 0.05 0.15 -0.17 0.00 1.00 0.00 0.00 62.75 63.79 2fbe n ILE 152 Cb 0.46 -2.35 -0.05 0.00 -0.71 0.00 0.00 39.64 36.99 2fbe n ILE 152 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 2fbe s TYR 153 N -2.83 -0.60 -0.03 1.39 5.04 -1.23 -4.96 117.35 114.12 2fbe s TYR 153 Ca -0.27 0.92 0.02 0.00 -2.44 0.00 0.00 57.07 55.30 2fbe s TYR 153 Cb 0.04 0.42 0.01 0.00 0.35 0.00 0.00 41.96 42.77 2fbe s TYR 153 CO 0.41 -0.64 -0.09 0.99 -1.34 0.00 0.00 175.55 174.88 2fbe s THR 154 N -1.70 0.81 -0.12 4.34 2.01 -1.26 -0.85 115.64 118.87 2fbe s THR 154 Ca -0.09 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.46 2fbe s THR 154 Cb -0.00 -0.73 -0.05 0.00 0.01 0.00 0.00 72.50 71.73 2fbe s THR 154 CO 0.05 0.26 0.21 -0.36 -0.69 0.00 0.00 174.62 174.09 2fbe s PHE 155 N 0.31 3.56 0.27 4.92 0.40 0.45 -4.94 117.98 122.95 2fbe s PHE 155 Ca -0.05 0.59 0.11 0.00 -0.60 0.00 0.00 56.93 56.98 2fbe s PHE 155 Cb -0.10 -2.12 -0.05 0.00 0.51 0.00 0.00 43.02 41.26 2fbe s PHE 155 CO 0.01 0.55 -0.18 0.96 0.70 0.00 0.00 175.22 177.26 2fbe s ILE 156 N -0.51 2.29 -1.46 0.64 -4.36 -1.26 -1.68 121.20 114.86 2fbe s ILE 156 Ca 0.16 -2.34 -0.10 0.00 -0.26 0.00 0.00 60.65 58.10 2fbe s ILE 156 Cb -0.13 -2.29 0.05 0.00 1.25 0.00 0.00 42.46 41.35 2fbe s ILE 156 CO 0.05 -0.42 0.84 -0.62 0.24 0.00 0.00 174.94 175.03 2fbe n GLU 157 N -0.59 -5.40 -2.63 0.37 1.02 -0.09 -4.94 120.64 108.38 2fbe n GLU 157 Ca -0.06 0.68 -0.34 0.00 -0.02 0.00 0.00 57.16 57.43 2fbe n GLU 157 Cb 0.60 -5.57 -0.05 0.00 -0.02 0.00 0.00 31.44 26.41 2fbe n GLU 157 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2fbe s ILE 158 N -3.20 3.95 0.30 -3.67 -4.36 -0.27 -4.99 121.20 108.96 2fbe s ILE 158 Ca 0.52 1.28 -0.29 0.00 -0.26 0.00 0.00 60.65 61.90 2fbe s ILE 158 Cb -0.25 -3.55 -0.10 0.00 1.25 0.00 0.00 42.46 39.81 2fbe s ILE 158 CO 0.64 -0.20 1.26 -2.16 0.24 0.00 0.00 174.94 174.72 2fbe s PRO 159 N -3.04 4.43 -0.45 0.37 0.04 -1.26 -4.81 135.00 130.27 2fbe s PRO 159 Ca 0.64 2.10 0.09 0.00 0.04 0.00 0.00 61.00 63.86 2fbe s PRO 159 Cb -0.15 -3.12 0.39 0.00 0.04 0.00 0.00 34.50 31.66 2fbe s PRO 159 CO 0.19 -0.10 0.95 1.33 0.04 0.00 0.00 177.00 179.41 2fbe n VAL 160 N 1.15 1.84 0.76 -0.36 0.24 -1.26 -4.78 118.33 115.93 2fbe n VAL 160 Ca 0.01 -4.74 0.09 0.00 -2.04 0.00 0.00 64.34 57.65 2fbe n VAL 160 Cb 0.43 -0.76 -0.11 0.00 -1.47 0.00 0.00 33.84 31.93 2fbe n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2fbe s GLU 162 N -2.76 0.92 0.30 0.00 -1.05 -1.26 -5.14 118.70 109.71 2fbe s GLU 162 Ca 0.05 -0.53 -0.27 0.00 -0.15 0.00 0.00 54.97 54.07 2fbe s GLU 162 Cb 0.13 0.40 -0.14 0.00 -0.44 0.00 0.00 34.13 34.09 2fbe s GLU 162 CO 0.74 -0.32 0.92 -2.30 0.95 0.00 0.00 175.26 175.26 2fbe n PRO 163 N 0.31 1.16 -3.83 -4.83 -0.02 -1.26 -4.84 135.00 121.68 2fbe n PRO 163 Ca -0.18 0.41 -0.36 0.00 -2.02 0.00 0.00 63.50 61.36 2fbe n PRO 163 Cb 0.61 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.24 2fbe n PRO 163 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2fbe s TRP 164 N -1.11 3.26 -0.19 6.00 0.52 0.60 -2.49 118.94 125.53 2fbe s TRP 164 Ca 0.60 0.07 -0.07 0.00 0.02 0.00 0.00 56.10 56.72 2fbe s TRP 164 Cb -0.70 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 29.41 2fbe s TRP 164 CO 0.59 0.06 0.05 1.03 0.02 0.00 0.00 176.95 178.70 2fbe s ARG 165 N 0.79 3.87 0.15 4.98 1.81 0.08 -2.17 118.95 128.47 2fbe s ARG 165 Ca 0.05 -0.39 -0.34 0.00 -1.72 0.00 0.00 55.73 53.33 2fbe s ARG 165 Cb -0.13 -3.21 -0.14 0.00 -0.45 0.00 0.00 34.95 31.02 2fbe s ARG 165 CO 0.02 0.16 1.50 -2.30 -0.68 0.00 0.00 175.30 174.00 2fbe n PRO 166 N 3.86 1.90 -4.10 3.54 -0.02 -1.26 -1.38 135.00 137.54 2fbe n PRO 166 Ca -0.16 0.69 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 2fbe n PRO 166 Cb 0.52 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.52 2fbe n PRO 166 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2fbe s PHE 167 N 0.69 3.07 -0.08 6.00 5.36 0.25 -0.18 117.98 133.09 2fbe s PHE 167 Ca 0.79 0.01 -0.18 0.00 -0.96 0.00 0.00 56.93 56.59 2fbe s PHE 167 Cb -0.74 -1.56 0.04 0.00 -0.34 0.00 0.00 43.02 40.42 2fbe s PHE 167 CO 0.41 0.50 0.42 -0.06 -1.46 0.00 0.00 175.22 175.04 2fbe s PHE 168 N -1.40 -0.38 -0.04 10.12 0.08 -0.86 -2.86 117.98 122.65 2fbe s PHE 168 Ca 0.28 0.76 -0.21 0.00 0.12 0.00 0.00 56.93 57.87 2fbe s PHE 168 Cb -0.12 0.18 0.04 0.00 -0.57 0.00 0.00 43.02 42.55 2fbe s PHE 168 CO 0.20 -0.37 0.47 0.00 -0.10 0.00 0.00 175.22 175.42 2fbe s ALA 169 N -0.72 -1.21 -0.21 5.36 0.00 -0.64 -1.94 121.76 122.41 2fbe s ALA 169 Ca -0.08 0.80 -0.27 0.00 0.00 0.00 0.00 51.96 52.41 2fbe s ALA 169 Cb -0.04 -0.02 0.09 0.00 0.00 0.00 0.00 23.12 23.16 2fbe s ALA 169 CO 0.04 -0.30 0.84 -1.58 0.00 0.00 0.00 175.76 174.75 2fbe s HIS 170 N -1.16 -0.61 -0.02 0.00 5.04 -1.16 -2.80 115.29 114.58 2fbe s HIS 170 Ca -0.12 1.34 -0.00 0.00 -1.54 0.00 0.00 55.06 54.75 2fbe s HIS 170 Cb -0.03 0.35 0.02 0.00 0.04 0.00 0.00 32.58 32.97 2fbe s HIS 170 CO 0.06 -0.38 0.02 0.21 -2.34 0.00 0.00 174.74 172.31 2fbe s LYS 171 N -0.24 -0.03 0.97 2.88 2.20 -1.11 -4.38 119.74 120.02 2fbe s LYS 171 Ca -0.02 0.15 -0.11 0.00 -0.36 0.00 0.00 55.97 55.63 2fbe s LYS 171 Cb -0.03 -0.19 0.17 0.00 -1.51 0.00 0.00 37.83 36.27 2fbe s LYS 171 CO 0.01 -0.13 1.12 1.03 -0.36 0.00 0.00 175.35 177.02 2fbe s ARG 172 N 0.82 0.62 -0.14 4.03 0.52 -1.26 -4.20 118.95 119.34 2fbe s ARG 172 Ca -0.07 1.38 0.09 0.00 -0.52 0.00 0.00 55.73 56.61 2fbe s ARG 172 Cb -0.10 -1.69 -0.23 0.00 0.52 0.00 0.00 34.95 33.45 2fbe s ARG 172 CO -0.02 -2.85 0.28 0.41 0.02 0.00 0.00 175.30 173.13 2fbe n GLY 173 N 0.29 -0.81 3.75 -3.53 0.00 -1.26 -4.92 105.19 98.70 2fbe n GLY 173 Ca 0.10 -0.20 -0.08 0.00 0.00 0.00 0.00 46.02 45.83 2fbe n GLY 173 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fbe s SER 174 N -6.15 -0.08 0.39 1.61 1.04 -1.26 -5.00 113.70 104.25 2fbe s SER 174 Ca -0.15 -0.86 0.08 0.00 0.48 0.00 0.00 55.95 55.50 2fbe s SER 174 Cb 0.07 0.70 0.84 0.00 0.10 0.00 0.00 66.02 67.73 2fbe s SER 174 CO 0.78 -1.34 2.00 1.56 0.98 0.00 0.00 173.24 177.22 2fbe h GLN 175 N 2.08 0.60 0.00 4.02 4.20 -2.04 -2.16 115.11 121.81 2fbe h GLN 175 Ca -0.24 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.34 2fbe h GLN 175 Cb 1.25 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 2fbe h GLN 175 CO 0.31 0.40 -0.85 -0.44 -0.67 0.00 0.00 178.83 177.58 2fbe h ASP 176 N 0.62 0.00 -1.03 1.46 3.32 -2.03 -3.47 116.42 115.29 2fbe h ASP 176 Ca 0.24 0.00 -0.81 0.00 0.02 0.00 0.00 57.03 56.49 2fbe h ASP 176 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2fbe h ASP 176 CO -0.07 0.35 0.90 -0.67 -1.72 0.00 0.00 179.24 178.03 2fbe n ASP 177 N -2.98 1.58 -1.37 6.45 2.03 -0.82 -4.87 116.55 116.58 2fbe n ASP 177 Ca -0.02 1.03 0.08 0.00 0.52 0.00 0.00 54.79 56.40 2fbe n ASP 177 Cb 0.70 -0.99 0.32 0.00 -0.72 0.00 0.00 41.12 40.43 2fbe n ASP 177 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2fbe n GLN 178 N 5.24 3.65 -2.14 -0.67 6.02 -1.26 -4.87 117.38 123.35 2fbe n GLN 178 Ca 0.34 -2.82 -0.36 0.00 -0.01 0.00 0.00 57.00 54.15 2fbe n GLN 178 Cb 0.02 -1.86 0.01 0.00 1.02 0.00 0.00 30.24 29.43 2fbe n GLN 178 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2fbe s SER 179 N -1.12 5.63 0.07 1.08 1.04 -1.26 -5.05 113.70 114.08 2fbe s SER 179 Ca 0.46 2.33 -0.09 0.00 0.48 0.00 0.00 55.95 59.13 2fbe s SER 179 Cb 0.32 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2fbe s SER 179 CO 0.19 -1.29 0.19 0.27 0.98 0.00 0.00 173.24 173.58 2fbe s ILE 180 N -1.62 0.13 -0.18 -1.02 -4.36 -1.26 -4.81 121.20 108.08 2fbe s ILE 180 Ca 0.72 -1.06 -0.05 0.00 -0.26 0.00 0.00 60.65 60.00 2fbe s ILE 180 Cb -0.28 -1.16 -0.03 0.00 1.25 0.00 0.00 42.46 42.23 2fbe s ILE 180 CO 0.32 -0.58 0.00 -0.76 0.24 0.00 0.00 174.94 174.17 2fbe s LEU 181 N -2.53 3.40 -0.01 0.37 1.02 -0.79 -4.08 118.68 116.06 2fbe s LEU 181 Ca 0.01 -0.10 0.02 0.00 0.02 0.00 0.00 54.13 54.08 2fbe s LEU 181 Cb 0.02 -1.85 -0.01 0.00 0.02 0.00 0.00 46.19 44.38 2fbe s LEU 181 CO -0.08 0.13 -0.08 -0.94 0.02 0.00 0.00 176.35 175.40 2fbe s SER 182 N 0.62 0.94 0.47 2.29 1.04 -0.62 -0.85 113.70 117.60 2fbe s SER 182 Ca -0.00 -0.15 -0.18 0.00 0.48 0.00 0.00 55.95 56.11 2fbe s SER 182 Cb -0.14 -0.11 -0.09 0.00 0.10 0.00 0.00 66.02 65.79 2fbe s SER 182 CO 0.02 0.10 0.94 -0.63 0.98 0.00 0.00 173.24 174.65 2fbe s ILE 183 N -0.19 4.51 -0.38 -1.02 1.01 0.30 -1.11 121.20 124.33 2fbe s ILE 183 Ca 0.03 1.25 -0.09 0.00 0.00 0.00 0.00 60.65 61.84 2fbe s ILE 183 Cb -0.03 -3.67 0.05 0.00 0.01 0.00 0.00 42.46 38.81 2fbe s ILE 183 CO -0.00 -0.52 0.19 0.00 0.00 0.00 0.00 174.94 174.60 2fbe n SER 185 N 4.91 0.00 0.00 0.00 2.88 -1.26 -4.62 113.62 115.53 2fbe n SER 185 Ca -0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 2fbe n SER 185 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 2fbe n SER 185 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2fbe n VAL 186 N 0.00 0.00 -3.83 2.46 0.24 -1.26 -4.81 118.33 111.12 2fbe n VAL 186 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 2fbe n VAL 186 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2fbe n VAL 186 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2fbe s ILE 187 N -0.57 0.00 0.00 1.34 -4.36 -1.26 -5.12 121.20 111.23 2fbe s ILE 187 Ca 0.00 -1.02 0.00 0.00 -0.26 0.00 0.00 60.65 59.37 2fbe s ILE 187 Cb 0.00 -2.53 0.00 0.00 1.25 0.00 0.00 42.46 41.18 2fbe s ILE 187 CO 0.00 0.00 0.00 -3.20 0.24 0.00 0.00 174.94 171.98