#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bgo s TRP 9 N 0.00 -0.45 0.17 1.43 -2.14 -1.15 -5.00 118.94 111.80 2bgo s TRP 9 Ca 0.00 0.71 -0.25 0.00 2.66 0.00 0.00 56.10 59.21 2bgo s TRP 9 Cb 0.00 0.29 -0.08 0.00 -3.10 0.00 0.00 33.47 30.58 2bgo s TRP 9 CO 0.00 -0.55 0.78 0.99 -2.66 0.00 0.00 176.95 175.52 2bgo s THR 10 N -1.51 4.36 -0.44 0.66 2.01 -1.26 -3.06 115.64 116.39 2bgo s THR 10 Ca -0.11 1.71 -0.10 0.00 0.31 0.00 0.00 61.69 63.50 2bgo s THR 10 Cb -0.02 -4.13 0.09 0.00 0.01 0.00 0.00 72.50 68.45 2bgo s THR 10 CO 0.06 0.51 0.30 -0.31 -0.69 0.00 0.00 174.62 174.48 2bgo s TYR 11 N -1.17 3.36 0.21 4.92 2.02 -1.06 -4.96 117.35 120.67 2bgo s TYR 11 Ca 0.36 -1.59 -0.32 0.00 -0.37 0.00 0.00 57.07 55.16 2bgo s TYR 11 Cb -0.23 -3.16 -0.14 0.00 -0.40 0.00 0.00 41.96 38.03 2bgo s TYR 11 CO 0.26 -0.89 1.31 0.25 -1.57 0.00 0.00 175.55 174.90 2bgo n THR 12 N 4.94 0.95 0.32 -0.71 -2.24 -1.26 -2.54 114.28 113.74 2bgo n THR 12 Ca -0.10 -0.24 0.16 0.00 -2.27 0.00 0.00 64.05 61.61 2bgo n THR 12 Cb 0.42 -1.22 0.67 0.00 -2.10 0.00 0.00 70.33 68.10 2bgo n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bgo h ALA 13 N 3.85 1.00 0.00 6.98 0.00 -1.74 -2.62 119.26 126.73 2bgo h ALA 13 Ca -0.44 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 2bgo h ALA 13 Cb 1.30 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2bgo h ALA 13 CO 0.73 0.00 -0.18 0.00 0.00 0.00 0.00 179.25 179.80 2bgo h ALA 14 N 2.08 1.07 -0.02 0.00 0.00 -1.89 -1.24 119.26 119.26 2bgo h ALA 14 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2bgo h ALA 14 Cb 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bgo h ALA 14 CO 0.00 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.35 2bgo n SER 15 N -3.42 1.03 -0.71 0.00 3.41 -0.99 -4.86 113.62 108.09 2bgo n SER 15 Ca -0.00 -1.37 0.00 0.00 -0.26 0.00 0.00 58.87 57.24 2bgo n SER 15 Cb 0.37 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 2bgo n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bgo n ALA 16 N -0.18 0.00 -3.54 7.33 0.00 -0.47 -4.50 120.51 119.15 2bgo n ALA 16 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.26 2bgo n ALA 16 Cb 0.27 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.61 2bgo n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2bgo s SER 17 N -0.97 5.37 -0.90 0.00 0.15 0.20 -4.93 113.70 112.63 2bgo s SER 17 Ca 0.00 -1.68 -0.20 0.00 0.70 0.00 0.00 55.95 54.77 2bgo s SER 17 Cb 0.00 -1.88 0.11 0.00 -1.71 0.00 0.00 66.02 62.54 2bgo s SER 17 CO 0.00 -0.50 1.14 -0.63 1.20 0.00 0.00 173.24 174.45 2bgo s ILE 18 N 1.29 4.56 -0.06 6.45 1.09 -1.26 -1.58 121.20 131.68 2bgo s ILE 18 Ca 0.04 -1.27 -0.20 0.00 -1.10 0.00 0.00 60.65 58.11 2bgo s ILE 18 Cb -0.22 -4.80 -0.05 0.00 -1.06 0.00 0.00 42.46 36.33 2bgo s ILE 18 CO -0.01 -1.56 0.56 -0.89 -0.10 0.00 0.00 174.94 172.94 2bgo s THR 19 N 3.21 5.05 0.47 2.92 2.01 -1.15 -4.78 115.64 123.37 2bgo s THR 19 Ca 0.33 1.15 -0.21 0.00 0.31 0.00 0.00 61.69 63.26 2bgo s THR 19 Cb -0.06 -3.90 -0.11 0.00 0.01 0.00 0.00 72.50 68.44 2bgo s THR 19 CO -0.06 0.36 0.56 0.00 -0.69 0.00 0.00 174.62 174.78 2bgo n ALA 20 N 3.25 -1.29 1.60 7.40 0.00 -1.26 -0.24 120.51 129.97 2bgo n ALA 20 Ca -0.06 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2bgo n ALA 20 Cb 0.51 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2bgo n ALA 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2bgo n PRO 21 N 0.38 0.80 -1.77 0.00 -0.04 -1.26 -3.19 135.00 129.92 2bgo n PRO 21 Ca 0.11 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.16 2bgo n PRO 21 Cb 0.42 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 2bgo n PRO 21 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bgo n ALA 22 N -0.50 2.25 -3.63 0.55 0.00 0.67 -4.22 120.51 115.63 2bgo n ALA 22 Ca 0.00 0.33 -0.19 0.00 0.00 0.00 0.00 53.44 53.58 2bgo n ALA 22 Cb 0.00 -2.40 -0.16 0.00 0.00 0.00 0.00 19.45 16.89 2bgo n ALA 22 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2bgo s GLN 23 N -2.13 0.05 -0.45 0.00 1.11 -0.52 -4.48 119.66 113.25 2bgo s GLN 23 Ca 0.54 0.39 -0.29 0.00 0.01 0.00 0.00 55.36 56.01 2bgo s GLN 23 Cb -0.48 -0.69 0.03 0.00 -1.01 0.00 0.00 33.01 30.85 2bgo s GLN 23 CO 0.63 -0.43 1.13 -1.17 0.01 0.00 0.00 175.29 175.46 2bgo s LEU 24 N 2.27 3.70 -0.99 2.90 1.98 -1.26 -1.93 118.68 125.34 2bgo s LEU 24 Ca 0.04 0.58 -0.18 0.00 -2.89 0.00 0.00 54.13 51.68 2bgo s LEU 24 Cb -0.13 -3.55 0.14 0.00 0.66 0.00 0.00 46.19 43.31 2bgo s LEU 24 CO -0.07 -1.18 1.19 -0.69 -1.89 0.00 0.00 176.35 173.71 2bgo s VAL 25 N 4.29 4.78 0.00 1.68 1.01 0.51 -4.66 120.40 128.02 2bgo s VAL 25 Ca 0.47 -1.79 0.00 0.00 0.00 0.00 0.00 61.98 60.67 2bgo s VAL 25 Cb -0.08 -4.81 0.00 0.00 0.00 0.00 0.00 36.38 31.49 2bgo s VAL 25 CO 0.28 -1.53 0.00 0.61 0.00 0.00 0.00 175.10 174.46 2bgo n GLY 26 N 5.22 1.05 0.00 4.51 0.00 -1.26 -2.57 105.19 112.14 2bgo n GLY 26 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2bgo n GLY 26 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bgo n ASN 27 N 2.42 0.00 -4.69 1.61 4.13 -1.26 -4.92 115.26 112.55 2bgo n ASN 27 Ca 0.00 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.84 2bgo n ASN 27 Cb 0.00 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.21 2bgo n ASN 27 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2bgo s VAL 28 N -1.00 4.84 0.57 2.41 1.01 -1.06 -3.74 120.40 123.43 2bgo s VAL 28 Ca 0.00 1.93 -0.14 0.00 0.00 0.00 0.00 61.98 63.77 2bgo s VAL 28 Cb 0.00 -4.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.06 2bgo s VAL 28 CO 0.00 0.05 1.01 -0.83 0.00 0.00 0.00 175.10 175.33 2bgo s GLY 29 N 1.07 1.88 -0.28 4.51 0.00 0.12 -0.36 107.32 114.25 2bgo s GLY 29 Ca 0.46 0.07 0.00 0.00 0.00 0.00 0.00 44.72 45.26 2bgo s GLY 29 CO 0.19 0.35 0.34 -0.54 0.00 0.00 0.00 173.10 173.44 2bgo s GLU 30 N -4.59 0.35 0.57 2.90 2.02 -0.81 0.85 118.70 120.00 2bgo s GLU 30 Ca 0.57 0.02 -0.12 0.00 0.02 0.00 0.00 54.97 55.47 2bgo s GLU 30 Cb -0.11 -0.53 -0.05 0.00 0.10 0.00 0.00 34.13 33.54 2bgo s GLU 30 CO 0.42 -0.99 0.99 -0.51 0.02 0.00 0.00 175.26 175.19 2bgo s LEU 31 N 2.44 3.38 0.00 1.80 1.43 0.06 -1.44 118.68 126.35 2bgo s LEU 31 Ca 0.10 1.41 0.00 0.00 -1.03 0.00 0.00 54.13 54.61 2bgo s LEU 31 Cb -0.13 -4.42 0.00 0.00 0.03 0.00 0.00 46.19 41.66 2bgo s LEU 31 CO -0.30 -0.76 0.00 1.67 0.23 0.00 0.00 176.35 177.19 2bgo n GLN 32 N -2.36 2.47 -0.97 1.70 7.27 -1.26 -2.10 117.38 122.14 2bgo n GLN 32 Ca 0.06 0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.76 2bgo n GLN 32 Cb 0.54 0.00 0.05 0.00 2.41 0.00 0.00 30.24 33.24 2bgo n GLN 32 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2bgo n GLY 33 N 3.09 -3.76 3.02 1.69 0.00 -0.38 -2.56 105.19 106.28 2bgo n GLY 33 Ca 0.00 -0.55 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 2bgo n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bgo n ALA 34 N -3.05 -5.51 0.00 4.61 0.00 -1.26 -3.51 120.51 111.80 2bgo n ALA 34 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.52 2bgo n ALA 34 Cb 0.63 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2bgo n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bgo n GLY 35 N 3.42 3.14 3.76 0.00 0.00 0.47 -4.62 105.19 111.36 2bgo n GLY 35 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2bgo n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bgo s SER 36 N 0.43 5.43 -0.33 1.61 0.01 -1.17 -4.54 113.70 115.13 2bgo s SER 36 Ca 0.00 2.25 0.06 0.00 1.31 0.00 0.00 55.95 59.57 2bgo s SER 36 Cb 0.00 -2.59 0.19 0.00 0.21 0.00 0.00 66.02 63.83 2bgo s SER 36 CO 0.00 -1.42 0.57 0.00 0.41 0.00 0.00 173.24 172.79 2bgo s ALA 37 N -1.75 -2.12 -1.00 1.44 0.00 -1.16 0.39 121.76 117.56 2bgo s ALA 37 Ca 0.74 0.59 -0.20 0.00 0.00 0.00 0.00 51.96 53.09 2bgo s ALA 37 Cb -0.26 -2.51 0.11 0.00 0.00 0.00 0.00 23.12 20.45 2bgo s ALA 37 CO 0.31 -1.95 1.28 0.08 0.00 0.00 0.00 175.76 175.48 2bgo s VAL 38 N 2.43 4.48 -0.36 0.00 1.01 0.43 -2.94 120.40 125.44 2bgo s VAL 38 Ca 0.12 -1.43 -0.18 0.00 0.00 0.00 0.00 61.98 60.49 2bgo s VAL 38 Cb -0.09 -4.90 -0.00 0.00 0.00 0.00 0.00 36.38 31.39 2bgo s VAL 38 CO -0.20 -1.67 0.53 -0.63 0.00 0.00 0.00 175.10 173.13 2bgo s ILE 39 N 3.37 5.00 0.32 2.22 -1.09 -0.61 0.12 121.20 130.53 2bgo s ILE 39 Ca 0.39 0.34 -0.21 0.00 -2.23 0.00 0.00 60.65 58.94 2bgo s ILE 39 Cb -0.03 -3.99 -0.09 0.00 -1.58 0.00 0.00 42.46 36.77 2bgo s ILE 39 CO -0.08 -0.25 0.84 0.26 -1.23 0.00 0.00 174.94 174.48 2bgo s TRP 40 N 2.44 3.53 -0.29 3.97 0.51 0.53 0.59 118.94 130.22 2bgo s TRP 40 Ca 0.19 1.52 -0.05 0.00 -2.12 0.00 0.00 56.10 55.65 2bgo s TRP 40 Cb -0.15 -2.75 0.02 0.00 -0.81 0.00 0.00 33.47 29.78 2bgo s TRP 40 CO 0.14 0.15 0.04 -0.80 -0.51 0.00 0.00 176.95 175.97 2bgo s ASN 41 N -1.88 4.93 0.05 2.95 -0.87 -1.26 -1.87 114.94 116.99 2bgo s ASN 41 Ca 0.52 -0.85 -0.13 0.00 -1.57 0.00 0.00 52.86 50.82 2bgo s ASN 41 Cb -0.14 -1.81 0.02 0.00 -0.02 0.00 0.00 41.25 39.29 2bgo s ASN 41 CO 0.19 -0.20 0.29 0.68 -2.57 0.00 0.00 177.10 175.49 2bgo s VAL 42 N 1.42 0.09 -0.21 1.60 -7.23 -1.25 -5.01 120.40 109.81 2bgo s VAL 42 Ca 0.01 -0.73 0.01 0.00 -1.81 0.00 0.00 61.98 59.46 2bgo s VAL 42 Cb -0.18 -0.97 0.03 0.00 0.56 0.00 0.00 36.38 35.82 2bgo s VAL 42 CO 0.00 -0.40 -0.16 1.51 -0.31 0.00 0.00 175.10 175.74 2bgo s ASP 43 N -2.15 3.59 -0.38 4.85 -4.77 -1.26 -3.59 116.67 112.97 2bgo s ASP 43 Ca -0.04 -0.83 -0.33 0.00 -3.30 0.00 0.00 52.55 48.05 2bgo s ASP 43 Cb -0.00 -1.52 -0.14 0.00 -1.09 0.00 0.00 42.92 40.16 2bgo s ASP 43 CO -0.04 -0.06 1.60 0.52 0.70 0.00 0.00 175.17 177.89 2bgo n VAL 44 N 4.59 0.00 -0.23 2.11 0.31 -1.26 -4.80 118.33 119.05 2bgo n VAL 44 Ca -0.19 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.11 2bgo n VAL 44 Cb 0.48 -0.38 0.08 0.00 -0.91 0.00 0.00 33.84 33.12 2bgo n VAL 44 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2bgo h PRO 45 N 6.72 0.73 0.00 5.55 0.13 -1.91 -3.35 132.00 139.88 2bgo h PRO 45 Ca -0.08 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.98 2bgo h PRO 45 Cb 1.06 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 2bgo h PRO 45 CO 0.82 0.48 0.04 1.33 -0.23 0.00 0.00 178.00 180.44 2bgo n VAL 46 N -4.73 0.00 -3.29 1.56 0.24 -1.26 -4.96 118.33 105.89 2bgo n VAL 46 Ca 0.08 -0.31 -0.46 0.00 -2.04 0.00 0.00 64.34 61.60 2bgo n VAL 46 Cb 0.13 0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.71 2bgo n VAL 46 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2bgo s THR 47 N -2.71 5.21 0.00 3.34 2.01 -1.26 -2.58 115.64 119.65 2bgo s THR 47 Ca 0.05 -1.57 0.00 0.00 0.31 0.00 0.00 61.69 60.48 2bgo s THR 47 Cb -0.01 -4.38 0.00 0.00 0.01 0.00 0.00 72.50 68.12 2bgo s THR 47 CO 0.04 -0.93 0.00 0.61 -0.69 0.00 0.00 174.62 173.65 2bgo n GLY 48 N 5.09 3.29 2.91 4.40 0.00 -0.10 -4.91 105.19 115.87 2bgo n GLY 48 Ca -0.10 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 2bgo n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bgo s GLU 49 N 3.43 1.43 -0.21 1.61 2.12 -1.26 -1.07 118.70 124.74 2bgo s GLU 49 Ca 0.00 -1.01 -0.05 0.00 0.36 0.00 0.00 54.97 54.27 2bgo s GLU 49 Cb 0.00 -2.53 -0.02 0.00 0.26 0.00 0.00 34.13 31.84 2bgo s GLU 49 CO 0.00 -0.67 0.00 0.71 -0.54 0.00 0.00 175.26 174.77 2bgo s TYR 50 N 1.42 3.03 -0.01 5.30 2.02 -0.92 -3.88 117.35 124.30 2bgo s TYR 50 Ca -0.03 -0.57 -0.26 0.00 -0.37 0.00 0.00 57.07 55.85 2bgo s TYR 50 Cb -0.19 -2.12 -0.04 0.00 -0.40 0.00 0.00 41.96 39.22 2bgo s TYR 50 CO -0.08 -0.34 0.80 -0.98 -1.57 0.00 0.00 175.55 173.38 2bgo s ARG 51 N 1.23 4.49 0.09 -0.62 1.70 0.42 -2.88 118.95 123.39 2bgo s ARG 51 Ca 0.03 1.09 -0.30 0.00 -0.47 0.00 0.00 55.73 56.08 2bgo s ARG 51 Cb -0.15 -3.42 -0.05 0.00 -0.57 0.00 0.00 34.95 30.76 2bgo s ARG 51 CO 0.01 0.10 1.01 0.42 -1.08 0.00 0.00 175.30 175.76 2bgo s ILE 52 N 0.58 4.45 -0.25 4.99 -1.09 0.69 -2.05 121.20 128.52 2bgo s ILE 52 Ca 0.42 1.95 -0.02 0.00 -2.23 0.00 0.00 60.65 60.76 2bgo s ILE 52 Cb -0.20 -4.25 0.08 0.00 -1.58 0.00 0.00 42.46 36.52 2bgo s ILE 52 CO 0.22 0.26 0.07 0.20 -1.23 0.00 0.00 174.94 174.46 2bgo s ASN 53 N 0.31 3.40 -0.30 3.58 -0.87 0.49 0.14 114.94 121.69 2bgo s ASN 53 Ca 0.49 -1.18 -0.12 0.00 -1.57 0.00 0.00 52.86 50.49 2bgo s ASN 53 Cb -0.24 -0.65 -0.04 0.00 -0.02 0.00 0.00 41.25 40.30 2bgo s ASN 53 CO 0.30 -0.36 0.23 -0.76 -2.57 0.00 0.00 177.10 173.94 2bgo s LEU 54 N 1.81 4.16 -0.21 0.60 1.43 -0.76 -0.73 118.68 124.98 2bgo s LEU 54 Ca 0.04 -0.08 -0.18 0.00 -1.03 0.00 0.00 54.13 52.88 2bgo s LEU 54 Cb -0.17 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.85 2bgo s LEU 54 CO -0.18 -0.12 0.51 -0.89 0.23 0.00 0.00 176.35 175.89 2bgo s THR 55 N 1.80 5.11 0.19 5.49 2.01 -0.95 -0.34 115.64 128.95 2bgo s THR 55 Ca 0.08 0.93 -0.07 0.00 0.31 0.00 0.00 61.69 62.94 2bgo s THR 55 Cb -0.16 -3.83 -0.02 0.00 0.01 0.00 0.00 72.50 68.50 2bgo s THR 55 CO 0.11 0.17 0.27 -1.66 -0.69 0.00 0.00 174.62 172.82 2bgo s TRP 56 N 1.68 0.60 -0.46 4.92 1.48 -0.99 -1.20 118.94 124.96 2bgo s TRP 56 Ca 0.23 -0.93 0.06 0.00 -1.06 0.00 0.00 56.10 54.40 2bgo s TRP 56 Cb -0.15 -0.15 0.18 0.00 -1.16 0.00 0.00 33.47 32.18 2bgo s TRP 56 CO 0.09 -0.74 0.60 -1.54 -4.06 0.00 0.00 176.95 171.30 2bgo s SER 57 N -3.03 -0.67 -0.70 -2.66 1.04 -1.20 -3.04 113.70 103.44 2bgo s SER 57 Ca 0.24 -1.73 0.03 0.00 0.48 0.00 0.00 55.95 54.97 2bgo s SER 57 Cb 0.04 1.37 0.17 0.00 0.10 0.00 0.00 66.02 67.70 2bgo s SER 57 CO 0.05 -0.12 0.50 -0.55 0.98 0.00 0.00 173.24 174.09 2bgo s SER 58 N 1.02 4.98 -0.51 7.02 0.15 0.25 -4.20 113.70 122.42 2bgo s SER 58 Ca 0.26 -3.59 -0.26 0.00 0.70 0.00 0.00 55.95 53.05 2bgo s SER 58 Cb -0.02 -1.71 -0.06 0.00 -1.71 0.00 0.00 66.02 62.52 2bgo s SER 58 CO -0.07 -0.15 2.31 -2.84 1.20 0.00 0.00 173.24 173.68 2bgo s PRO 59 N -1.11 2.21 0.00 5.44 0.02 -0.63 -3.74 135.00 137.20 2bgo s PRO 59 Ca 0.23 1.28 0.00 0.00 0.02 0.00 0.00 61.00 62.53 2bgo s PRO 59 Cb -0.10 -4.54 0.00 0.00 0.02 0.00 0.00 34.50 29.87 2bgo s PRO 59 CO -0.12 -3.16 0.00 0.66 -0.33 0.00 0.00 177.00 174.06 2bgo n TYR 60 N 15.26 0.00 0.00 6.54 4.02 -1.26 -5.06 117.16 136.67 2bgo n TYR 60 Ca 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.23 2bgo n TYR 60 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 2bgo n TYR 60 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2bgo n SER 61 N -0.66 0.00 0.00 7.72 7.64 -1.26 -4.95 113.62 122.11 2bgo n SER 61 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2bgo n SER 61 Cb 0.00 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 2bgo n SER 61 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2bgo n SER 62 N -1.50 0.00 -4.97 6.43 2.88 -1.25 -1.91 113.62 113.30 2bgo n SER 62 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 2bgo n SER 62 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 2bgo n SER 62 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2bgo s LYS 63 N 0.00 2.52 -0.79 -1.46 3.01 0.11 -4.82 119.74 118.31 2bgo s LYS 63 Ca 0.00 -0.79 0.02 0.00 -1.01 0.00 0.00 55.97 54.19 2bgo s LYS 63 Cb 0.00 -2.48 0.20 0.00 -1.01 0.00 0.00 37.83 34.54 2bgo s LYS 63 CO 0.00 -0.73 0.65 0.28 0.51 0.00 0.00 175.35 176.06 2bgo n VAL 64 N -2.36 2.34 -4.26 3.17 0.31 -1.24 0.13 118.33 116.42 2bgo n VAL 64 Ca 0.08 -5.02 -0.26 0.00 -0.01 0.00 0.00 64.34 59.13 2bgo n VAL 64 Cb 0.60 -2.26 -0.08 0.00 -0.91 0.00 0.00 33.84 31.19 2bgo n VAL 64 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2bgo s ASN 65 N -1.05 4.50 -0.29 4.52 0.02 -0.98 -1.29 114.94 120.38 2bgo s ASN 65 Ca 0.27 -0.53 -0.02 0.00 -1.02 0.00 0.00 52.86 51.56 2bgo s ASN 65 Cb -0.04 -0.85 0.04 0.00 0.02 0.00 0.00 41.25 40.43 2bgo s ASN 65 CO -0.14 0.08 -0.01 -0.89 0.02 0.00 0.00 177.10 176.16 2bgo s THR 66 N -1.85 3.03 0.15 1.60 2.01 -1.00 -1.84 115.64 117.73 2bgo s THR 66 Ca 0.27 -1.29 -0.30 0.00 0.31 0.00 0.00 61.69 60.68 2bgo s THR 66 Cb -0.08 -2.70 -0.07 0.00 0.01 0.00 0.00 72.50 69.66 2bgo s THR 66 CO 0.17 -0.05 1.16 -0.22 -0.69 0.00 0.00 174.62 175.00 2bgo s LEU 67 N 1.28 4.44 -0.38 4.42 2.96 -0.11 -1.83 118.68 129.47 2bgo s LEU 67 Ca -0.04 2.12 -0.07 0.00 -0.22 0.00 0.00 54.13 55.92 2bgo s LEU 67 Cb -0.19 -3.60 0.06 0.00 0.50 0.00 0.00 46.19 42.96 2bgo s LEU 67 CO -0.01 -0.34 0.18 -0.69 -1.32 0.00 0.00 176.35 174.16 2bgo s VAL 68 N 0.19 3.93 -0.05 1.68 1.01 -0.85 -1.88 120.40 124.42 2bgo s VAL 68 Ca 0.53 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2bgo s VAL 68 Cb -0.31 -3.34 0.03 0.00 0.00 0.00 0.00 36.38 32.76 2bgo s VAL 68 CO 0.34 -0.36 0.02 -0.04 0.00 0.00 0.00 175.10 175.06 2bgo s MET 69 N 1.39 0.34 -1.07 2.72 -1.94 -1.08 0.12 119.30 119.78 2bgo s MET 69 Ca 0.01 0.18 -0.05 0.00 -1.71 0.00 0.00 55.69 54.13 2bgo s MET 69 Cb -0.21 -0.73 0.01 0.00 2.01 0.00 0.00 34.83 35.90 2bgo s MET 69 CO 0.02 -0.27 0.92 -3.47 -0.01 0.00 0.00 175.02 172.21 2bgo n ASP 70 N 4.98 -4.25 -0.61 3.03 2.03 -1.26 -1.95 116.55 118.51 2bgo n ASP 70 Ca -0.10 -0.47 -0.08 0.00 0.52 0.00 0.00 54.79 54.66 2bgo n ASP 70 Cb 0.50 -4.27 -0.03 0.00 -0.72 0.00 0.00 41.12 36.59 2bgo n ASP 70 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bgo n GLY 71 N -1.51 0.87 3.91 0.27 0.00 -1.24 -4.97 105.19 102.52 2bgo n GLY 71 Ca -0.09 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 2bgo n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bgo s THR 72 N -1.92 5.43 -0.79 2.61 2.01 -0.82 -5.05 115.64 117.10 2bgo s THR 72 Ca 0.00 -0.19 0.02 0.00 0.31 0.00 0.00 61.69 61.83 2bgo s THR 72 Cb 0.00 -3.56 0.25 0.00 0.01 0.00 0.00 72.50 69.20 2bgo s THR 72 CO 0.00 0.30 0.87 0.00 -0.69 0.00 0.00 174.62 175.10 2bgo n ALA 73 N 0.84 4.16 -2.57 7.40 0.00 -1.26 -2.63 120.51 126.45 2bgo n ALA 73 Ca -0.10 -4.72 -0.42 0.00 0.00 0.00 0.00 53.44 48.20 2bgo n ALA 73 Cb 0.52 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.57 2bgo n ALA 73 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2bgo s LEU 74 N -2.19 3.45 -0.11 0.00 0.05 -0.79 -4.92 118.68 114.18 2bgo s LEU 74 Ca 0.34 0.13 -0.24 0.00 0.05 0.00 0.00 54.13 54.41 2bgo s LEU 74 Cb 0.06 -3.16 -0.03 0.00 -2.05 0.00 0.00 46.19 41.00 2bgo s LEU 74 CO -0.03 -1.50 0.72 -0.55 -0.55 0.00 0.00 176.35 174.44 2bgo s SER 75 N 3.05 6.94 -0.02 1.48 0.15 -1.26 -0.93 113.70 123.11 2bgo s SER 75 Ca 0.44 1.14 -0.30 0.00 0.70 0.00 0.00 55.95 57.93 2bgo s SER 75 Cb -0.08 -2.41 0.07 0.00 -1.71 0.00 0.00 66.02 61.89 2bgo s SER 75 CO 0.25 -0.20 0.68 -0.72 1.20 0.00 0.00 173.24 174.45 2bgo s TYR 76 N 1.24 -0.64 -0.50 3.44 1.13 -0.77 -4.99 117.35 116.27 2bgo s TYR 76 Ca 0.37 1.01 -0.29 0.00 -1.41 0.00 0.00 57.07 56.74 2bgo s TYR 76 Cb -0.17 0.43 0.03 0.00 -1.10 0.00 0.00 41.96 41.15 2bgo s TYR 76 CO 0.16 -0.64 1.17 0.00 -2.51 0.00 0.00 175.55 173.73 2bgo s ALA 77 N -1.55 3.10 -0.53 9.51 0.00 -1.25 -2.31 121.76 128.73 2bgo s ALA 77 Ca -0.09 -0.55 -0.26 0.00 0.00 0.00 0.00 51.96 51.06 2bgo s ALA 77 Cb -0.00 -3.94 -0.08 0.00 0.00 0.00 0.00 23.12 19.10 2bgo s ALA 77 CO 0.07 -2.38 2.43 1.19 0.00 0.00 0.00 175.76 177.06 2bgo n PHE 78 N 8.08 1.38 -0.96 0.00 3.72 0.35 -4.65 117.46 125.38 2bgo n PHE 78 Ca 0.11 0.12 -0.38 0.00 -0.05 0.00 0.00 57.45 57.26 2bgo n PHE 78 Cb 0.49 -2.63 0.05 0.00 -0.94 0.00 0.00 39.48 36.45 2bgo n PHE 78 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2bgo n ALA 79 N 15.94 -5.55 -1.02 4.37 0.00 -1.26 0.05 120.51 133.04 2bgo n ALA 79 Ca 0.39 -1.25 -0.34 0.00 0.00 0.00 0.00 53.44 52.23 2bgo n ALA 79 Cb 0.52 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 19.00 2bgo n ALA 79 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2bgo n GLU 80 N 1.96 1.90 -3.09 0.00 0.00 -0.80 -4.46 120.64 116.15 2bgo n GLU 80 Ca -0.02 -1.74 -0.37 0.00 0.00 0.00 0.00 57.16 55.03 2bgo n GLU 80 Cb 0.71 -2.74 -0.06 0.00 0.00 0.00 0.00 31.44 29.34 2bgo n GLU 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bgo s ALA 81 N 4.12 3.44 0.00 4.31 0.00 -1.25 -4.75 121.76 127.64 2bgo s ALA 81 Ca 0.49 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.64 2bgo s ALA 81 Cb 0.13 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.42 2bgo s ALA 81 CO 0.03 0.33 0.00 -2.37 0.00 0.00 0.00 175.76 173.75 2bgo n THR 82 N 0.96 0.00 -2.78 0.00 5.66 -1.26 0.88 114.28 117.74 2bgo n THR 82 Ca -0.04 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.60 2bgo n THR 82 Cb 0.51 -0.62 -0.06 0.00 -1.55 0.00 0.00 70.33 68.60 2bgo n THR 82 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2bgo s VAL 83 N -1.92 4.22 -0.44 1.08 1.01 -1.26 -4.46 120.40 118.63 2bgo s VAL 83 Ca 0.00 1.76 -0.08 0.00 0.00 0.00 0.00 61.98 63.66 2bgo s VAL 83 Cb 0.00 -3.94 -0.12 0.00 0.00 0.00 0.00 36.38 32.32 2bgo s VAL 83 CO 0.00 0.06 1.52 -2.65 0.00 0.00 0.00 175.10 174.03 2bgo n PRO 84 N 0.35 0.05 -3.60 2.72 -0.02 -1.26 -4.74 135.00 128.51 2bgo n PRO 84 Ca 0.03 -0.31 -0.37 0.00 -2.02 0.00 0.00 63.50 60.83 2bgo n PRO 84 Cb 0.51 -1.62 -0.09 0.00 -0.02 0.00 0.00 33.50 32.28 2bgo n PRO 84 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bgo s VAL 85 N 3.61 5.32 -0.50 -1.45 1.01 -1.17 -4.90 120.40 122.32 2bgo s VAL 85 Ca 0.48 0.31 -0.16 0.00 0.00 0.00 0.00 61.98 62.61 2bgo s VAL 85 Cb -0.21 -3.56 0.09 0.00 0.00 0.00 0.00 36.38 32.71 2bgo s VAL 85 CO 0.16 0.33 0.48 -0.89 0.00 0.00 0.00 175.10 175.18 2bgo s THR 86 N 1.07 5.15 -0.38 3.92 2.01 -1.25 -2.35 115.64 123.81 2bgo s THR 86 Ca 0.10 -1.11 -0.28 0.00 0.31 0.00 0.00 61.69 60.72 2bgo s THR 86 Cb -0.14 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 2bgo s THR 86 CO 0.05 -0.73 2.02 -0.47 -0.69 0.00 0.00 174.62 174.80 2bgo s TYR 87 N 1.83 1.49 -0.18 4.92 6.14 0.54 -4.62 117.35 127.48 2bgo s TYR 87 Ca 0.06 0.80 -0.25 0.00 0.64 0.00 0.00 57.07 58.31 2bgo s TYR 87 Cb -0.25 -3.98 -0.01 0.00 0.42 0.00 0.00 41.96 38.14 2bgo s TYR 87 CO 0.06 -3.05 0.83 0.08 0.64 0.00 0.00 175.55 174.12 2bgo s VAL 88 N 8.56 4.88 -0.14 3.14 1.01 -1.25 -1.83 120.40 134.76 2bgo s VAL 88 Ca 0.86 1.63 -0.04 0.00 0.00 0.00 0.00 61.98 64.43 2bgo s VAL 88 Cb -0.22 -4.14 0.05 0.00 0.00 0.00 0.00 36.38 32.07 2bgo s VAL 88 CO 0.30 0.02 0.07 -1.58 0.00 0.00 0.00 175.10 173.91 2bgo s GLN 89 N 2.21 0.13 -0.29 2.72 0.74 0.37 -4.95 119.66 120.59 2bgo s GLN 89 Ca 0.38 -0.02 -0.29 0.00 0.05 0.00 0.00 55.36 55.48 2bgo s GLN 89 Cb -0.16 -1.56 0.01 0.00 1.10 0.00 0.00 33.01 32.39 2bgo s GLN 89 CO 0.12 -0.58 1.11 0.95 -0.55 0.00 0.00 175.29 176.34 2bgo s THR 90 N 2.10 4.47 -0.09 -0.34 -4.23 -1.26 0.25 115.64 116.54 2bgo s THR 90 Ca 0.02 1.71 0.00 0.00 -1.18 0.00 0.00 61.69 62.24 2bgo s THR 90 Cb -0.15 -4.34 0.02 0.00 1.34 0.00 0.00 72.50 69.37 2bgo s THR 90 CO -0.07 -0.41 -0.06 -0.75 -0.54 0.00 0.00 174.62 172.78 2bgo s LYS 91 N 3.65 1.25 -0.32 3.99 2.47 -1.14 -4.91 119.74 124.73 2bgo s LYS 91 Ca 0.47 -0.18 -0.29 0.00 -1.56 0.00 0.00 55.97 54.42 2bgo s LYS 91 Cb -0.14 -1.31 -0.01 0.00 -1.46 0.00 0.00 37.83 34.91 2bgo s LYS 91 CO 0.15 -0.20 1.68 0.99 0.16 0.00 0.00 175.35 178.13 2bgo s THR 92 N 1.47 3.62 0.03 3.43 2.01 -1.26 -2.18 115.64 122.76 2bgo s THR 92 Ca -0.01 0.64 -0.14 0.00 0.31 0.00 0.00 61.69 62.50 2bgo s THR 92 Cb -0.13 -3.77 -0.06 0.00 0.01 0.00 0.00 72.50 68.55 2bgo s THR 92 CO -0.04 -0.45 0.42 -0.76 -0.69 0.00 0.00 174.62 173.09 2bgo s LEU 93 N 6.17 4.45 0.06 4.42 1.43 -0.23 -4.87 118.68 130.11 2bgo s LEU 93 Ca 0.74 0.95 0.08 0.00 -1.03 0.00 0.00 54.13 54.87 2bgo s LEU 93 Cb -0.21 -2.71 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 2bgo s LEU 93 CO 0.32 0.28 -0.19 -0.94 0.23 0.00 0.00 176.35 176.06 2bgo s SER 94 N -1.24 3.76 0.58 2.29 1.04 -1.26 -0.92 113.70 117.95 2bgo s SER 94 Ca 0.26 -0.48 -0.18 0.00 0.48 0.00 0.00 55.95 56.04 2bgo s SER 94 Cb -0.16 -0.56 -0.08 0.00 0.10 0.00 0.00 66.02 65.32 2bgo s SER 94 CO 0.15 0.24 0.59 0.00 0.98 0.00 0.00 173.24 175.19 2bgo n ALA 95 N 1.37 -0.96 0.00 5.32 0.00 -1.07 -4.62 120.51 120.55 2bgo n ALA 95 Ca -0.16 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2bgo n ALA 95 Cb 0.52 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.10 2bgo n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bgo n GLY 96 N 1.71 0.74 3.61 0.00 0.00 -1.26 -4.98 105.19 105.01 2bgo n GLY 96 Ca 0.12 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 2bgo n GLY 96 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bgo s ASN 97 N -4.00 -0.49 0.26 1.61 2.47 -1.26 -4.01 114.94 109.52 2bgo s ASN 97 Ca 0.00 0.80 -0.21 0.00 0.42 0.00 0.00 52.86 53.86 2bgo s ASN 97 Cb 0.00 0.75 0.03 0.00 -1.45 0.00 0.00 41.25 40.58 2bgo s ASN 97 CO 0.00 -0.27 0.73 -1.38 -3.72 0.00 0.00 177.10 172.46 2bgo s HIS 98 N -0.30 -0.21 -0.22 0.43 -3.43 -1.24 -4.89 115.29 105.43 2bgo s HIS 98 Ca -0.00 -0.23 0.02 0.00 -0.80 0.00 0.00 55.06 54.05 2bgo s HIS 98 Cb -0.03 0.70 0.04 0.00 -1.43 0.00 0.00 32.58 31.86 2bgo s HIS 98 CO -0.01 -1.19 -0.15 -1.54 -2.00 0.00 0.00 174.74 169.85 2bgo s SER 99 N -2.91 3.87 0.68 7.38 1.04 -1.26 -3.91 113.70 118.59 2bgo s SER 99 Ca 0.10 -1.05 -0.00 0.00 0.48 0.00 0.00 55.95 55.48 2bgo s SER 99 Cb -0.05 -1.52 0.10 0.00 0.10 0.00 0.00 66.02 64.64 2bgo s SER 99 CO 0.05 -0.10 0.94 -0.36 0.98 0.00 0.00 173.24 174.76 2bgo s PHE 100 N 1.19 1.91 -5.00 5.02 0.40 -0.78 -3.60 117.98 117.12 2bgo s PHE 100 Ca -0.02 -0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.11 2bgo s PHE 100 Cb -0.17 -2.94 0.00 0.00 0.51 0.00 0.00 43.02 40.42 2bgo s PHE 100 CO -0.08 -1.51 0.00 0.41 0.70 0.00 0.00 175.22 174.73 2bgo n GLY 101 N -2.72 0.06 3.33 4.36 0.00 0.33 0.20 105.19 110.74 2bgo n GLY 101 Ca 0.13 -1.23 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 2bgo n GLY 101 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bgo s VAL 102 N -3.66 -0.39 0.15 1.61 1.01 0.34 -2.02 120.40 117.44 2bgo s VAL 102 Ca 0.00 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.19 2bgo s VAL 102 Cb 0.00 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2bgo s VAL 102 CO 0.00 0.05 -0.23 -0.60 0.00 0.00 0.00 175.10 174.32 2bgo s ARG 103 N 2.10 1.33 -0.01 2.72 6.06 -0.76 0.16 118.95 130.56 2bgo s ARG 103 Ca -0.06 -1.36 0.01 0.00 -2.50 0.00 0.00 55.73 51.82 2bgo s ARG 103 Cb -0.10 -1.63 0.00 0.00 0.06 0.00 0.00 34.95 33.28 2bgo s ARG 103 CO -0.14 0.37 -0.03 0.14 -2.50 0.00 0.00 175.30 173.14 2bgo s VAL 104 N -1.46 0.25 0.04 7.11 -7.23 0.16 -2.38 120.40 116.89 2bgo s VAL 104 Ca 0.14 -0.10 -0.00 0.00 -1.81 0.00 0.00 61.98 60.21 2bgo s VAL 104 Cb -0.09 -0.24 0.00 0.00 0.56 0.00 0.00 36.38 36.61 2bgo s VAL 104 CO 0.07 0.09 0.06 0.61 -0.31 0.00 0.00 175.10 175.61 2bgo n GLY 105 N 3.25 2.99 0.30 2.32 0.00 0.14 0.18 105.19 114.37 2bgo n GLY 105 Ca -0.16 -1.39 0.05 0.00 0.00 0.00 0.00 46.02 44.52 2bgo n GLY 105 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bgo h SER 106 N 0.22 0.53 1.06 1.61 4.64 -1.98 0.42 113.55 120.05 2bgo h SER 106 Ca -0.03 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2bgo h SER 106 Cb 0.13 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2bgo h SER 106 CO 0.04 0.26 0.00 0.28 -0.87 0.00 0.00 176.83 176.54 2bgo h SER 107 N 0.65 0.00 -1.32 4.97 0.02 -1.96 -3.37 113.55 112.54 2bgo h SER 107 Ca 0.42 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 61.11 2bgo h SER 107 Cb 0.51 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.84 2bgo h SER 107 CO -0.32 0.00 -0.61 -0.90 -1.14 0.00 0.00 176.83 173.86 2bgo n ASP 108 N -2.48 -2.73 -4.70 3.07 5.75 0.11 -5.00 116.55 110.56 2bgo n ASP 108 Ca 0.03 -2.79 -0.33 0.00 -0.01 0.00 0.00 54.79 51.69 2bgo n ASP 108 Cb 0.31 1.20 0.13 0.00 -1.03 0.00 0.00 41.12 41.73 2bgo n ASP 108 CO 0.00 0.00 0.00 -1.66 -0.11 0.00 0.00 177.20 175.43 2bgo s TRP 109 N 0.67 1.88 0.41 2.11 1.48 0.11 0.26 118.94 125.85 2bgo s TRP 109 Ca 0.31 1.69 0.07 0.00 -1.06 0.00 0.00 56.10 57.10 2bgo s TRP 109 Cb 0.01 -3.39 -0.08 0.00 -1.16 0.00 0.00 33.47 28.86 2bgo s TRP 109 CO -0.09 -2.66 0.01 0.20 -4.06 0.00 0.00 176.95 170.35 2bgo s GLY 110 N -2.42 2.49 0.00 3.67 0.00 -1.14 -3.42 107.32 106.50 2bgo s GLY 110 Ca 0.70 -2.22 0.00 0.00 0.00 0.00 0.00 44.72 43.20 2bgo s GLY 110 CO 0.52 -2.08 0.00 -1.72 0.00 0.00 0.00 173.10 169.82 2bgo n TYR 111 N -0.96 0.00 -3.97 1.90 4.01 -1.06 -1.25 117.16 115.83 2bgo n TYR 111 Ca -0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.67 2bgo n TYR 111 Cb 0.67 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.69 2bgo n TYR 111 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bgo n MET 112 N 0.00 0.04 -4.99 -0.72 0.00 -0.89 -4.95 117.12 105.61 2bgo n MET 112 Ca 0.00 -0.27 -0.32 0.00 0.00 0.00 0.00 57.70 57.10 2bgo n MET 112 Cb 0.00 0.23 -0.15 0.00 0.00 0.00 0.00 33.22 33.30 2bgo n MET 112 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 2bgo s ASN 113 N -1.19 3.59 -0.90 3.17 0.01 -1.26 -0.76 114.94 117.61 2bgo s ASN 113 Ca 0.03 -0.42 -0.09 0.00 -0.71 0.00 0.00 52.86 51.68 2bgo s ASN 113 Cb 0.00 -1.40 0.23 0.00 0.41 0.00 0.00 41.25 40.49 2bgo s ASN 113 CO 0.02 0.19 0.83 -0.69 -1.51 0.00 0.00 177.10 175.94 2bgo s VAL 114 N 0.20 5.27 0.10 1.60 1.01 0.25 -3.22 120.40 125.62 2bgo s VAL 114 Ca -0.11 -3.05 -0.25 0.00 0.00 0.00 0.00 61.98 58.57 2bgo s VAL 114 Cb -0.16 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 31.87 2bgo s VAL 114 CO 0.06 -1.06 1.69 -0.74 0.00 0.00 0.00 175.10 175.04 2bgo h HIS 115 N 7.06 -0.34 -1.39 5.22 2.76 -1.32 0.34 115.15 127.47 2bgo h HIS 115 Ca 0.12 0.00 0.33 0.00 -2.20 0.00 0.00 60.37 58.63 2bgo h HIS 115 Cb 0.94 0.14 -0.13 0.00 1.55 0.00 0.00 27.41 29.92 2bgo h HIS 115 CO 0.86 -0.20 0.85 0.45 -1.30 0.00 0.00 177.93 178.58 2bgo s SER 116 N -4.96 -0.05 -0.59 3.26 0.15 -1.13 -4.28 113.70 106.10 2bgo s SER 116 Ca -0.15 -0.11 -0.00 0.00 0.70 0.00 0.00 55.95 56.39 2bgo s SER 116 Cb 0.07 0.14 0.15 0.00 -1.71 0.00 0.00 66.02 64.67 2bgo s SER 116 CO 0.66 -0.26 0.38 -0.22 1.20 0.00 0.00 173.24 174.99 2bgo s LEU 117 N -2.95 4.93 0.09 3.45 0.20 -1.05 -2.24 118.68 121.11 2bgo s LEU 117 Ca 0.14 -2.91 -0.21 0.00 0.69 0.00 0.00 54.13 51.84 2bgo s LEU 117 Cb 0.05 -1.78 -0.07 0.00 -0.43 0.00 0.00 46.19 43.96 2bgo s LEU 117 CO -0.04 -0.32 0.62 -0.75 -0.29 0.00 0.00 176.35 175.57 2bgo s LYS 118 N -0.15 4.30 -0.06 1.98 2.20 0.09 -2.56 119.74 125.55 2bgo s LYS 118 Ca 0.17 0.85 0.01 0.00 -0.36 0.00 0.00 55.97 56.63 2bgo s LYS 118 Cb -0.22 -3.25 0.02 0.00 -1.51 0.00 0.00 37.83 32.87 2bgo s LYS 118 CO -0.02 0.60 -0.06 -0.51 -0.36 0.00 0.00 175.35 175.00 2bgo s LEU 119 N -1.05 1.32 0.13 5.43 1.43 -1.17 -0.38 118.68 124.38 2bgo s LEU 119 Ca 0.31 -0.18 0.09 0.00 -1.03 0.00 0.00 54.13 53.32 2bgo s LEU 119 Cb -0.20 -0.57 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 2bgo s LEU 119 CO 0.21 -0.05 -0.16 -0.70 0.23 0.00 0.00 176.35 175.87 2bgo s GLU 120 N 1.04 1.85 -0.30 1.70 2.12 -0.87 -2.94 118.70 121.29 2bgo s GLU 120 Ca -0.09 -1.20 -0.00 0.00 0.36 0.00 0.00 54.97 54.04 2bgo s GLU 120 Cb -0.14 -2.12 0.24 0.00 0.26 0.00 0.00 34.13 32.36 2bgo s GLU 120 CO -0.00 0.47 1.91 1.28 -0.54 0.00 0.00 175.26 178.38 2bgo n LEU 121 N 0.63 6.17 -2.28 2.70 7.99 -1.26 -0.43 117.00 130.52 2bgo n LEU 121 Ca -0.14 -3.16 -0.08 0.00 -0.01 0.00 0.00 56.01 52.62 2bgo n LEU 121 Cb 0.53 -0.98 -0.01 0.00 -0.11 0.00 0.00 43.42 42.85 2bgo n LEU 121 CO 0.30 1.14 -0.10 0.18 -1.51 0.00 0.00 177.39 177.41 2bgo n LEU 122 N 0.22 -0.71 0.00 2.23 4.77 -1.25 -4.91 117.00 117.34 2bgo n LEU 122 Ca 0.30 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 2bgo n LEU 122 Cb 0.67 -1.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 2bgo n LEU 122 CO 0.37 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.90