#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbc n ASP 2 N 0.00 -6.67 -4.82 1.67 8.00 -1.26 -4.70 116.55 108.77 2wbc n ASP 2 Ca 0.00 0.03 -0.22 0.00 0.71 0.00 0.00 54.79 55.31 2wbc n ASP 2 Cb 0.00 -3.57 -0.05 0.00 -0.02 0.00 0.00 41.12 37.48 2wbc n ASP 2 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2wbc s ASP 3 N -2.29 4.95 0.26 -2.24 1.01 -1.26 -0.07 116.67 117.03 2wbc s ASP 3 Ca 0.24 -0.73 -0.30 0.00 0.71 0.00 0.00 52.55 52.47 2wbc s ASP 3 Cb -0.04 -0.70 -0.09 0.00 1.01 0.00 0.00 42.92 43.09 2wbc s ASP 3 CO 0.82 -0.48 1.04 -0.76 0.21 0.00 0.00 175.17 176.00 2wbc s LEU 4 N -4.00 4.59 0.01 1.23 2.01 0.14 -4.65 118.68 118.02 2wbc s LEU 4 Ca 0.43 2.14 0.08 0.00 0.01 0.00 0.00 54.13 56.79 2wbc s LEU 4 Cb -0.03 -3.62 -0.02 0.00 0.01 0.00 0.00 46.19 42.53 2wbc s LEU 4 CO 0.26 -0.02 -0.25 -0.69 1.01 0.00 0.00 176.35 176.66 2wbc s VAL 5 N -1.16 1.97 0.83 -1.59 1.01 -1.26 -1.26 120.40 118.94 2wbc s VAL 5 Ca 0.43 -1.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2wbc s VAL 5 Cb -0.30 -1.65 0.18 0.00 0.00 0.00 0.00 36.38 34.61 2wbc s VAL 5 CO 0.37 0.45 1.14 -0.90 0.00 0.00 0.00 175.10 176.16 2wbc n ASP 6 N 2.19 0.91 0.34 3.32 5.68 0.13 -4.75 116.55 124.36 2wbc n ASP 6 Ca -0.16 -1.91 0.21 0.00 -0.50 0.00 0.00 54.79 52.42 2wbc n ASP 6 Cb 0.52 -0.79 1.11 0.00 -1.14 0.00 0.00 41.12 40.82 2wbc n ASP 6 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wbc h ALA 7 N -1.05 1.09 -0.47 2.12 0.00 -1.65 -2.47 119.26 116.84 2wbc h ALA 7 Ca -0.37 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 2wbc h ALA 7 Cb 1.23 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2wbc h ALA 7 CO 0.34 -0.09 0.09 0.39 0.00 0.00 0.00 179.25 179.98 2wbc n GLU 8 N -3.02 2.95 -0.91 0.00 1.02 -1.26 -4.94 120.64 114.48 2wbc n GLU 8 Ca -0.03 -3.02 0.00 0.00 -0.02 0.00 0.00 57.16 54.09 2wbc n GLU 8 Cb 0.16 -1.98 0.00 0.00 -0.02 0.00 0.00 31.44 29.59 2wbc n GLU 8 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wbc n GLY 9 N -0.54 0.79 3.88 0.62 0.00 -0.93 -5.01 105.19 104.01 2wbc n GLY 9 Ca 0.32 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.02 2wbc n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wbc s ASN 10 N -2.78 6.56 0.20 1.61 0.01 -1.26 -4.82 114.94 114.47 2wbc s ASN 10 Ca 0.00 0.72 -0.30 0.00 -0.71 0.00 0.00 52.86 52.57 2wbc s ASN 10 Cb 0.00 -2.14 -0.09 0.00 0.41 0.00 0.00 41.25 39.42 2wbc s ASN 10 CO 0.00 0.06 1.41 -0.76 -1.51 0.00 0.00 177.10 176.29 2wbc s LEU 11 N -2.48 4.39 0.04 0.60 1.02 -1.26 0.19 118.68 121.19 2wbc s LEU 11 Ca 0.40 2.52 -0.30 0.00 0.02 0.00 0.00 54.13 56.77 2wbc s LEU 11 Cb -0.12 -3.61 -0.07 0.00 0.02 0.00 0.00 46.19 42.41 2wbc s LEU 11 CO 0.22 -0.65 1.48 -0.69 0.02 0.00 0.00 176.35 176.73 2wbc s VAL 12 N 0.35 3.44 0.38 -1.59 1.01 -0.39 -4.80 120.40 118.79 2wbc s VAL 12 Ca 0.61 0.87 -0.25 0.00 0.00 0.00 0.00 61.98 63.21 2wbc s VAL 12 Cb -0.40 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 32.33 2wbc s VAL 12 CO 0.38 0.01 1.08 -1.61 0.00 0.00 0.00 175.10 174.95 2wbc s GLU 13 N 2.31 4.23 -0.25 2.72 2.02 -1.26 -3.18 118.70 125.29 2wbc s GLU 13 Ca 0.67 1.62 -0.29 0.00 0.02 0.00 0.00 54.97 56.99 2wbc s GLU 13 Cb -0.35 -2.69 0.01 0.00 0.10 0.00 0.00 34.13 31.21 2wbc s GLU 13 CO 0.29 -0.10 1.06 1.21 0.02 0.00 0.00 175.26 177.73 2wbc s ASN 14 N -1.37 7.06 0.00 -0.19 3.84 0.90 -2.35 114.94 122.83 2wbc s ASN 14 Ca 0.55 1.32 0.00 0.00 0.21 0.00 0.00 52.86 54.94 2wbc s ASN 14 Cb -0.25 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 37.91 2wbc s ASN 14 CO 0.32 -0.72 0.00 0.61 -2.79 0.00 0.00 177.10 174.52 2wbc n GLY 15 N 3.45 0.73 3.85 1.21 0.00 0.18 -4.94 105.19 109.67 2wbc n GLY 15 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2wbc n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wbc s GLY 16 N -1.45 1.64 -0.12 -0.02 0.00 -0.99 -4.57 107.32 101.80 2wbc s GLY 16 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 44.72 44.49 2wbc s GLY 16 CO 0.00 0.16 0.03 -0.51 0.00 0.00 0.00 173.10 172.78 2wbc s THR 17 N -3.23 4.55 0.10 0.90 -4.23 -1.26 -1.12 115.64 111.36 2wbc s THR 17 Ca 0.58 -0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 60.94 2wbc s THR 17 Cb -0.12 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 2wbc s THR 17 CO 0.53 0.56 0.01 -0.31 -0.54 0.00 0.00 174.62 174.87 2wbc s TYR 18 N -0.45 0.75 -0.16 3.99 1.51 0.96 -1.29 117.35 122.66 2wbc s TYR 18 Ca 0.09 -1.14 -0.06 0.00 -1.01 0.00 0.00 57.07 54.95 2wbc s TYR 18 Cb -0.12 -0.46 -0.04 0.00 -0.11 0.00 0.00 41.96 41.23 2wbc s TYR 18 CO 0.02 -0.42 0.05 0.71 -1.11 0.00 0.00 175.55 174.80 2wbc s TYR 19 N -3.95 3.25 -0.55 2.71 2.02 0.65 0.10 117.35 121.59 2wbc s TYR 19 Ca 0.17 0.11 -0.14 0.00 -0.37 0.00 0.00 57.07 56.83 2wbc s TYR 19 Cb 0.07 -2.00 0.14 0.00 -0.40 0.00 0.00 41.96 39.77 2wbc s TYR 19 CO -0.03 0.26 0.49 -0.51 -1.57 0.00 0.00 175.55 174.19 2wbc s LEU 20 N -0.01 6.14 0.20 -1.29 1.02 -1.26 -1.14 118.68 122.32 2wbc s LEU 20 Ca 0.06 -1.89 0.04 0.00 0.02 0.00 0.00 54.13 52.36 2wbc s LEU 20 Cb -0.12 -2.17 -0.03 0.00 0.02 0.00 0.00 46.19 43.88 2wbc s LEU 20 CO 0.01 -0.80 0.26 -0.76 0.02 0.00 0.00 176.35 175.08 2wbc s LEU 21 N 1.43 4.14 0.65 1.79 2.01 -0.79 -3.63 118.68 124.29 2wbc s LEU 21 Ca 0.05 0.01 -0.14 0.00 0.01 0.00 0.00 54.13 54.06 2wbc s LEU 21 Cb -0.28 -2.70 -0.01 0.00 0.01 0.00 0.00 46.19 43.21 2wbc s LEU 21 CO 0.01 0.00 1.07 -2.84 1.01 0.00 0.00 176.35 175.61 2wbc s PRO 22 N -3.53 3.00 -0.04 1.29 0.02 -1.26 -0.60 135.00 133.88 2wbc s PRO 22 Ca 0.33 1.15 -0.22 0.00 0.02 0.00 0.00 61.00 62.28 2wbc s PRO 22 Cb -0.10 -1.99 -0.16 0.00 0.02 0.00 0.00 34.50 32.27 2wbc s PRO 22 CO 0.27 -1.06 0.96 1.25 -0.33 0.00 0.00 177.00 178.09 2wbc h HIS 23 N -0.15 -0.21 -3.61 6.54 -0.00 -1.86 -3.41 115.15 112.44 2wbc h HIS 23 Ca -0.45 -0.01 -0.63 0.00 -0.00 0.00 0.00 60.37 59.28 2wbc h HIS 23 Cb 1.22 0.07 -0.13 0.00 -0.00 0.00 0.00 27.41 28.57 2wbc h HIS 23 CO 0.59 0.22 0.31 0.42 -0.00 0.00 0.00 177.93 179.47 2wbc s ILE 24 N -3.68 4.70 0.24 6.26 -1.09 -1.26 -4.93 121.20 121.44 2wbc s ILE 24 Ca -0.13 0.43 -0.14 0.00 -2.23 0.00 0.00 60.65 58.57 2wbc s ILE 24 Cb 0.01 -4.28 0.30 0.00 -1.58 0.00 0.00 42.46 36.91 2wbc s ILE 24 CO 0.50 -0.66 1.57 -0.50 -1.23 0.00 0.00 174.94 174.62 2wbc h TRP 25 N 8.90 -0.81 0.00 3.97 6.55 -1.91 -0.19 115.95 132.45 2wbc h TRP 25 Ca -0.25 0.09 0.00 0.00 0.95 0.00 0.00 58.89 59.68 2wbc h TRP 25 Cb 1.09 0.49 0.00 0.00 -0.86 0.00 0.00 29.16 29.88 2wbc h TRP 25 CO 0.78 -0.40 0.08 0.00 -1.05 0.00 0.00 178.44 177.86 2wbc n ALA 26 N -3.45 0.86 0.71 1.49 0.00 -1.26 -2.86 120.51 116.01 2wbc n ALA 26 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.64 2wbc n ALA 26 Cb 0.42 -0.72 0.25 0.00 0.00 0.00 0.00 19.45 19.41 2wbc n ALA 26 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2wbc n HIS 27 N -1.16 0.48 0.00 0.00 8.25 -0.08 -5.04 115.22 117.67 2wbc n HIS 27 Ca 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 2wbc n HIS 27 Cb 0.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 2wbc n HIS 27 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wbc n GLY 28 N 1.23 0.43 0.00 -1.41 0.00 -1.14 -4.95 105.19 99.36 2wbc n GLY 28 Ca 0.16 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.97 2wbc n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbc n GLY 29 N 0.00 3.29 0.00 -0.02 0.00 0.16 -4.27 105.19 104.34 2wbc n GLY 29 Ca 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2wbc n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbc n GLY 30 N 5.00 -1.25 3.87 -0.02 0.00 0.24 -4.37 105.19 108.66 2wbc n GLY 30 Ca 0.00 -1.64 -0.35 0.00 0.00 0.00 0.00 46.02 44.03 2wbc n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wbc s ILE 31 N -0.86 5.15 0.09 -0.61 -1.09 -1.24 0.13 121.20 122.78 2wbc s ILE 31 Ca 0.00 0.40 -0.03 0.00 -2.23 0.00 0.00 60.65 58.79 2wbc s ILE 31 Cb 0.00 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.27 2wbc s ILE 31 CO 0.00 0.34 0.18 -1.84 -1.23 0.00 0.00 174.94 172.39 2wbc n GLU 32 N 1.07 0.25 -4.31 2.79 0.28 -0.34 0.53 120.64 120.92 2wbc n GLU 32 Ca -0.10 -0.56 -0.24 0.00 -0.16 0.00 0.00 57.16 56.11 2wbc n GLU 32 Cb 0.52 0.66 -0.08 0.00 1.43 0.00 0.00 31.44 33.98 2wbc n GLU 32 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2wbc s THR 33 N -2.74 3.00 0.06 3.84 -4.23 -1.26 -0.65 115.64 113.67 2wbc s THR 33 Ca 0.04 -1.97 -0.07 0.00 -1.18 0.00 0.00 61.69 58.51 2wbc s THR 33 Cb -0.01 -2.77 -0.01 0.00 1.34 0.00 0.00 72.50 71.05 2wbc s THR 33 CO 0.03 -0.30 0.14 0.00 -0.54 0.00 0.00 174.62 173.95 2wbc s ALA 34 N -2.42 -0.10 -0.21 3.99 0.00 0.16 -4.88 121.76 118.29 2wbc s ALA 34 Ca 0.33 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 51.54 2wbc s ALA 34 Cb -0.04 0.37 -0.05 0.00 0.00 0.00 0.00 23.12 23.40 2wbc s ALA 34 CO 0.19 -0.42 0.20 0.21 0.00 0.00 0.00 175.76 175.94 2wbc s LYS 35 N -3.37 4.15 0.00 0.00 2.20 -1.26 -0.60 119.74 120.86 2wbc s LYS 35 Ca 0.01 -0.15 -0.08 0.00 -0.36 0.00 0.00 55.97 55.40 2wbc s LYS 35 Cb 0.03 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 2wbc s LYS 35 CO -0.08 0.15 0.15 0.99 -0.36 0.00 0.00 175.35 176.20 2wbc s THR 36 N 0.79 0.08 0.00 3.43 2.01 -1.26 -4.96 115.64 115.74 2wbc s THR 36 Ca 0.10 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2wbc s THR 36 Cb -0.13 -0.48 0.00 0.00 0.01 0.00 0.00 72.50 71.90 2wbc s THR 36 CO 0.03 -0.39 0.00 0.61 -0.69 0.00 0.00 174.62 174.18 2wbc n GLY 37 N 1.37 3.08 0.54 4.40 0.00 -1.26 -1.78 105.19 111.54 2wbc n GLY 37 Ca -0.22 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.67 2wbc n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wbc n ASN 38 N 4.72 1.59 -4.62 1.61 5.03 -1.26 -4.97 115.26 117.37 2wbc n ASN 38 Ca 0.00 -1.77 -0.45 0.00 0.87 0.00 0.00 54.58 53.23 2wbc n ASN 38 Cb 0.00 -0.13 -0.02 0.00 -1.02 0.00 0.00 39.78 38.61 2wbc n ASN 38 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2wbc n GLU 39 N 0.29 1.54 0.22 3.52 1.02 -0.73 -4.91 120.64 121.59 2wbc n GLU 39 Ca 0.15 0.54 0.11 0.00 -0.02 0.00 0.00 57.16 57.94 2wbc n GLU 39 Cb 0.30 -2.03 0.24 0.00 -0.02 0.00 0.00 31.44 29.93 2wbc n GLU 39 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2wbc h PRO 40 N 2.90 0.00 0.00 3.49 0.13 -1.93 -3.44 132.00 133.15 2wbc h PRO 40 Ca -0.42 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 2wbc h PRO 40 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2wbc h PRO 40 CO 0.67 0.10 0.23 0.00 -0.23 0.00 0.00 178.00 178.77 2wbc s PRO 42 N -2.17 2.62 0.00 0.00 0.02 -1.26 -4.44 135.00 129.78 2wbc s PRO 42 Ca 0.17 0.91 0.00 0.00 0.02 0.00 0.00 61.00 62.10 2wbc s PRO 42 Cb -0.05 -4.40 0.00 0.00 0.02 0.00 0.00 34.50 30.07 2wbc s PRO 42 CO 0.13 -2.72 0.31 1.28 -0.33 0.00 0.00 177.00 175.67 2wbc n LEU 43 N 13.06 0.62 -4.76 -5.54 4.32 0.23 -4.58 117.00 120.35 2wbc n LEU 43 Ca 0.24 -0.78 -0.36 0.00 -0.02 0.00 0.00 56.01 55.09 2wbc n LEU 43 Cb 0.52 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.24 2wbc n LEU 43 CO 0.71 0.15 -0.16 0.42 -1.22 0.00 0.00 177.39 177.29 2wbc s THR 44 N -0.33 5.41 -0.11 -5.08 -4.23 -0.47 -0.79 115.64 110.04 2wbc s THR 44 Ca 0.00 0.24 -0.25 0.00 -1.18 0.00 0.00 61.69 60.50 2wbc s THR 44 Cb 0.00 -3.48 -0.03 0.00 1.34 0.00 0.00 72.50 70.34 2wbc s THR 44 CO 0.00 0.47 0.79 -0.69 -0.54 0.00 0.00 174.62 174.65 2wbc s VAL 45 N 0.11 4.95 0.06 2.29 1.01 -1.22 -0.66 120.40 126.95 2wbc s VAL 45 Ca 0.10 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.67 2wbc s VAL 45 Cb -0.11 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2wbc s VAL 45 CO -0.00 0.14 -0.05 0.68 0.00 0.00 0.00 175.10 175.87 2wbc s VAL 46 N 1.46 0.39 -0.03 2.92 -7.23 0.18 -1.57 120.40 116.51 2wbc s VAL 46 Ca 0.39 -1.70 -0.21 0.00 -1.81 0.00 0.00 61.98 58.65 2wbc s VAL 46 Cb -0.18 -1.37 -0.05 0.00 0.56 0.00 0.00 36.38 35.35 2wbc s VAL 46 CO 0.16 -0.86 0.60 -0.60 -0.31 0.00 0.00 175.10 174.09 2wbc s ARG 47 N -3.45 4.34 0.22 4.82 3.52 0.70 -1.20 118.95 127.89 2wbc s ARG 47 Ca 0.05 0.73 -0.30 0.00 -0.13 0.00 0.00 55.73 56.07 2wbc s ARG 47 Cb 0.04 -3.37 -0.09 0.00 -1.56 0.00 0.00 34.95 29.97 2wbc s ARG 47 CO -0.07 0.29 1.36 0.45 -0.81 0.00 0.00 175.30 176.53 2wbc s SER 48 N 0.06 6.80 0.00 -2.12 0.15 0.12 -4.32 113.70 114.39 2wbc s SER 48 Ca 0.32 2.50 0.21 0.00 0.70 0.00 0.00 55.95 59.68 2wbc s SER 48 Cb -0.18 -2.62 1.02 0.00 -1.71 0.00 0.00 66.02 62.53 2wbc s SER 48 CO 0.17 -0.59 1.68 -0.81 1.20 0.00 0.00 173.24 174.89 2wbc n PRO 49 N 2.50 1.31 -3.68 5.44 -0.04 -1.26 0.36 135.00 139.62 2wbc n PRO 49 Ca 0.06 -0.46 -0.39 0.00 -0.04 0.00 0.00 63.50 62.67 2wbc n PRO 49 Cb 0.42 -1.35 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 2wbc n PRO 49 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2wbc s ASN 50 N -1.62 5.49 0.57 3.54 0.02 -1.26 -4.61 114.94 117.06 2wbc s ASN 50 Ca 0.31 -1.24 0.32 0.00 -1.02 0.00 0.00 52.86 51.23 2wbc s ASN 50 Cb 0.15 -1.93 1.42 0.00 0.02 0.00 0.00 41.25 40.92 2wbc s ASN 50 CO 0.25 -0.40 1.76 -0.33 0.02 0.00 0.00 177.10 178.40 2wbc h GLU 51 N 8.31 0.00 0.00 -0.60 5.08 -1.85 -1.34 114.58 124.17 2wbc h GLU 51 Ca -0.23 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.02 2wbc h GLU 51 Cb 1.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 2wbc h GLU 51 CO 0.66 0.00 -0.50 -0.39 -1.00 0.00 0.00 179.01 177.78 2wbc h VAL 52 N 0.00 1.07 -3.48 3.13 -1.51 -1.94 -3.44 116.25 110.09 2wbc h VAL 52 Ca 0.41 -1.91 -0.53 0.00 -1.23 0.00 0.00 66.70 63.44 2wbc h VAL 52 Cb 1.92 2.12 -0.03 0.00 -2.13 0.00 0.00 31.29 33.18 2wbc h VAL 52 CO -0.00 0.49 0.31 -0.55 -1.23 0.00 0.00 177.57 176.58 2wbc s SER 53 N -6.55 7.37 0.00 4.19 0.15 -0.51 -4.94 113.70 113.41 2wbc s SER 53 Ca 0.00 1.64 0.28 0.00 0.70 0.00 0.00 55.95 58.58 2wbc s SER 53 Cb 0.11 -2.55 1.07 0.00 -1.71 0.00 0.00 66.02 62.94 2wbc s SER 53 CO 0.72 -0.12 1.75 0.29 1.20 0.00 0.00 173.24 177.09 2wbc n LYS 54 N 3.23 1.23 0.00 5.44 5.02 -1.26 -0.59 118.16 131.22 2wbc n LYS 54 Ca 0.02 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.68 2wbc n LYS 54 Cb 0.50 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 2wbc n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wbc n GLY 55 N 1.22 -0.23 3.87 0.72 0.00 -1.26 -4.06 105.19 105.45 2wbc n GLY 55 Ca 0.17 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 2wbc n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wbc s GLU 56 N 0.00 3.75 0.35 1.61 0.41 0.19 -4.88 118.70 120.13 2wbc s GLU 56 Ca 0.00 0.16 -0.28 0.00 -0.41 0.00 0.00 54.97 54.44 2wbc s GLU 56 Cb 0.00 -2.99 -0.10 0.00 -1.78 0.00 0.00 34.13 29.26 2wbc s GLU 56 CO 0.00 0.56 1.25 -2.14 -0.49 0.00 0.00 175.26 174.44 2wbc s PRO 57 N -1.95 4.27 -0.07 0.39 0.02 -1.26 -4.64 135.00 131.77 2wbc s PRO 57 Ca 0.33 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.47 2wbc s PRO 57 Cb -0.14 -2.96 0.01 0.00 0.02 0.00 0.00 34.50 31.43 2wbc s PRO 57 CO 0.18 -0.21 -0.15 0.42 -0.33 0.00 0.00 177.00 176.91 2wbc s ILE 58 N -1.21 1.36 -0.12 2.83 1.01 0.28 -1.52 121.20 123.84 2wbc s ILE 58 Ca 0.51 -0.63 -0.24 0.00 0.00 0.00 0.00 60.65 60.29 2wbc s ILE 58 Cb -0.37 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2wbc s ILE 58 CO 0.48 0.40 0.75 -0.60 0.00 0.00 0.00 174.94 175.98 2wbc s ARG 59 N 0.47 4.36 -0.29 2.79 3.52 0.27 -0.03 118.95 130.05 2wbc s ARG 59 Ca -0.13 0.92 -0.07 0.00 -0.13 0.00 0.00 55.73 56.31 2wbc s ARG 59 Cb -0.15 -3.51 -0.00 0.00 -1.56 0.00 0.00 34.95 29.73 2wbc s ARG 59 CO 0.04 -0.13 0.08 0.42 -0.81 0.00 0.00 175.30 174.91 2wbc s ILE 60 N 1.45 4.08 -0.07 4.11 1.01 -0.27 -2.65 121.20 128.86 2wbc s ILE 60 Ca 0.37 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.49 2wbc s ILE 60 Cb -0.17 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.24 2wbc s ILE 60 CO 0.15 0.14 -0.17 -0.44 0.00 0.00 0.00 174.94 174.62 2wbc s SER 61 N 1.53 2.30 0.41 3.58 0.01 -0.79 0.49 113.70 121.23 2wbc s SER 61 Ca 0.04 -0.39 0.08 0.00 1.31 0.00 0.00 55.95 56.98 2wbc s SER 61 Cb -0.17 -0.91 -0.01 0.00 0.21 0.00 0.00 66.02 65.14 2wbc s SER 61 CO 0.03 0.11 0.41 -0.94 0.41 0.00 0.00 173.24 173.26 2wbc s SER 62 N 0.35 5.22 0.39 2.44 1.04 -1.26 -0.53 113.70 121.34 2wbc s SER 62 Ca -0.12 -0.64 0.28 0.00 0.48 0.00 0.00 55.95 55.95 2wbc s SER 62 Cb -0.15 -0.65 1.26 0.00 0.10 0.00 0.00 66.02 66.58 2wbc s SER 62 CO 0.05 -0.64 1.84 0.06 0.98 0.00 0.00 173.24 175.53 2wbc h GLN 63 N 0.97 0.00 -6.20 4.02 3.07 -1.96 -3.46 115.11 111.55 2wbc h GLN 63 Ca -0.42 0.00 -0.49 0.00 0.09 0.00 0.00 58.65 57.83 2wbc h GLN 63 Cb 1.27 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.79 2wbc h GLN 63 CO 0.55 0.00 -0.49 -0.06 0.09 0.00 0.00 178.83 178.92 2wbc s PHE 64 N -3.53 3.12 -1.05 0.06 0.08 -1.26 -5.03 117.98 110.37 2wbc s PHE 64 Ca 0.01 -0.14 -0.14 0.00 0.12 0.00 0.00 56.93 56.78 2wbc s PHE 64 Cb 0.09 -1.52 0.19 0.00 -0.57 0.00 0.00 43.02 41.21 2wbc s PHE 64 CO 0.40 0.43 1.17 -0.51 -0.10 0.00 0.00 175.22 176.61 2wbc s LEU 65 N -3.90 5.59 0.01 -0.37 1.43 -1.26 -4.92 118.68 115.25 2wbc s LEU 65 Ca 0.35 -2.79 -0.01 0.00 -1.03 0.00 0.00 54.13 50.64 2wbc s LEU 65 Cb -0.08 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.80 2wbc s LEU 65 CO 0.26 -0.72 0.01 -0.55 0.23 0.00 0.00 176.35 175.58 2wbc s SER 66 N 2.65 0.14 0.37 2.29 0.15 -1.26 -5.04 113.70 112.99 2wbc s SER 66 Ca 0.33 -0.31 0.17 0.00 0.70 0.00 0.00 55.95 56.85 2wbc s SER 66 Cb -0.06 0.11 0.69 0.00 -1.71 0.00 0.00 66.02 65.04 2wbc s SER 66 CO -0.06 -0.23 1.75 -0.07 1.20 0.00 0.00 173.24 175.83 2wbc h LEU 67 N 4.98 0.00 -9.31 3.45 4.07 -1.93 -3.41 115.31 113.15 2wbc h LEU 67 Ca -0.30 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.15 2wbc h LEU 67 Cb 1.21 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.81 2wbc h LEU 67 CO 0.43 0.40 -0.61 -0.36 -1.08 0.00 0.00 178.44 177.21 2wbc s PHE 68 N -3.74 2.09 -0.28 1.13 0.08 -1.26 -0.07 117.98 115.93 2wbc s PHE 68 Ca -0.01 -0.86 -0.05 0.00 0.12 0.00 0.00 56.93 56.13 2wbc s PHE 68 Cb 0.12 -1.38 0.01 0.00 -0.57 0.00 0.00 43.02 41.21 2wbc s PHE 68 CO 0.70 0.14 0.04 0.42 -0.10 0.00 0.00 175.22 176.42 2wbc s ILE 69 N -3.13 3.67 0.40 0.64 1.01 -1.19 -4.74 121.20 117.87 2wbc s ILE 69 Ca 0.35 -0.78 -0.23 0.00 0.00 0.00 0.00 60.65 59.99 2wbc s ILE 69 Cb 0.08 -2.89 -0.10 0.00 0.01 0.00 0.00 42.46 39.56 2wbc s ILE 69 CO 0.16 0.11 0.98 -2.16 0.00 0.00 0.00 174.94 174.03 2wbc s PRO 70 N 1.45 4.24 0.56 2.79 0.04 -1.26 0.29 135.00 143.10 2wbc s PRO 70 Ca 0.02 1.30 -0.20 0.00 0.04 0.00 0.00 61.00 62.16 2wbc s PRO 70 Cb -0.17 -2.41 -0.05 0.00 0.04 0.00 0.00 34.50 31.91 2wbc s PRO 70 CO 0.01 -0.04 1.17 1.03 0.04 0.00 0.00 177.00 179.21 2wbc s ARG 71 N -2.75 3.22 0.00 4.56 0.52 0.89 -2.40 118.95 122.99 2wbc s ARG 71 Ca 0.59 1.73 0.00 0.00 -0.52 0.00 0.00 55.73 57.53 2wbc s ARG 71 Cb -0.16 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.30 2wbc s ARG 71 CO 0.20 -0.98 0.00 0.41 0.02 0.00 0.00 175.30 174.95 2wbc n GLY 72 N 0.35 1.26 3.80 -3.53 0.00 -1.26 -4.95 105.19 100.86 2wbc n GLY 72 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2wbc n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wbc s SER 73 N -1.75 6.69 0.40 1.61 0.15 -1.01 -5.07 113.70 114.73 2wbc s SER 73 Ca 0.00 0.82 -0.24 0.00 0.70 0.00 0.00 55.95 57.23 2wbc s SER 73 Cb 0.00 -2.23 -0.09 0.00 -1.71 0.00 0.00 66.02 61.99 2wbc s SER 73 CO 0.00 0.24 1.08 -0.76 1.20 0.00 0.00 173.24 175.00 2wbc s LEU 74 N -0.53 4.15 0.16 3.45 1.02 -1.26 -4.66 118.68 121.01 2wbc s LEU 74 Ca 0.22 2.12 0.06 0.00 0.02 0.00 0.00 54.13 56.55 2wbc s LEU 74 Cb -0.15 -4.15 -0.04 0.00 0.02 0.00 0.00 46.19 41.87 2wbc s LEU 74 CO 0.10 -0.55 -0.14 0.68 0.02 0.00 0.00 176.35 176.47 2wbc s VAL 75 N -1.59 1.49 -0.04 -1.59 -7.23 0.55 -3.51 120.40 108.48 2wbc s VAL 75 Ca 0.58 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.78 2wbc s VAL 75 Cb -0.24 -1.82 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 2wbc s VAL 75 CO 0.30 -0.55 -0.11 0.00 -0.31 0.00 0.00 175.10 174.44 2wbc s ALA 76 N -2.70 2.83 -0.03 1.32 0.00 0.31 -2.93 121.76 120.56 2wbc s ALA 76 Ca 0.16 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.22 2wbc s ALA 76 Cb -0.02 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.01 2wbc s ALA 76 CO 0.04 0.57 -0.24 -0.51 0.00 0.00 0.00 175.76 175.63 2wbc s LEU 77 N -0.92 2.04 -0.07 0.00 1.43 -1.26 -1.89 118.68 118.01 2wbc s LEU 77 Ca 0.13 -0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 52.56 2wbc s LEU 77 Cb -0.11 -1.27 0.05 0.00 0.03 0.00 0.00 46.19 44.89 2wbc s LEU 77 CO 0.02 0.27 0.48 -0.83 0.23 0.00 0.00 176.35 176.52 2wbc s GLY 78 N -0.38 -0.35 0.34 -3.19 0.00 -1.08 -0.02 107.32 102.64 2wbc s GLY 78 Ca 0.04 0.93 -0.27 0.00 0.00 0.00 0.00 44.72 45.42 2wbc s GLY 78 CO 0.01 0.67 1.10 -1.36 0.00 0.00 0.00 173.10 173.52 2wbc s PHE 79 N -0.89 3.38 0.18 1.90 0.08 -0.76 -0.56 117.98 121.31 2wbc s PHE 79 Ca -0.09 1.65 0.20 0.00 0.12 0.00 0.00 56.93 58.81 2wbc s PHE 79 Cb -0.03 -3.26 0.78 0.00 -0.57 0.00 0.00 43.02 39.95 2wbc s PHE 79 CO 0.05 -0.72 1.78 0.00 -0.10 0.00 0.00 175.22 176.23 2wbc h ALA 80 N 3.17 1.03 -2.75 5.36 0.00 -1.63 -3.35 119.26 121.10 2wbc h ALA 80 Ca -0.48 -0.29 -0.60 0.00 0.00 0.00 0.00 54.91 53.54 2wbc h ALA 80 Cb 1.22 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 18.56 2wbc h ALA 80 CO 0.65 0.40 -0.79 -0.80 0.00 0.00 0.00 179.25 178.71 2wbc s ASN 81 N -6.38 3.09 0.69 0.00 0.02 -1.26 -5.10 114.94 105.99 2wbc s ASN 81 Ca -0.00 -3.07 -0.14 0.00 -1.02 0.00 0.00 52.86 48.63 2wbc s ASN 81 Cb 0.11 -0.92 0.01 0.00 0.02 0.00 0.00 41.25 40.47 2wbc s ASN 81 CO 0.67 -0.19 1.11 -2.84 0.02 0.00 0.00 177.10 175.87 2wbc s PRO 82 N -0.16 2.67 0.15 -0.60 0.02 -1.26 -4.99 135.00 130.82 2wbc s PRO 82 Ca 0.25 1.35 -0.30 0.00 0.02 0.00 0.00 61.00 62.31 2wbc s PRO 82 Cb -0.09 -1.94 -0.08 0.00 0.02 0.00 0.00 34.50 32.42 2wbc s PRO 82 CO -0.11 -1.35 1.25 -2.14 -0.33 0.00 0.00 177.00 174.32 2wbc s PRO 83 N -4.27 4.43 -0.57 5.54 0.02 -1.26 -4.91 135.00 133.98 2wbc s PRO 83 Ca 0.66 1.91 -0.27 0.00 0.02 0.00 0.00 61.00 63.32 2wbc s PRO 83 Cb -0.20 -3.26 -0.01 0.00 0.02 0.00 0.00 34.50 31.05 2wbc s PRO 83 CO 0.45 -0.21 1.72 0.45 -0.33 0.00 0.00 177.00 179.07 2wbc s SER 84 N 0.53 5.61 0.00 2.53 0.15 -1.26 -0.94 113.70 120.32 2wbc s SER 84 Ca 0.57 0.42 0.00 0.00 0.70 0.00 0.00 55.95 57.64 2wbc s SER 84 Cb -0.33 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.44 2wbc s SER 84 CO 0.34 -2.09 0.00 0.00 1.20 0.00 0.00 173.24 172.69 2wbc s ALA 86 N 0.00 3.42 0.17 0.00 0.00 -0.12 -4.26 121.76 120.98 2wbc s ALA 86 Ca 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 51.96 51.99 2wbc s ALA 86 Cb 0.00 -2.86 0.03 0.00 0.00 0.00 0.00 23.12 20.29 2wbc s ALA 86 CO 0.00 0.09 1.58 0.00 0.00 0.00 0.00 175.76 177.43 2wbc h ALA 87 N 5.83 0.74 -2.39 0.00 0.00 -0.59 -3.46 119.26 119.40 2wbc h ALA 87 Ca -0.44 -0.36 -0.23 0.00 0.00 0.00 0.00 54.91 53.88 2wbc h ALA 87 Cb 1.20 -0.19 -0.15 0.00 0.00 0.00 0.00 17.79 18.65 2wbc h ALA 87 CO 0.71 0.67 -0.65 -1.54 0.00 0.00 0.00 179.25 178.44 2wbc s SER 88 N -6.66 0.61 0.00 0.00 1.04 -1.26 -4.68 113.70 102.76 2wbc s SER 88 Ca -0.12 -1.22 0.27 0.00 0.48 0.00 0.00 55.95 55.37 2wbc s SER 88 Cb 0.13 0.24 1.16 0.00 0.10 0.00 0.00 66.02 67.65 2wbc s SER 88 CO 0.87 -0.69 1.87 -0.81 0.98 0.00 0.00 173.24 175.46 2wbc n PRO 89 N -0.16 0.00 -2.29 4.02 -0.04 -1.26 -4.70 135.00 130.56 2wbc n PRO 89 Ca -0.05 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.03 2wbc n PRO 89 Cb 0.64 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2wbc n PRO 89 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2wbc s TRP 90 N -3.00 3.33 0.54 0.54 0.52 -1.26 -1.83 118.94 117.78 2wbc s TRP 90 Ca 0.13 1.37 -0.16 0.00 0.02 0.00 0.00 56.10 57.46 2wbc s TRP 90 Cb 0.18 -3.51 -0.06 0.00 -1.15 0.00 0.00 33.47 28.92 2wbc s TRP 90 CO 0.50 -1.48 1.01 -1.58 0.02 0.00 0.00 176.95 175.42 2wbc s TRP 91 N -0.22 3.30 0.03 -1.98 0.52 0.97 -4.54 118.94 117.03 2wbc s TRP 91 Ca 0.53 1.48 -0.21 0.00 0.02 0.00 0.00 56.10 57.92 2wbc s TRP 91 Cb -0.35 -2.86 0.04 0.00 -1.15 0.00 0.00 33.47 29.15 2wbc s TRP 91 CO 0.39 -0.62 0.47 -0.08 0.02 0.00 0.00 176.95 177.13 2wbc s THR 92 N -2.58 0.04 -0.37 2.01 -1.32 0.91 -4.63 115.64 109.70 2wbc s THR 92 Ca 0.60 -0.34 -0.14 0.00 -1.21 0.00 0.00 61.69 60.61 2wbc s THR 92 Cb -0.12 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 2wbc s THR 92 CO 0.34 -0.19 0.26 -0.69 -2.21 0.00 0.00 174.62 172.13 2wbc s VAL 93 N -2.24 5.22 -0.11 5.08 1.01 -1.26 0.43 120.40 128.52 2wbc s VAL 93 Ca -0.07 -0.44 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2wbc s VAL 93 Cb -0.01 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2wbc s VAL 93 CO -0.00 -0.14 0.03 -0.69 0.00 0.00 0.00 175.10 174.29 2wbc s VAL 94 N 1.69 4.52 0.70 2.92 1.01 0.15 -4.83 120.40 126.56 2wbc s VAL 94 Ca 0.05 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.77 2wbc s VAL 94 Cb -0.18 -2.94 0.01 0.00 0.00 0.00 0.00 36.38 33.27 2wbc s VAL 94 CO 0.10 0.57 1.06 -1.81 0.00 0.00 0.00 175.10 175.02 2wbc s ASP 95 N -0.58 5.36 0.30 3.32 1.01 -1.26 -0.48 116.67 124.33 2wbc s ASP 95 Ca 0.10 1.63 -0.18 0.00 0.71 0.00 0.00 52.55 54.80 2wbc s ASP 95 Cb -0.12 -2.50 0.07 0.00 1.01 0.00 0.00 42.92 41.38 2wbc s ASP 95 CO 0.02 -1.46 0.91 -0.94 0.21 0.00 0.00 175.17 173.92 2wbc s SER 96 N -3.77 0.02 0.18 0.27 1.04 -1.12 -4.85 113.70 105.46 2wbc s SER 96 Ca 0.58 -0.95 -0.12 0.00 0.48 0.00 0.00 55.95 55.94 2wbc s SER 96 Cb -0.14 0.69 0.09 0.00 0.10 0.00 0.00 66.02 66.76 2wbc s SER 96 CO 0.55 -1.38 1.74 1.55 0.98 0.00 0.00 173.24 176.68 2wbc h PRO 97 N 2.00 0.91 0.00 4.02 0.13 -2.03 -2.96 132.00 134.08 2wbc h PRO 97 Ca -0.31 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2wbc h PRO 97 Cb 1.23 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2wbc h PRO 97 CO 0.39 0.76 0.00 1.04 -0.23 0.00 0.00 178.00 179.97 2wbc n GLN 98 N -4.46 0.13 0.00 0.86 6.02 -1.26 -4.98 117.38 113.69 2wbc n GLN 98 Ca 0.04 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.43 2wbc n GLN 98 Cb 0.15 -1.77 0.00 0.00 1.02 0.00 0.00 30.24 29.65 2wbc n GLN 98 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wbc n GLY 99 N -0.16 0.86 3.74 1.08 0.00 -1.12 -5.06 105.19 104.53 2wbc n GLY 99 Ca 0.02 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 2wbc n GLY 99 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wbc s PRO 100 N -0.96 4.36 -0.01 1.61 0.02 -1.26 -2.79 135.00 135.97 2wbc s PRO 100 Ca 0.00 2.13 0.06 0.00 0.02 0.00 0.00 61.00 63.20 2wbc s PRO 100 Cb 0.00 -3.17 -0.02 0.00 0.02 0.00 0.00 34.50 31.34 2wbc s PRO 100 CO 0.00 -0.29 -0.18 0.00 -0.33 0.00 0.00 177.00 176.20 2wbc s ALA 101 N 0.02 1.53 0.03 -1.55 0.00 0.36 -2.11 121.76 120.05 2wbc s ALA 101 Ca 0.57 -0.81 -0.25 0.00 0.00 0.00 0.00 51.96 51.47 2wbc s ALA 101 Cb -0.38 -0.38 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 2wbc s ALA 101 CO 0.40 0.37 0.76 0.08 0.00 0.00 0.00 175.76 177.37 2wbc s VAL 102 N -0.48 4.77 0.06 0.00 1.01 -1.03 0.34 120.40 125.08 2wbc s VAL 102 Ca 0.07 1.61 -0.27 0.00 0.00 0.00 0.00 61.98 63.38 2wbc s VAL 102 Cb -0.07 -4.11 0.09 0.00 0.00 0.00 0.00 36.38 32.30 2wbc s VAL 102 CO -0.00 0.35 1.16 -1.59 0.00 0.00 0.00 175.10 175.02 2wbc s LYS 103 N 0.05 0.76 0.86 2.72 -2.85 0.17 -3.37 119.74 118.08 2wbc s LYS 103 Ca 0.38 -0.45 -0.10 0.00 -1.00 0.00 0.00 55.97 54.81 2wbc s LYS 103 Cb -0.20 0.24 0.16 0.00 -2.06 0.00 0.00 37.83 35.97 2wbc s LYS 103 CO 0.22 -0.35 1.19 -0.51 0.10 0.00 0.00 175.35 176.01 2wbc s LEU 104 N -3.16 2.80 0.07 2.77 1.43 0.03 -0.06 118.68 122.55 2wbc s LEU 104 Ca 0.17 0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 2wbc s LEU 104 Cb 0.01 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 2wbc s LEU 104 CO -0.00 -2.35 -0.09 -0.55 0.23 0.00 0.00 176.35 173.58 2wbc s SER 105 N -4.81 1.15 0.30 2.29 0.15 -1.26 -4.87 113.70 106.65 2wbc s SER 105 Ca 0.70 -0.67 0.18 0.00 0.70 0.00 0.00 55.95 56.86 2wbc s SER 105 Cb -0.05 0.02 0.13 0.00 -1.71 0.00 0.00 66.02 64.41 2wbc s SER 105 CO 0.50 -0.23 1.40 1.56 1.20 0.00 0.00 173.24 177.67 2wbc h GLN 106 N 4.08 0.00 -5.35 5.44 4.20 -1.93 0.23 115.11 121.78 2wbc h GLN 106 Ca -0.37 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 57.70 2wbc h GLN 106 Cb 1.19 0.00 -0.22 0.00 0.30 0.00 0.00 27.48 28.75 2wbc h GLN 106 CO 0.46 0.28 -0.68 1.14 -0.67 0.00 0.00 178.83 179.36 2wbc s GLN 107 N -3.07 3.58 -0.08 1.46 -2.07 -1.26 -3.60 119.66 114.63 2wbc s GLN 107 Ca 0.04 -0.55 -0.35 0.00 -1.82 0.00 0.00 55.36 52.69 2wbc s GLN 107 Cb 0.07 -2.85 -0.12 0.00 -1.09 0.00 0.00 33.01 29.02 2wbc s GLN 107 CO 0.73 0.26 1.83 1.17 -1.32 0.00 0.00 175.29 177.97 2wbc n LYS 108 N 3.45 2.09 -3.65 9.60 0.00 -1.26 -4.71 118.16 123.67 2wbc n LYS 108 Ca -0.18 0.76 -0.25 0.00 0.00 0.00 0.00 58.31 58.64 2wbc n LYS 108 Cb 0.53 -2.59 -0.02 0.00 0.00 0.00 0.00 35.03 32.94 2wbc n LYS 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2wbc s LEU 109 N 3.67 4.18 0.60 3.14 1.43 -1.26 -5.05 118.68 125.40 2wbc s LEU 109 Ca 0.92 0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 54.22 2wbc s LEU 109 Cb -0.72 -3.16 -0.03 0.00 0.03 0.00 0.00 46.19 42.31 2wbc s LEU 109 CO 0.51 -0.12 1.07 -2.16 0.23 0.00 0.00 176.35 175.89 2wbc s PRO 110 N -3.70 3.21 0.45 1.29 0.04 -1.26 -4.97 135.00 130.06 2wbc s PRO 110 Ca 0.38 1.27 0.11 0.00 0.04 0.00 0.00 61.00 62.80 2wbc s PRO 110 Cb -0.10 -2.01 0.99 0.00 0.04 0.00 0.00 34.50 33.42 2wbc s PRO 110 CO 0.31 -0.91 2.07 0.93 0.04 0.00 0.00 177.00 179.44 2wbc h GLU 111 N 0.41 0.31 0.00 4.56 3.07 -2.00 -2.04 114.58 118.89 2wbc h GLU 111 Ca -0.47 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 2wbc h GLU 111 Cb 1.23 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 2wbc h GLU 111 CO 0.57 0.23 0.00 1.57 -1.40 0.00 0.00 179.01 179.98 2wbc h LYS 112 N 0.31 0.00 0.00 2.33 2.10 -1.93 -0.80 116.57 118.58 2wbc h LYS 112 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2wbc h LYS 112 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 2wbc h LYS 112 CO -0.01 0.00 -0.98 -0.25 -2.00 0.00 0.00 179.45 176.21 2wbc n ASP 113 N -2.72 0.63 -0.07 7.07 8.00 -0.77 -4.40 116.55 124.30 2wbc n ASP 113 Ca 0.00 -0.31 -0.08 0.00 0.71 0.00 0.00 54.79 55.11 2wbc n ASP 113 Cb 0.23 0.78 -0.09 0.00 -0.02 0.00 0.00 41.12 42.02 2wbc n ASP 113 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2wbc n ILE 114 N -1.85 0.86 -1.72 0.53 -5.35 -1.00 -4.53 119.36 106.31 2wbc n ILE 114 Ca 0.03 -0.45 -0.42 0.00 -0.27 0.00 0.00 62.75 61.64 2wbc n ILE 114 Cb 0.41 -0.82 -0.00 0.00 -1.74 0.00 0.00 39.64 37.48 2wbc n ILE 114 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2wbc n LEU 115 N -2.65 7.16 -0.05 7.28 4.77 -0.34 -4.25 117.00 128.91 2wbc n LEU 115 Ca -0.23 -4.23 0.03 0.00 -0.03 0.00 0.00 56.01 51.56 2wbc n LEU 115 Cb 0.86 -1.63 0.05 0.00 -2.33 0.00 0.00 43.42 40.37 2wbc n LEU 115 CO 0.22 1.29 0.48 1.33 -1.33 0.00 0.00 177.39 179.38 2wbc n VAL 116 N 4.68 1.13 -4.44 4.08 0.24 -1.22 -4.81 118.33 117.99 2wbc n VAL 116 Ca 0.55 -1.25 -0.22 0.00 -2.04 0.00 0.00 64.34 61.37 2wbc n VAL 116 Cb 0.36 0.31 -0.10 0.00 -1.47 0.00 0.00 33.84 32.94 2wbc n VAL 116 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2wbc s PHE 117 N -1.45 2.11 -0.28 6.34 0.08 -1.15 -0.58 117.98 123.05 2wbc s PHE 117 Ca 0.10 -0.44 -0.19 0.00 0.12 0.00 0.00 56.93 56.53 2wbc s PHE 117 Cb 0.09 -0.97 0.08 0.00 -0.57 0.00 0.00 43.02 41.65 2wbc s PHE 117 CO 0.01 0.58 0.72 0.21 -0.10 0.00 0.00 175.22 176.63 2wbc s LYS 118 N -3.57 0.73 0.05 0.44 2.20 -0.99 -0.33 119.74 118.26 2wbc s LYS 118 Ca 0.28 1.13 -0.18 0.00 -0.36 0.00 0.00 55.97 56.84 2wbc s LYS 118 Cb -0.03 0.21 -0.06 0.00 -1.51 0.00 0.00 37.83 36.44 2wbc s LYS 118 CO 0.12 -0.13 0.52 -0.06 -0.36 0.00 0.00 175.35 175.45 2wbc s PHE 119 N 1.25 3.78 -0.12 4.03 0.08 -1.26 -0.57 117.98 125.18 2wbc s PHE 119 Ca -0.07 1.20 0.01 0.00 0.12 0.00 0.00 56.93 58.19 2wbc s PHE 119 Cb -0.05 -2.44 0.02 0.00 -0.57 0.00 0.00 43.02 39.97 2wbc s PHE 119 CO -0.14 0.60 -0.15 -2.00 -0.10 0.00 0.00 175.22 173.43 2wbc s GLU 120 N -1.08 2.22 0.48 0.44 2.12 -0.37 -4.60 118.70 117.91 2wbc s GLU 120 Ca 0.28 -0.55 -0.23 0.00 0.36 0.00 0.00 54.97 54.82 2wbc s GLU 120 Cb -0.19 -1.93 -0.07 0.00 0.26 0.00 0.00 34.13 32.21 2wbc s GLU 120 CO 0.17 -0.11 1.24 -1.59 -0.54 0.00 0.00 175.26 174.44 2wbc s LYS 121 N 1.11 3.59 -0.03 4.30 -2.85 -1.26 -0.66 119.74 123.94 2wbc s LYS 121 Ca -0.04 1.96 -0.25 0.00 -1.00 0.00 0.00 55.97 56.64 2wbc s LYS 121 Cb -0.14 -2.40 -0.04 0.00 -2.06 0.00 0.00 37.83 33.19 2wbc s LYS 121 CO -0.04 -0.74 0.77 0.08 0.10 0.00 0.00 175.35 175.52 2wbc s VAL 122 N -1.44 4.95 0.00 1.79 1.01 0.10 -4.82 120.40 121.99 2wbc s VAL 122 Ca 0.65 1.60 0.00 0.00 0.00 0.00 0.00 61.98 64.24 2wbc s VAL 122 Cb -0.33 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 31.94 2wbc s VAL 122 CO 0.40 0.26 0.93 -1.54 0.00 0.00 0.00 175.10 175.15 2wbc n SER 123 N 3.59 0.00 -4.51 3.32 3.41 -1.26 -4.38 113.62 113.79 2wbc n SER 123 Ca -0.00 0.93 -0.43 0.00 -0.26 0.00 0.00 58.87 59.11 2wbc n SER 123 Cb 0.51 -0.43 -0.02 0.00 -0.26 0.00 0.00 64.21 64.01 2wbc n SER 123 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2wbc s HIS 124 N -2.72 2.98 -0.16 7.33 2.46 -1.26 -4.94 115.29 118.98 2wbc s HIS 124 Ca 0.00 -1.44 -0.28 0.00 0.47 0.00 0.00 55.06 53.81 2wbc s HIS 124 Cb 0.00 -4.49 0.08 0.00 -0.13 0.00 0.00 32.58 28.05 2wbc s HIS 124 CO 0.00 -1.65 0.77 0.45 -2.47 0.00 0.00 174.74 171.84 2wbc s SER 125 N 3.94 -0.63 0.05 9.88 0.15 -1.26 -5.04 113.70 120.79 2wbc s SER 125 Ca 0.42 0.95 0.04 0.00 0.70 0.00 0.00 55.95 58.06 2wbc s SER 125 Cb -0.02 0.86 -0.24 0.00 -1.71 0.00 0.00 66.02 64.92 2wbc s SER 125 CO -0.05 -0.41 1.03 0.78 1.20 0.00 0.00 173.24 175.80 2wbc h ASN 126 N 3.76 0.15 -0.45 5.45 2.35 -1.95 -3.47 115.58 121.41 2wbc h ASN 126 Ca -0.27 -0.19 -0.58 0.00 -0.55 0.00 0.00 56.30 54.72 2wbc h ASN 126 Cb 1.15 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.44 2wbc h ASN 126 CO 0.23 1.15 -0.25 0.27 -1.65 0.00 0.00 177.43 177.19 2wbc s ILE 127 N -2.66 1.60 -0.52 2.81 -4.36 -1.26 -5.06 121.20 111.74 2wbc s ILE 127 Ca -0.03 -1.41 -0.24 0.00 -0.26 0.00 0.00 60.65 58.71 2wbc s ILE 127 Cb 0.08 -2.01 0.04 0.00 1.25 0.00 0.00 42.46 41.83 2wbc s ILE 127 CO 0.84 0.00 0.91 -1.00 0.24 0.00 0.00 174.94 175.93 2wbc s HIS 128 N -2.80 2.84 0.02 1.37 3.76 -1.26 -4.97 115.29 114.26 2wbc s HIS 128 Ca 0.37 0.05 0.08 0.00 -0.15 0.00 0.00 55.06 55.40 2wbc s HIS 128 Cb -0.03 -4.00 -0.03 0.00 1.11 0.00 0.00 32.58 29.64 2wbc s HIS 128 CO 0.24 -1.26 -0.22 0.08 -0.85 0.00 0.00 174.74 172.73 2wbc s VAL 129 N 3.80 2.48 0.11 -0.90 1.01 -1.26 -4.63 120.40 121.01 2wbc s VAL 129 Ca 0.31 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 61.14 2wbc s VAL 129 Cb -0.12 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 2wbc s VAL 129 CO 0.20 0.42 -0.08 -0.31 0.00 0.00 0.00 175.10 175.33 2wbc s TYR 130 N -0.80 1.05 0.17 5.22 2.02 -0.09 0.02 117.35 124.93 2wbc s TYR 130 Ca 0.12 -0.81 0.07 0.00 -0.37 0.00 0.00 57.07 56.08 2wbc s TYR 130 Cb -0.10 -0.57 -0.04 0.00 -0.40 0.00 0.00 41.96 40.85 2wbc s TYR 130 CO 0.02 -0.04 -0.00 0.15 -1.57 0.00 0.00 175.55 174.11 2wbc s LYS 131 N -3.61 2.41 -0.27 -0.62 1.02 0.17 -0.06 119.74 118.78 2wbc s LYS 131 Ca 0.12 -1.08 -0.05 0.00 0.02 0.00 0.00 55.97 54.98 2wbc s LYS 131 Cb 0.03 -2.37 0.01 0.00 -0.52 0.00 0.00 37.83 34.97 2wbc s LYS 131 CO -0.02 0.46 0.03 -1.17 -0.92 0.00 0.00 175.35 173.73 2wbc s LEU 132 N -2.88 3.49 0.08 3.17 2.96 -1.26 -1.23 118.68 123.01 2wbc s LEU 132 Ca 0.27 -0.64 -0.01 0.00 -0.22 0.00 0.00 54.13 53.53 2wbc s LEU 132 Cb -0.09 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 2wbc s LEU 132 CO 0.18 -0.13 0.26 -0.76 -1.32 0.00 0.00 176.35 174.58 2wbc s LEU 133 N 1.47 4.33 -0.14 -0.68 1.43 0.27 -1.19 118.68 124.17 2wbc s LEU 133 Ca 0.03 0.37 -0.03 0.00 -1.03 0.00 0.00 54.13 53.47 2wbc s LEU 133 Cb -0.16 -3.06 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 2wbc s LEU 133 CO -0.00 0.14 -0.03 -0.47 0.23 0.00 0.00 176.35 176.21 2wbc s TYR 134 N -1.55 3.04 -0.28 0.29 5.04 -0.54 -2.36 117.35 120.98 2wbc s TYR 134 Ca 0.37 -0.19 -0.05 0.00 -2.44 0.00 0.00 57.07 54.76 2wbc s TYR 134 Cb -0.13 -1.91 0.02 0.00 0.35 0.00 0.00 41.96 40.29 2wbc s TYR 134 CO 0.27 0.07 0.03 0.00 -1.34 0.00 0.00 175.55 174.59 2wbc n GLN 136 N 4.78 0.68 -0.37 0.00 3.00 0.01 -4.69 117.38 120.79 2wbc n GLN 136 Ca -0.15 -0.33 0.07 0.00 -0.01 0.00 0.00 57.00 56.58 2wbc n GLN 136 Cb 0.47 -3.17 0.19 0.00 0.00 0.00 0.00 30.24 27.73 2wbc n GLN 136 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 2wbc n HIS 137 N 15.70 0.32 -0.11 1.08 -0.00 -1.23 -2.12 115.22 128.87 2wbc n HIS 137 Ca 0.46 -1.19 -0.19 0.00 0.46 0.00 0.00 57.72 57.26 2wbc n HIS 137 Cb 0.42 -0.25 -0.07 0.00 -0.12 0.00 0.00 29.99 29.97 2wbc n HIS 137 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2wbc n ASP 138 N -1.15 1.90 -4.42 0.26 8.00 -1.25 -4.56 116.55 115.33 2wbc n ASP 138 Ca 0.20 0.41 -0.43 0.00 0.71 0.00 0.00 54.79 55.68 2wbc n ASP 138 Cb 0.75 -0.85 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 2wbc n ASP 138 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2wbc n GLU 139 N -4.41 3.14 -0.79 -1.24 2.13 -1.26 -4.69 120.64 113.51 2wbc n GLU 139 Ca -0.31 -3.16 -0.00 0.00 0.66 0.00 0.00 57.16 54.34 2wbc n GLU 139 Cb 0.64 -3.46 0.00 0.00 0.27 0.00 0.00 31.44 28.90 2wbc n GLU 139 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2wbc n GLU 140 N 7.96 -0.01 -1.55 5.31 2.13 -1.26 -4.82 120.64 128.40 2wbc n GLU 140 Ca 0.49 0.01 0.00 0.00 0.66 0.00 0.00 57.16 58.32 2wbc n GLU 140 Cb 0.45 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 32.15 2wbc n GLU 140 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2wbc n ASP 141 N 1.22 0.00 -3.66 4.31 8.00 -1.26 -5.13 116.55 120.02 2wbc n ASP 141 Ca -0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 2wbc n ASP 141 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.01 2wbc n ASP 141 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wbc s VAL 142 N -1.72 -0.57 -0.08 2.53 0.11 -1.19 -3.49 120.40 115.99 2wbc s VAL 142 Ca 0.00 0.17 -0.01 0.00 -2.93 0.00 0.00 61.98 59.21 2wbc s VAL 142 Cb 0.00 -0.65 0.03 0.00 -1.53 0.00 0.00 36.38 34.23 2wbc s VAL 142 CO 0.00 0.07 -0.03 -0.54 -3.33 0.00 0.00 175.10 171.27 2wbc s LYS 143 N 2.47 0.96 -0.69 1.54 -0.14 -0.90 -4.91 119.74 118.06 2wbc s LYS 143 Ca -0.02 -0.04 -0.17 0.00 -1.36 0.00 0.00 55.97 54.38 2wbc s LYS 143 Cb -0.12 -1.18 0.15 0.00 -1.68 0.00 0.00 37.83 35.00 2wbc s LYS 143 CO -0.12 -0.27 0.72 0.00 -0.76 0.00 0.00 175.35 174.92 2wbc n ASP 145 N 5.41 1.09 -4.46 0.00 5.75 -1.25 -4.97 116.55 118.11 2wbc n ASP 145 Ca 0.00 -1.53 -0.27 0.00 -0.01 0.00 0.00 54.79 52.99 2wbc n ASP 145 Cb 0.44 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.42 2wbc n ASP 145 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2wbc s GLN 146 N -0.53 1.66 0.31 0.11 -0.21 -1.24 -5.05 119.66 114.71 2wbc s GLN 146 Ca 0.00 -1.48 0.10 0.00 0.02 0.00 0.00 55.36 54.00 2wbc s GLN 146 Cb 0.00 -1.92 -0.06 0.00 1.00 0.00 0.00 33.01 32.03 2wbc s GLN 146 CO 0.00 0.40 -0.12 0.71 -2.12 0.00 0.00 175.29 174.16 2wbc s TYR 147 N -1.73 2.28 -0.23 0.91 2.02 -1.26 -1.47 117.35 117.87 2wbc s TYR 147 Ca 0.22 -0.48 -0.07 0.00 -0.37 0.00 0.00 57.07 56.38 2wbc s TYR 147 Cb -0.08 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.25 2wbc s TYR 147 CO 0.11 0.58 0.05 0.42 -1.57 0.00 0.00 175.55 175.14 2wbc s ILE 148 N -2.65 4.29 0.29 2.71 -1.09 -0.34 -1.44 121.20 122.97 2wbc s ILE 148 Ca 0.31 -0.19 0.04 0.00 -2.23 0.00 0.00 60.65 58.58 2wbc s ILE 148 Cb 0.00 -2.98 -0.01 0.00 -1.58 0.00 0.00 42.46 37.89 2wbc s ILE 148 CO 0.15 0.37 0.14 0.61 -1.23 0.00 0.00 174.94 174.98 2wbc n GLY 149 N 4.59 3.38 3.86 6.18 0.00 0.55 -2.67 105.19 121.08 2wbc n GLY 149 Ca -0.16 -2.00 -0.26 0.00 0.00 0.00 0.00 46.02 43.60 2wbc n GLY 149 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wbc s ILE 150 N -2.79 4.86 -0.16 -0.61 -4.36 -1.26 -1.07 121.20 115.81 2wbc s ILE 150 Ca 0.20 -0.90 -0.04 0.00 -0.26 0.00 0.00 60.65 59.64 2wbc s ILE 150 Cb 0.01 -3.49 0.06 0.00 1.25 0.00 0.00 42.46 40.29 2wbc s ILE 150 CO 0.14 -0.10 0.11 -2.28 0.24 0.00 0.00 174.94 173.05 2wbc s HIS 151 N -1.75 0.08 -0.01 1.37 2.46 -0.15 -4.89 115.29 112.40 2wbc s HIS 151 Ca 0.33 -0.12 -0.30 0.00 0.47 0.00 0.00 55.06 55.43 2wbc s HIS 151 Cb -0.10 -0.59 -0.04 0.00 -0.13 0.00 0.00 32.58 31.71 2wbc s HIS 151 CO 0.26 -0.49 1.09 1.03 -2.47 0.00 0.00 174.74 174.16 2wbc s ARG 152 N 2.18 4.46 0.30 2.88 0.52 -1.26 -1.94 118.95 126.09 2wbc s ARG 152 Ca 0.03 1.57 0.01 0.00 -0.52 0.00 0.00 55.73 56.83 2wbc s ARG 152 Cb -0.15 -3.46 0.06 0.00 0.52 0.00 0.00 34.95 31.92 2wbc s ARG 152 CO -0.09 -0.23 0.41 -0.40 0.02 0.00 0.00 175.30 175.01 2wbc n ASP 153 N 4.32 0.71 -0.20 0.23 5.68 0.08 -4.92 116.55 122.45 2wbc n ASP 153 Ca 0.08 -1.56 -0.01 0.00 -0.50 0.00 0.00 54.79 52.80 2wbc n ASP 153 Cb 0.48 -0.25 0.10 0.00 -1.14 0.00 0.00 41.12 40.31 2wbc n ASP 153 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2wbc h ARG 154 N 0.00 0.45 0.00 0.11 0.11 -1.96 -0.12 114.38 112.97 2wbc h ARG 154 Ca -0.14 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.92 2wbc h ARG 154 Cb 0.54 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 31.52 2wbc h ARG 154 CO 0.16 0.30 0.00 0.09 0.10 0.00 0.00 179.97 180.62 2wbc n ASN 155 N -4.95 0.00 0.00 0.08 4.13 -1.26 -4.85 115.26 108.41 2wbc n ASN 155 Ca 0.08 -0.99 0.00 0.00 1.68 0.00 0.00 54.58 55.36 2wbc n ASN 155 Cb 0.24 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.48 2wbc n ASN 155 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wbc n GLY 156 N 0.77 0.73 3.68 7.41 0.00 -0.06 -5.04 105.19 112.68 2wbc n GLY 156 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2wbc n GLY 156 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wbc s ASN 157 N -2.81 6.66 -1.09 1.61 0.01 -1.26 -4.63 114.94 113.44 2wbc s ASN 157 Ca 0.00 2.36 -0.17 0.00 -0.71 0.00 0.00 52.86 54.34 2wbc s ASN 157 Cb 0.00 -2.55 0.13 0.00 0.41 0.00 0.00 41.25 39.24 2wbc s ASN 157 CO 0.00 -0.87 1.35 -0.13 -1.51 0.00 0.00 177.10 175.93 2wbc s ARG 158 N 3.00 3.83 0.06 -0.60 0.52 -1.26 -0.74 118.95 123.75 2wbc s ARG 158 Ca 0.72 -2.04 -0.23 0.00 -0.52 0.00 0.00 55.73 53.66 2wbc s ARG 158 Cb -0.37 -5.09 -0.06 0.00 0.52 0.00 0.00 34.95 29.96 2wbc s ARG 158 CO 0.31 -1.87 0.70 -0.98 0.02 0.00 0.00 175.30 173.48 2wbc s ARG 159 N 2.65 4.43 0.02 3.54 1.70 -0.82 -0.22 118.95 130.25 2wbc s ARG 159 Ca 0.40 0.96 -0.30 0.00 -0.47 0.00 0.00 55.73 56.31 2wbc s ARG 159 Cb -0.03 -3.33 -0.05 0.00 -0.57 0.00 0.00 34.95 30.98 2wbc s ARG 159 CO -0.04 0.40 1.24 -0.51 -1.08 0.00 0.00 175.30 175.31 2wbc s LEU 160 N -0.40 4.33 0.16 -1.89 1.02 -0.61 -0.98 118.68 120.31 2wbc s LEU 160 Ca 0.35 1.99 -0.17 0.00 0.02 0.00 0.00 54.13 56.32 2wbc s LEU 160 Cb -0.20 -3.57 0.03 0.00 0.02 0.00 0.00 46.19 42.47 2wbc s LEU 160 CO 0.22 -0.56 0.46 0.54 0.02 0.00 0.00 176.35 177.03 2wbc s VAL 161 N 1.65 0.05 0.17 -1.59 0.11 -0.23 -2.47 120.40 118.07 2wbc s VAL 161 Ca 0.59 -0.63 -0.30 0.00 -2.93 0.00 0.00 61.98 58.71 2wbc s VAL 161 Cb -0.29 -1.34 -0.07 0.00 -1.53 0.00 0.00 36.38 33.15 2wbc s VAL 161 CO 0.27 -0.21 1.10 -0.69 -3.33 0.00 0.00 175.10 172.24 2wbc s VAL 162 N -3.83 3.91 0.24 2.04 1.01 -0.90 -0.33 120.40 122.54 2wbc s VAL 162 Ca 0.06 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.68 2wbc s VAL 162 Cb 0.01 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 2wbc s VAL 162 CO -0.08 0.27 0.08 0.42 0.00 0.00 0.00 175.10 175.79 2wbc s THR 163 N -0.15 0.61 -0.98 3.92 -4.23 -0.52 -4.74 115.64 109.54 2wbc s THR 163 Ca 0.50 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.87 2wbc s THR 163 Cb -0.29 -2.55 0.20 0.00 1.34 0.00 0.00 72.50 71.20 2wbc s THR 163 CO 0.34 -0.09 1.05 -1.61 -0.54 0.00 0.00 174.62 173.77 2wbc s GLU 164 N -4.01 3.81 -0.81 3.99 2.02 -1.26 -4.10 118.70 118.34 2wbc s GLU 164 Ca 0.35 -2.44 -0.01 0.00 0.02 0.00 0.00 54.97 52.89 2wbc s GLU 164 Cb 0.07 -4.70 -0.00 0.00 0.10 0.00 0.00 34.13 29.61 2wbc s GLU 164 CO 0.12 -1.49 0.65 0.39 0.02 0.00 0.00 175.26 174.94 2wbc n GLU 165 N 4.71 -1.43 -2.85 1.61 -0.58 -1.26 -4.95 120.64 115.90 2wbc n GLU 165 Ca 0.23 1.03 -0.11 0.00 -0.42 0.00 0.00 57.16 57.88 2wbc n GLU 165 Cb 0.45 -3.73 0.04 0.00 -0.57 0.00 0.00 31.44 27.64 2wbc n GLU 165 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2wbc n ASN 166 N -2.29 -0.31 -4.76 1.62 2.85 -1.26 -5.13 115.26 105.98 2wbc n ASN 166 Ca -0.19 -3.00 -0.41 0.00 -0.11 0.00 0.00 54.58 50.88 2wbc n ASN 166 Cb 0.61 0.33 -0.03 0.00 1.24 0.00 0.00 39.78 41.94 2wbc n ASN 166 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 2wbc s PRO 167 N -1.45 4.44 0.35 1.20 0.02 -1.26 -4.13 135.00 134.18 2wbc s PRO 167 Ca 0.29 2.05 -0.09 0.00 0.02 0.00 0.00 61.00 63.27 2wbc s PRO 167 Cb 0.37 -3.14 -0.06 0.00 0.02 0.00 0.00 34.50 31.69 2wbc s PRO 167 CO -0.04 -0.10 0.69 -0.48 -0.33 0.00 0.00 177.00 176.74 2wbc s LEU 168 N -1.20 3.94 0.04 -5.54 0.05 -1.09 -4.97 118.68 109.91 2wbc s LEU 168 Ca 0.50 1.03 0.08 0.00 0.05 0.00 0.00 54.13 55.78 2wbc s LEU 168 Cb -0.37 -3.87 -0.03 0.00 -2.05 0.00 0.00 46.19 39.87 2wbc s LEU 168 CO 0.45 -0.30 -0.20 -1.61 -0.55 0.00 0.00 176.35 174.14 2wbc s GLU 169 N -3.60 2.01 0.11 1.48 2.02 -1.26 -4.24 118.70 115.22 2wbc s GLU 169 Ca 0.49 -1.01 0.06 0.00 0.02 0.00 0.00 54.97 54.54 2wbc s GLU 169 Cb -0.10 -2.14 -0.04 0.00 0.10 0.00 0.00 34.13 31.95 2wbc s GLU 169 CO 0.29 0.54 -0.15 -0.51 0.02 0.00 0.00 175.26 175.44 2wbc s LEU 170 N -1.37 2.37 -0.09 1.80 1.43 0.91 -3.19 118.68 120.53 2wbc s LEU 170 Ca 0.14 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.50 2wbc s LEU 170 Cb -0.10 -0.58 0.02 0.00 0.03 0.00 0.00 46.19 45.56 2wbc s LEU 170 CO 0.04 -0.11 -0.12 -0.69 0.23 0.00 0.00 176.35 175.70 2wbc s VAL 171 N -1.85 1.22 -0.57 -1.59 1.01 0.23 -0.91 120.40 117.93 2wbc s VAL 171 Ca 0.06 -0.48 -0.22 0.00 0.00 0.00 0.00 61.98 61.34 2wbc s VAL 171 Cb -0.07 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.23 2wbc s VAL 171 CO 0.03 0.38 0.84 -0.76 0.00 0.00 0.00 175.10 175.59 2wbc s LEU 172 N 1.02 4.54 -0.42 3.92 1.02 -1.26 -1.89 118.68 125.61 2wbc s LEU 172 Ca -0.07 -0.79 -0.17 0.00 0.02 0.00 0.00 54.13 53.12 2wbc s LEU 172 Cb -0.15 -2.56 0.02 0.00 0.02 0.00 0.00 46.19 43.52 2wbc s LEU 172 CO -0.01 -1.18 0.42 -0.22 0.02 0.00 0.00 176.35 175.37 2wbc s LEU 173 N 3.50 4.87 0.11 1.79 1.98 -0.30 -1.79 118.68 128.85 2wbc s LEU 173 Ca 0.22 -0.68 -0.36 0.00 -2.89 0.00 0.00 54.13 50.43 2wbc s LEU 173 Cb -0.17 -2.36 -0.16 0.00 0.66 0.00 0.00 46.19 44.17 2wbc s LEU 173 CO 0.13 -0.55 1.34 1.17 -1.89 0.00 0.00 176.35 176.55 2wbc n LYS 174 N 5.53 1.28 -3.75 1.98 4.81 -1.26 -0.25 118.16 126.50 2wbc n LYS 174 Ca -0.08 0.46 -0.31 0.00 -0.87 0.00 0.00 58.31 57.52 2wbc n LYS 174 Cb 0.47 -2.09 -0.04 0.00 0.02 0.00 0.00 35.03 33.39 2wbc n LYS 174 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wbc s ALA 175 N 0.40 3.86 0.00 3.14 0.00 -0.41 -4.78 121.76 123.96 2wbc s ALA 175 Ca 0.81 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.09 2wbc s ALA 175 Cb -0.90 -2.02 0.00 0.00 0.00 0.00 0.00 23.12 20.20 2wbc s ALA 175 CO 0.47 0.69 0.00 1.63 0.00 0.00 0.00 175.76 178.55 2wbc n LYS 176 N 0.04 0.00 0.00 0.00 4.01 -1.26 -4.83 118.16 116.12 2wbc n LYS 176 Ca -0.03 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.77 2wbc n LYS 176 Cb 0.52 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.04 2wbc n LYS 176 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2wbc n SER 177 N 0.00 0.00 -0.35 4.39 2.88 -1.26 -5.20 113.62 114.08 2wbc n SER 177 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 2wbc n SER 177 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2wbc n SER 177 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2wbc n GLU 178 N -1.70 -0.56 -2.09 -1.46 1.02 -1.26 -5.13 120.64 109.47 2wbc n GLU 178 Ca 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2wbc n GLU 178 Cb 0.00 -0.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 2wbc n GLU 178 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2wbc n THR 179 N -1.23 0.00 -2.68 2.62 5.66 -1.26 -5.20 114.28 112.19 2wbc n THR 179 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2wbc n THR 179 Cb 0.13 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 2wbc n THR 179 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wbc n ALA 180 N -0.48 0.00 -3.60 1.79 0.00 -1.26 -5.19 120.51 111.77 2wbc n ALA 180 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 2wbc n ALA 180 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2wbc n ALA 180 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2wbc s SER 181 N 1.00 -0.30 0.00 0.00 1.04 -1.26 -5.17 113.70 109.01 2wbc s SER 181 Ca 0.00 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.26 2wbc s SER 181 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2wbc s SER 181 CO 0.00 -0.75 0.00 -1.20 0.98 0.00 0.00 173.24 172.27 2wbc n SER 182 N -0.34 0.00 0.00 7.02 7.64 -1.26 -5.39 113.62 121.29 2wbc n SER 182 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2wbc n SER 182 Cb 0.61 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 2wbc n SER 182 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44