#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bgx s GLU 6 N 0.00 4.12 -0.08 3.69 8.01 -1.26 -3.49 118.70 129.69 1bgx s GLU 6 Ca 0.00 1.58 0.04 0.00 0.01 0.00 0.00 54.97 56.60 1bgx s GLU 6 Cb 0.00 -3.82 -0.01 0.00 -4.31 0.00 0.00 34.13 25.98 1bgx s GLU 6 CO 0.00 -0.86 -0.21 -1.12 0.01 0.00 0.00 175.26 173.08 1bgx s SER 7 N 2.41 3.40 0.00 -0.19 0.01 -0.67 -4.99 113.70 113.67 1bgx s SER 7 Ca 0.57 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.39 1bgx s SER 7 Cb -0.21 -1.10 0.00 0.00 0.21 0.00 0.00 66.02 64.92 1bgx s SER 7 CO 0.18 0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.67 1bgx n GLY 8 N 3.07 -1.08 3.85 3.44 0.00 -1.26 -2.00 105.19 111.21 1bgx n GLY 8 Ca -0.18 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.54 1bgx n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bgx s PRO 9 N -1.08 3.94 0.07 1.61 0.04 -1.26 -4.98 135.00 133.34 1bgx s PRO 9 Ca 0.00 0.80 0.23 0.00 0.04 0.00 0.00 61.00 62.07 1bgx s PRO 9 Cb 0.00 -2.25 0.13 0.00 0.04 0.00 0.00 34.50 32.42 1bgx s PRO 9 CO 0.00 -0.13 1.10 0.41 0.04 0.00 0.00 177.00 178.43 1bgx n GLY 10 N -1.25 -1.26 3.06 0.56 0.00 -1.26 -4.87 105.19 100.17 1bgx n GLY 10 Ca 0.05 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 1bgx n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bgx s LEU 11 N -4.00 1.48 -0.06 0.99 2.96 -1.26 -3.70 118.68 115.09 1bgx s LEU 11 Ca 0.04 0.08 -0.08 0.00 -0.22 0.00 0.00 54.13 53.96 1bgx s LEU 11 Cb 0.14 0.59 0.02 0.00 0.50 0.00 0.00 46.19 47.43 1bgx s LEU 11 CO 0.78 -0.19 0.20 0.54 -1.32 0.00 0.00 176.35 176.36 1bgx s VAL 12 N -0.57 0.02 0.50 1.68 0.11 -1.22 -5.04 120.40 115.88 1bgx s VAL 12 Ca -0.07 -0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 58.74 1bgx s VAL 12 Cb -0.04 -0.33 -0.05 0.00 -1.53 0.00 0.00 36.38 34.43 1bgx s VAL 12 CO 0.01 -0.08 0.88 -0.54 -3.33 0.00 0.00 175.10 172.04 1bgx s LYS 13 N -0.22 3.69 0.67 1.54 -0.14 -1.26 -2.01 119.74 122.01 1bgx s LYS 13 Ca -0.03 0.54 -0.15 0.00 -1.36 0.00 0.00 55.97 54.96 1bgx s LYS 13 Cb -0.03 -2.27 0.00 0.00 -1.68 0.00 0.00 37.83 33.86 1bgx s LYS 13 CO 0.01 -0.26 1.13 -2.14 -0.76 0.00 0.00 175.35 173.33 1bgx s PRO 14 N -4.49 2.69 -1.09 -1.68 0.02 -1.26 -3.63 135.00 125.55 1bgx s PRO 14 Ca 0.52 1.49 0.00 0.00 0.02 0.00 0.00 61.00 63.04 1bgx s PRO 14 Cb -0.10 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1bgx s PRO 14 CO 0.41 -1.36 0.00 0.66 -0.33 0.00 0.00 177.00 176.39 1bgx n TYR 15 N -2.40 0.00 -3.03 6.54 4.01 -0.42 -4.96 117.16 116.90 1bgx n TYR 15 Ca 0.11 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.71 1bgx n TYR 15 Cb 0.51 -2.68 0.05 0.00 -0.31 0.00 0.00 39.34 36.92 1bgx n TYR 15 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1bgx n GLN 16 N -0.79 0.71 -4.10 -0.72 6.02 -1.24 -4.43 117.38 112.83 1bgx n GLN 16 Ca -0.10 -2.33 -0.35 0.00 -0.01 0.00 0.00 57.00 54.21 1bgx n GLN 16 Cb 0.58 -0.18 -0.10 0.00 1.02 0.00 0.00 30.24 31.56 1bgx n GLN 16 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1bgx s SER 17 N -3.68 5.55 -0.00 1.08 0.01 -1.26 -1.89 113.70 113.50 1bgx s SER 17 Ca 0.45 0.11 -0.08 0.00 1.31 0.00 0.00 55.95 57.74 1bgx s SER 17 Cb -0.04 -1.88 -0.05 0.00 0.21 0.00 0.00 66.02 64.27 1bgx s SER 17 CO 0.29 0.23 0.29 -0.22 0.41 0.00 0.00 173.24 174.24 1bgx s LEU 18 N 0.03 4.39 -0.17 2.44 2.96 -0.56 -4.96 118.68 122.81 1bgx s LEU 18 Ca 0.05 0.64 -0.02 0.00 -0.22 0.00 0.00 54.13 54.58 1bgx s LEU 18 Cb -0.12 -2.60 0.05 0.00 0.50 0.00 0.00 46.19 44.02 1bgx s LEU 18 CO 0.01 0.28 0.01 -0.44 -1.32 0.00 0.00 176.35 174.89 1bgx s SER 19 N -1.50 2.76 0.32 3.68 0.01 -1.26 -2.62 113.70 115.09 1bgx s SER 19 Ca 0.26 -0.71 0.07 0.00 1.31 0.00 0.00 55.95 56.88 1bgx s SER 19 Cb -0.14 -0.65 -0.06 0.00 0.21 0.00 0.00 66.02 65.38 1bgx s SER 19 CO 0.14 -0.27 -0.06 -0.76 0.41 0.00 0.00 173.24 172.70 1bgx s LEU 20 N 1.81 2.59 -0.28 2.44 1.43 -0.96 -4.42 118.68 121.29 1bgx s LEU 20 Ca -0.00 -1.22 -0.16 0.00 -1.03 0.00 0.00 54.13 51.71 1bgx s LEU 20 Cb -0.16 -0.78 0.09 0.00 0.03 0.00 0.00 46.19 45.37 1bgx s LEU 20 CO -0.07 -0.32 0.74 -0.94 0.23 0.00 0.00 176.35 175.98 1bgx s SER 21 N -3.53 -0.87 -0.26 2.29 1.04 -0.85 -1.47 113.70 110.05 1bgx s SER 21 Ca 0.32 1.40 -0.06 0.00 0.48 0.00 0.00 55.95 58.09 1bgx s SER 21 Cb 0.04 1.36 -0.00 0.00 0.10 0.00 0.00 66.02 67.52 1bgx s SER 21 CO 0.14 -0.22 0.03 0.00 0.98 0.00 0.00 173.24 174.18 1bgx s THR 23 N 1.51 4.67 0.01 0.00 2.01 -1.23 -3.07 115.64 119.54 1bgx s THR 23 Ca 0.04 1.03 0.01 0.00 0.31 0.00 0.00 61.69 63.09 1bgx s THR 23 Cb -0.16 -3.71 -0.01 0.00 0.01 0.00 0.00 72.50 68.63 1bgx s THR 23 CO 0.01 0.00 -0.04 0.54 -0.69 0.00 0.00 174.62 174.43 1bgx s VAL 24 N -1.76 0.29 0.05 3.82 0.11 -1.05 -3.91 120.40 117.94 1bgx s VAL 24 Ca 0.48 -0.53 0.01 0.00 -2.93 0.00 0.00 61.98 59.01 1bgx s VAL 24 Cb -0.13 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.37 1bgx s VAL 24 CO 0.19 -0.17 -0.06 -0.89 -3.33 0.00 0.00 175.10 170.84 1bgx s THR 25 N -0.69 0.45 0.00 5.04 2.01 -1.26 -4.75 115.64 116.44 1bgx s THR 25 Ca -0.05 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 60.62 1bgx s THR 25 Cb -0.05 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.56 1bgx s THR 25 CO -0.00 -0.59 0.00 0.61 -0.69 0.00 0.00 174.62 173.95 1bgx n GLY 26 N 0.98 1.76 3.57 4.40 0.00 -1.26 -4.85 105.19 109.79 1bgx n GLY 26 Ca -0.20 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 1bgx n GLY 26 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bgx s TYR 27 N 0.00 2.98 0.76 1.61 5.04 -1.26 -5.03 117.35 121.45 1bgx s TYR 27 Ca 0.00 0.39 -0.11 0.00 -2.44 0.00 0.00 57.07 54.92 1bgx s TYR 27 Cb 0.00 -3.78 0.05 0.00 0.35 0.00 0.00 41.96 38.58 1bgx s TYR 27 CO 0.00 -0.99 1.08 -1.54 -1.34 0.00 0.00 175.55 172.76 1bgx s SER 28 N 2.13 4.69 -0.28 4.32 1.04 -1.26 -4.96 113.70 119.38 1bgx s SER 28 Ca 0.34 1.64 -0.00 0.00 0.48 0.00 0.00 55.95 58.41 1bgx s SER 28 Cb -0.11 -2.40 0.21 0.00 0.10 0.00 0.00 66.02 63.82 1bgx s SER 28 CO 0.23 -1.89 1.92 2.30 0.98 0.00 0.00 173.24 176.79 1bgx n ILE 29 N -3.41 2.61 0.00 -1.02 -5.35 -1.26 -3.44 119.36 107.49 1bgx n ILE 29 Ca 0.08 -1.46 0.00 0.00 -0.27 0.00 0.00 62.75 61.09 1bgx n ILE 29 Cb 0.54 -1.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.18 1bgx n ILE 29 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1bgx n THR 30 N 0.33 0.00 -0.06 7.28 -2.24 -1.26 -4.46 114.28 113.87 1bgx n THR 30 Ca 0.28 -0.03 -0.02 0.00 -2.27 0.00 0.00 64.05 62.01 1bgx n THR 30 Cb 0.64 0.58 -0.01 0.00 -2.10 0.00 0.00 70.33 69.44 1bgx n THR 30 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1bgx h SER 31 N 0.00 0.00 -2.01 3.42 0.02 -1.87 -3.46 113.55 109.65 1bgx h SER 31 Ca 0.00 -0.07 0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1bgx h SER 31 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1bgx h SER 31 CO 0.00 0.59 0.34 -0.67 -1.14 0.00 0.00 176.83 175.95 1bgx n ASP 31 N -4.74 -1.27 -0.88 3.07 2.03 -1.26 -5.05 116.55 108.46 1bgx n ASP 31 Ca -0.02 -1.73 0.00 0.00 0.52 0.00 0.00 54.79 53.55 1bgx n ASP 31 Cb 0.09 2.07 0.00 0.00 -0.72 0.00 0.00 41.12 42.56 1bgx n ASP 31 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1bgx n TYR 32 N -0.45 -2.44 -4.10 -0.67 4.01 -1.26 -4.70 117.16 107.55 1bgx n TYR 32 Ca -0.03 1.30 -0.36 0.00 -0.16 0.00 0.00 57.90 58.66 1bgx n TYR 32 Cb 0.39 -2.38 -0.08 0.00 -0.31 0.00 0.00 39.34 36.96 1bgx n TYR 32 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bgx s ALA 33 N -3.04 3.58 -0.33 -0.72 0.00 -0.98 -3.68 121.76 116.59 1bgx s ALA 33 Ca 0.00 -0.72 -0.07 0.00 0.00 0.00 0.00 51.96 51.16 1bgx s ALA 33 Cb 0.00 -1.76 0.03 0.00 0.00 0.00 0.00 23.12 21.39 1bgx s ALA 33 CO 0.00 0.56 0.12 -1.58 0.00 0.00 0.00 175.76 174.86 1bgx s TRP 34 N -0.82 3.22 0.68 0.00 0.52 -0.31 0.27 118.94 122.50 1bgx s TRP 34 Ca 0.13 -1.19 -0.04 0.00 0.02 0.00 0.00 56.10 55.02 1bgx s TRP 34 Cb -0.12 -2.30 0.08 0.00 -1.15 0.00 0.00 33.47 29.98 1bgx s TRP 34 CO 0.03 -0.67 0.96 -0.80 0.02 0.00 0.00 176.95 176.50 1bgx s ASN 35 N 1.46 4.70 -0.04 2.95 0.01 -0.32 -1.99 114.94 121.71 1bgx s ASN 35 Ca 0.00 0.11 -0.02 0.00 -0.71 0.00 0.00 52.86 52.24 1bgx s ASN 35 Cb -0.19 -0.71 0.03 0.00 0.41 0.00 0.00 41.25 40.79 1bgx s ASN 35 CO 0.03 -1.62 0.06 0.26 -1.51 0.00 0.00 177.10 174.32 1bgx s TRP 36 N -3.13 0.09 -0.02 2.20 0.52 -0.64 -2.00 118.94 115.96 1bgx s TRP 36 Ca 0.62 0.24 -0.01 0.00 0.02 0.00 0.00 56.10 56.96 1bgx s TRP 36 Cb -0.09 -0.48 0.01 0.00 -1.15 0.00 0.00 33.47 31.76 1bgx s TRP 36 CO 0.43 -0.19 0.05 0.42 0.02 0.00 0.00 176.95 177.68 1bgx s ILE 37 N 2.11 -0.00 0.42 2.03 1.01 -1.01 -2.18 121.20 123.58 1bgx s ILE 37 Ca 0.04 0.02 0.08 0.00 0.00 0.00 0.00 60.65 60.79 1bgx s ILE 37 Cb -0.12 -0.07 -0.02 0.00 0.01 0.00 0.00 42.46 42.25 1bgx s ILE 37 CO -0.03 0.01 0.36 0.00 0.00 0.00 0.00 174.94 175.28 1bgx s ARG 38 N 0.11 2.49 0.36 2.79 1.70 -1.07 -1.06 118.95 124.27 1bgx s ARG 38 Ca -0.01 -1.59 -0.12 0.00 -0.47 0.00 0.00 55.73 53.55 1bgx s ARG 38 Cb -0.01 -2.33 0.03 0.00 -0.57 0.00 0.00 34.95 32.07 1bgx s ARG 38 CO -0.00 -0.21 0.67 -1.14 -1.08 0.00 0.00 175.30 173.53 1bgx s GLN 39 N -4.12 2.07 0.61 3.89 0.74 -0.89 -3.51 119.66 118.45 1bgx s GLN 39 Ca 0.47 -1.51 0.00 0.00 0.05 0.00 0.00 55.36 54.37 1bgx s GLN 39 Cb -0.02 0.56 0.00 0.00 1.10 0.00 0.00 33.01 34.64 1bgx s GLN 39 CO 0.27 -0.93 0.00 1.19 -0.55 0.00 0.00 175.29 175.27 1bgx n PHE 40 N -0.53 -4.40 0.13 1.67 3.72 -1.26 -3.79 117.46 112.99 1bgx n PHE 40 Ca -0.05 2.38 0.01 0.00 -0.05 0.00 0.00 57.45 59.75 1bgx n PHE 40 Cb 0.60 -3.69 0.04 0.00 -0.94 0.00 0.00 39.48 35.49 1bgx n PHE 40 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1bgx h PRO 41 N 0.16 0.00 0.00 -1.08 0.11 -1.80 -3.36 132.00 126.02 1bgx h PRO 41 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1bgx h PRO 41 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1bgx h PRO 41 CO 0.00 0.59 0.00 0.41 -0.21 0.00 0.00 178.00 178.80 1bgx n GLY 42 N 1.10 -0.72 3.00 -0.55 0.00 -1.26 -4.86 105.19 101.90 1bgx n GLY 42 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1bgx n GLY 42 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bgx n ASN 43 N -0.85 -3.80 -4.71 1.61 5.15 -1.26 -4.97 115.26 106.42 1bgx n ASN 43 Ca 0.12 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.73 1bgx n ASN 43 Cb 0.06 -2.46 -0.06 0.00 -0.53 0.00 0.00 39.78 36.78 1bgx n ASN 43 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1bgx s LYS 44 N -1.27 4.29 0.50 1.20 2.47 -1.26 -4.74 119.74 120.93 1bgx s LYS 44 Ca 0.00 0.31 0.01 0.00 -1.56 0.00 0.00 55.97 54.74 1bgx s LYS 44 Cb 0.00 -3.45 0.02 0.00 -1.46 0.00 0.00 37.83 32.93 1bgx s LYS 44 CO 0.00 0.14 0.72 -0.51 0.16 0.00 0.00 175.35 175.86 1bgx s LEU 45 N 0.71 3.46 -0.09 5.43 1.02 -1.26 -4.38 118.68 123.57 1bgx s LEU 45 Ca 0.22 0.09 -0.19 0.00 0.02 0.00 0.00 54.13 54.27 1bgx s LEU 45 Cb -0.14 -2.98 0.04 0.00 0.02 0.00 0.00 46.19 43.13 1bgx s LEU 45 CO 0.08 -0.92 0.46 -0.70 0.02 0.00 0.00 176.35 175.29 1bgx s GLU 46 N -4.64 0.70 0.25 1.70 2.12 -1.23 -5.02 118.70 112.58 1bgx s GLU 46 Ca 0.53 0.27 -0.04 0.00 0.36 0.00 0.00 54.97 56.10 1bgx s GLU 46 Cb -0.10 0.33 -0.05 0.00 0.26 0.00 0.00 34.13 34.57 1bgx s GLU 46 CO 0.38 -0.16 0.49 -0.46 -0.54 0.00 0.00 175.26 174.96 1bgx s TRP 47 N -0.61 3.48 0.00 5.30 -0.00 -1.26 -2.59 118.94 123.25 1bgx s TRP 47 Ca -0.07 0.55 0.00 0.00 -0.00 0.00 0.00 56.10 56.58 1bgx s TRP 47 Cb -0.03 -2.03 0.00 0.00 -0.00 0.00 0.00 33.47 31.41 1bgx s TRP 47 CO 0.04 0.26 0.00 -1.33 -0.00 0.00 0.00 176.95 175.92 1bgx n MET 48 N -0.72 3.66 0.00 5.86 2.81 -0.93 -4.67 117.12 123.13 1bgx n MET 48 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1bgx n MET 48 Cb 0.54 -0.28 0.00 0.00 -0.71 0.00 0.00 33.22 32.76 1bgx n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bgx n GLY 49 N 0.56 -0.25 0.51 3.03 0.00 -1.25 -4.78 105.19 103.00 1bgx n GLY 49 Ca 0.00 -2.28 -0.04 0.00 0.00 0.00 0.00 46.02 43.71 1bgx n GLY 49 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1bgx n TYR 50 N -0.54 0.00 -3.20 1.61 4.11 -1.26 -1.63 117.16 116.26 1bgx n TYR 50 Ca 0.00 -0.41 0.01 0.00 -0.00 0.00 0.00 57.90 57.50 1bgx n TYR 50 Cb 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 39.34 39.32 1bgx n TYR 50 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.86 175.36 1bgx s ILE 51 N -1.83 -0.91 0.99 -3.48 2.07 -0.84 -4.53 121.20 112.67 1bgx s ILE 51 Ca 0.04 -0.02 -0.15 0.00 -1.41 0.00 0.00 60.65 59.11 1bgx s ILE 51 Cb 0.00 -0.96 0.19 0.00 0.13 0.00 0.00 42.46 41.82 1bgx s ILE 51 CO 0.03 -0.03 1.19 0.42 -1.91 0.00 0.00 174.94 174.64 1bgx s THR 52 N 2.79 1.90 0.25 4.00 -4.23 -0.72 -1.16 115.64 118.47 1bgx s THR 52 Ca 0.19 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 1bgx s THR 52 Cb -0.15 -2.78 -0.03 0.00 1.34 0.00 0.00 72.50 70.88 1bgx s THR 52 CO -0.20 0.00 1.59 0.10 -0.54 0.00 0.00 174.62 175.57 1bgx h TYR 52 N -1.77 0.32 0.01 3.99 -0.00 -1.78 -3.29 116.97 114.45 1bgx h TYR 52 Ca -0.47 -0.12 -0.22 0.00 -0.00 0.00 0.00 58.73 57.93 1bgx h TYR 52 Cb 1.29 -0.06 0.02 0.00 -0.00 0.00 0.00 36.73 37.98 1bgx h TYR 52 CO -0.74 0.76 -0.86 0.77 -0.00 0.00 0.00 178.16 178.09 1bgx h SER 53 N 0.20 0.73 0.00 0.10 0.02 -1.88 -3.38 113.55 109.33 1bgx h SER 53 Ca 0.00 -0.76 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 1bgx h SER 53 Cb 1.05 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1bgx h SER 53 CO 0.09 1.40 0.00 0.61 -1.14 0.00 0.00 176.83 177.79 1bgx n GLY 54 N 1.12 -0.54 1.21 -3.77 0.00 -1.24 -5.10 105.19 96.87 1bgx n GLY 54 Ca -0.11 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1bgx n GLY 54 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bgx n THR 55 N 0.00 0.17 -1.08 2.61 -2.24 -1.26 -3.64 114.28 108.84 1bgx n THR 55 Ca 0.00 0.06 -0.03 0.00 -2.27 0.00 0.00 64.05 61.80 1bgx n THR 55 Cb 0.00 -0.90 -0.01 0.00 -2.10 0.00 0.00 70.33 67.32 1bgx n THR 55 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1bgx n THR 56 N -2.67 0.00 -2.27 4.28 -1.04 -1.26 -1.75 114.28 109.57 1bgx n THR 56 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.67 1bgx n THR 56 Cb 0.00 -1.14 -0.00 0.00 -1.82 0.00 0.00 70.33 67.37 1bgx n THR 56 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1bgx s ASP 57 N -2.10 5.89 -0.38 8.00 1.47 -1.26 -5.01 116.67 123.29 1bgx s ASP 57 Ca 0.00 1.99 0.02 0.00 1.18 0.00 0.00 52.55 55.74 1bgx s ASP 57 Cb 0.00 -2.56 0.15 0.00 -0.34 0.00 0.00 42.92 40.17 1bgx s ASP 57 CO 0.00 -1.09 0.28 -0.47 0.68 0.00 0.00 175.17 174.57 1bgx s TYR 58 N -2.05 0.71 1.02 2.11 6.14 -1.26 -5.00 117.35 119.02 1bgx s TYR 58 Ca 0.68 -1.78 -0.14 0.00 0.64 0.00 0.00 57.07 56.48 1bgx s TYR 58 Cb -0.19 -0.84 0.20 0.00 0.42 0.00 0.00 41.96 41.55 1bgx s TYR 58 CO 0.28 -0.85 1.11 -0.80 0.64 0.00 0.00 175.55 175.93 1bgx s ASN 59 N 0.75 2.49 0.68 4.32 0.01 -1.26 -4.91 114.94 117.02 1bgx s ASN 59 Ca 0.23 0.99 0.00 0.00 -0.71 0.00 0.00 52.86 53.37 1bgx s ASN 59 Cb -0.13 -1.54 0.00 0.00 0.41 0.00 0.00 41.25 39.99 1bgx s ASN 59 CO -0.07 -3.19 0.00 -2.65 -1.51 0.00 0.00 177.10 169.68 1bgx n PRO 60 N -4.19 -0.12 -0.09 -0.60 -0.02 -1.26 -4.91 135.00 123.81 1bgx n PRO 60 Ca 0.07 0.00 0.25 0.00 -2.02 0.00 0.00 63.50 61.80 1bgx n PRO 60 Cb 0.58 0.00 0.72 0.00 -0.02 0.00 0.00 33.50 34.78 1bgx n PRO 60 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1bgx h SER 61 N -0.44 0.00 -1.76 2.55 0.87 -1.98 -3.20 113.55 109.59 1bgx h SER 61 Ca 0.00 0.00 -0.77 0.00 -1.23 0.00 0.00 61.79 59.79 1bgx h SER 61 Cb 0.00 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 61.77 1bgx h SER 61 CO 0.00 0.00 1.74 0.18 -0.53 0.00 0.00 176.83 178.22 1bgx n LEU 62 N -4.13 7.06 -0.13 2.23 7.99 -1.26 -4.67 117.00 124.09 1bgx n LEU 62 Ca 0.15 -4.92 0.12 0.00 -0.01 0.00 0.00 56.01 51.34 1bgx n LEU 62 Cb 0.84 -1.37 0.19 0.00 -0.11 0.00 0.00 43.42 42.98 1bgx n LEU 62 CO 0.36 1.71 0.40 0.29 -1.51 0.00 0.00 177.39 178.64 1bgx n LYS 63 N 2.28 0.38 0.07 3.23 5.02 -1.21 -4.15 118.16 123.77 1bgx n LYS 63 Ca 0.43 -0.25 0.13 0.00 -2.02 0.00 0.00 58.31 56.60 1bgx n LYS 63 Cb 0.31 -1.49 0.48 0.00 -0.02 0.00 0.00 35.03 34.30 1bgx n LYS 63 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1bgx n SER 64 N -1.09 0.50 -0.06 4.39 2.88 -1.26 -4.11 113.62 114.88 1bgx n SER 64 Ca 0.08 0.56 -0.09 0.00 -1.33 0.00 0.00 58.87 58.08 1bgx n SER 64 Cb 0.35 -0.69 -0.05 0.00 -0.75 0.00 0.00 64.21 63.07 1bgx n SER 64 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bgx n ARG 65 N -1.98 0.27 -2.55 -1.46 1.74 -1.26 -4.97 116.66 106.44 1bgx n ARG 65 Ca 0.06 0.07 -0.39 0.00 -0.77 0.00 0.00 57.85 56.82 1bgx n ARG 65 Cb 0.37 -1.16 -0.05 0.00 -1.02 0.00 0.00 32.46 30.61 1bgx n ARG 65 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1bgx s ILE 66 N -2.22 3.67 -0.06 0.55 1.10 -1.26 -2.15 121.20 120.83 1bgx s ILE 66 Ca -0.15 1.60 -0.02 0.00 -0.51 0.00 0.00 60.65 61.56 1bgx s ILE 66 Cb 0.04 -3.98 0.04 0.00 0.15 0.00 0.00 42.46 38.71 1bgx s ILE 66 CO 0.25 0.31 0.13 -0.44 -2.11 0.00 0.00 174.94 173.08 1bgx s SER 67 N -1.09 0.13 -0.15 4.50 0.01 -0.38 -4.94 113.70 111.77 1bgx s SER 67 Ca 0.46 0.26 0.01 0.00 1.31 0.00 0.00 55.95 57.99 1bgx s SER 67 Cb -0.28 0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.10 1bgx s SER 67 CO 0.36 -0.17 -0.18 -0.63 0.41 0.00 0.00 173.24 173.03 1bgx s ILE 68 N 1.41 2.37 0.31 1.44 1.01 -1.26 -1.19 121.20 125.30 1bgx s ILE 68 Ca -0.06 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.75 1bgx s ILE 68 Cb -0.12 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1bgx s ILE 68 CO -0.05 0.53 0.14 0.42 0.00 0.00 0.00 174.94 175.97 1bgx s THR 69 N 0.89 0.48 0.16 2.92 -4.23 -1.17 -5.06 115.64 109.63 1bgx s THR 69 Ca -0.05 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.33 1bgx s THR 69 Cb -0.15 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.16 1bgx s THR 69 CO -0.02 0.00 0.38 0.00 -0.54 0.00 0.00 174.62 174.44 1bgx s ARG 70 N -3.85 1.20 -0.28 3.99 1.70 -1.26 -1.16 118.95 119.29 1bgx s ARG 70 Ca 0.34 -0.98 -0.02 0.00 -0.47 0.00 0.00 55.73 54.60 1bgx s ARG 70 Cb 0.05 0.44 0.09 0.00 -0.57 0.00 0.00 34.95 34.97 1bgx s ARG 70 CO 0.16 -0.47 0.09 0.34 -1.08 0.00 0.00 175.30 174.35 1bgx s ASP 71 N -2.90 3.60 0.25 -2.89 -1.08 -0.49 -4.90 116.67 108.26 1bgx s ASP 71 Ca 0.11 -1.33 0.07 0.00 -0.52 0.00 0.00 52.55 50.88 1bgx s ASP 71 Cb 0.02 -0.63 0.30 0.00 -1.46 0.00 0.00 42.92 41.15 1bgx s ASP 71 CO -0.04 -0.40 1.59 0.71 0.52 0.00 0.00 175.17 177.55 1bgx h THR 72 N 6.47 1.40 -0.77 1.71 1.35 -1.97 -1.92 112.91 119.19 1bgx h THR 72 Ca -0.16 -2.00 -0.02 0.00 -0.55 0.00 0.00 66.41 63.68 1bgx h THR 72 Cb 1.04 2.03 -0.04 0.00 -1.73 0.00 0.00 68.15 69.46 1bgx h THR 72 CO 0.43 0.58 0.38 0.28 -0.25 0.00 0.00 175.52 176.94 1bgx h SER 73 N 0.11 0.99 0.57 5.36 0.02 -1.95 -2.49 113.55 116.16 1bgx h SER 73 Ca -0.01 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1bgx h SER 73 Cb 1.08 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1bgx h SER 73 CO 0.09 0.83 -0.51 0.29 -1.14 0.00 0.00 176.83 176.40 1bgx n LYS 74 N -4.40 0.05 -3.08 3.45 5.02 -1.24 -5.00 118.16 112.96 1bgx n LYS 74 Ca 0.07 0.01 -0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1bgx n LYS 74 Cb 0.12 -1.53 0.02 0.00 -0.02 0.00 0.00 35.03 33.62 1bgx n LYS 74 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1bgx n ASN 75 N -1.59 -7.43 -3.47 4.39 5.15 -0.94 -4.87 115.26 106.50 1bgx n ASN 75 Ca 0.05 -0.23 -0.10 0.00 -0.60 0.00 0.00 54.58 53.70 1bgx n ASN 75 Cb 0.35 -5.23 -0.02 0.00 -0.53 0.00 0.00 39.78 34.36 1bgx n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1bgx s GLN 76 N -3.35 1.06 -0.08 1.20 -2.07 -0.76 -2.53 119.66 113.11 1bgx s GLN 76 Ca 0.12 -0.39 0.03 0.00 -1.82 0.00 0.00 55.36 53.29 1bgx s GLN 76 Cb -0.02 0.48 0.01 0.00 -1.09 0.00 0.00 33.01 32.40 1bgx s GLN 76 CO 0.74 -0.46 -0.16 -0.59 -1.32 0.00 0.00 175.29 173.49 1bgx s PHE 77 N -3.44 1.89 0.54 9.60 -0.71 -1.18 -1.40 117.98 123.29 1bgx s PHE 77 Ca 0.03 -0.77 -0.04 0.00 -1.04 0.00 0.00 56.93 55.11 1bgx s PHE 77 Cb -0.01 -1.33 -0.00 0.00 -1.21 0.00 0.00 43.02 40.47 1bgx s PHE 77 CO -0.11 -0.36 0.82 -0.06 -1.34 0.00 0.00 175.22 174.17 1bgx s PHE 78 N 0.64 3.28 -0.01 3.49 0.08 -0.31 -2.88 117.98 122.27 1bgx s PHE 78 Ca -0.14 0.55 0.01 0.00 0.12 0.00 0.00 56.93 57.46 1bgx s PHE 78 Cb -0.16 -2.56 0.01 0.00 -0.57 0.00 0.00 43.02 39.73 1bgx s PHE 78 CO 0.04 -0.62 -0.01 -1.17 -0.10 0.00 0.00 175.22 173.35 1bgx s LEU 79 N -4.84 1.71 -0.23 -0.37 2.96 -0.54 -3.06 118.68 114.32 1bgx s LEU 79 Ca 0.51 -0.03 -0.03 0.00 -0.22 0.00 0.00 54.13 54.36 1bgx s LEU 79 Cb -0.10 -0.15 0.07 0.00 0.50 0.00 0.00 46.19 46.51 1bgx s LEU 79 CO 0.43 -0.02 0.07 -1.58 -1.32 0.00 0.00 176.35 173.93 1bgx s GLN 80 N 0.31 0.55 -0.45 1.98 2.00 -0.33 -2.26 119.66 121.46 1bgx s GLN 80 Ca -0.03 -0.55 -0.09 0.00 -2.00 0.00 0.00 55.36 52.69 1bgx s GLN 80 Cb -0.05 -1.93 0.11 0.00 0.80 0.00 0.00 33.01 31.94 1bgx s GLN 80 CO -0.01 -0.77 0.32 -1.17 -0.50 0.00 0.00 175.29 173.16 1bgx s LEU 81 N 1.86 5.52 0.36 3.68 2.96 -1.08 -1.25 118.68 130.74 1bgx s LEU 81 Ca 0.03 -1.79 -0.24 0.00 -0.22 0.00 0.00 54.13 51.90 1bgx s LEU 81 Cb -0.17 -2.00 -0.10 0.00 0.50 0.00 0.00 46.19 44.42 1bgx s LEU 81 CO -0.16 -0.64 0.96 0.20 -1.32 0.00 0.00 176.35 175.38 1bgx s ASN 82 N 2.48 7.16 -1.14 3.68 0.01 -0.91 -1.49 114.94 124.73 1bgx s ASN 82 Ca 0.05 1.81 -0.09 0.00 -0.71 0.00 0.00 52.86 53.93 1bgx s ASN 82 Cb -0.25 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 38.81 1bgx s ASN 82 CO -0.00 -0.20 0.85 -1.20 -1.51 0.00 0.00 177.10 175.04 1bgx n SER 82 N 0.13 -4.82 -4.66 -1.22 7.64 -0.79 -4.78 113.62 105.12 1bgx n SER 82 Ca 0.04 -0.81 -0.43 0.00 1.01 0.00 0.00 58.87 58.68 1bgx n SER 82 Cb 0.51 -4.47 -0.02 0.00 -1.01 0.00 0.00 64.21 59.22 1bgx n SER 82 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1bgx s VAL 82 N -3.46 4.50 0.12 0.44 0.11 -0.89 -4.76 120.40 116.46 1bgx s VAL 82 Ca 0.34 1.79 0.01 0.00 -2.93 0.00 0.00 61.98 61.19 1bgx s VAL 82 Cb -0.07 -4.21 0.01 0.00 -1.53 0.00 0.00 36.38 30.57 1bgx s VAL 82 CO 0.79 -0.22 0.06 0.35 -3.33 0.00 0.00 175.10 172.75 1bgx n THR 83 N 5.45 0.00 0.96 5.04 -2.24 -1.26 -1.29 114.28 120.94 1bgx n THR 83 Ca 0.13 -0.51 0.12 0.00 -2.27 0.00 0.00 64.05 61.52 1bgx n THR 83 Cb 0.46 -0.22 0.56 0.00 -2.10 0.00 0.00 70.33 69.03 1bgx n THR 83 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1bgx n THR 84 N -0.62 0.26 0.50 4.28 -2.24 -1.26 -3.42 114.28 111.78 1bgx n THR 84 Ca -0.02 0.06 0.12 0.00 -2.27 0.00 0.00 64.05 61.95 1bgx n THR 84 Cb 0.14 -0.64 0.46 0.00 -2.10 0.00 0.00 70.33 68.19 1bgx n THR 84 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1bgx n GLU 85 N -1.44 0.21 -2.57 -0.78 4.71 -1.26 -4.74 120.64 114.77 1bgx n GLU 85 Ca 0.08 0.33 -0.42 0.00 -0.01 0.00 0.00 57.16 57.13 1bgx n GLU 85 Cb 0.27 -1.83 -0.03 0.00 -1.01 0.00 0.00 31.44 28.84 1bgx n GLU 85 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1bgx s ASP 86 N -4.28 7.16 0.16 1.62 1.01 -1.22 -4.96 116.67 116.16 1bgx s ASP 86 Ca 0.07 1.70 -0.10 0.00 0.71 0.00 0.00 52.55 54.92 1bgx s ASP 86 Cb 0.11 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1bgx s ASP 86 CO 0.47 -0.50 1.54 0.00 0.21 0.00 0.00 175.17 176.89 1bgx h THR 87 N 5.00 1.27 -3.69 -1.27 1.03 -1.85 -3.48 112.91 109.92 1bgx h THR 87 Ca -0.34 -1.39 0.00 0.00 -0.01 0.00 0.00 66.41 64.67 1bgx h THR 87 Cb 1.16 1.14 0.00 0.00 -1.07 0.00 0.00 68.15 69.38 1bgx h THR 87 CO 0.86 0.48 -0.95 0.00 -0.01 0.00 0.00 175.52 175.90 1bgx n ALA 88 N -2.52 -1.93 0.00 0.00 0.00 -1.26 -4.33 120.51 110.47 1bgx n ALA 88 Ca -0.00 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1bgx n ALA 88 Cb 0.46 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1bgx n ALA 88 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1bgx n THR 89 N -2.40 0.00 -2.72 0.00 -1.04 -1.25 -4.36 114.28 102.51 1bgx n THR 89 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1bgx n THR 89 Cb 0.42 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.90 1bgx n THR 89 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1bgx s TYR 90 N -0.02 3.67 -0.01 -1.42 2.02 -1.07 -2.10 117.35 118.44 1bgx s TYR 90 Ca 0.00 1.70 0.08 0.00 -0.37 0.00 0.00 57.07 58.47 1bgx s TYR 90 Cb 0.00 -3.10 -0.02 0.00 -0.40 0.00 0.00 41.96 38.43 1bgx s TYR 90 CO 0.00 0.02 -0.24 0.71 -1.57 0.00 0.00 175.55 174.46 1bgx s TYR 91 N 0.90 2.38 -0.66 2.71 1.51 -0.22 -3.97 117.35 119.99 1bgx s TYR 91 Ca 0.51 -0.39 -0.16 0.00 -1.01 0.00 0.00 57.07 56.01 1bgx s TYR 91 Cb -0.21 -1.49 0.15 0.00 -0.11 0.00 0.00 41.96 40.30 1bgx s TYR 91 CO 0.28 0.03 0.65 0.00 -1.11 0.00 0.00 175.55 175.40 1bgx n ALA 93 N 5.13 -0.31 -3.60 0.00 0.00 -0.84 -1.23 120.51 119.65 1bgx n ALA 93 Ca -0.03 -1.03 -0.11 0.00 0.00 0.00 0.00 53.44 52.26 1bgx n ALA 93 Cb 0.43 0.08 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 1bgx n ALA 93 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1bgx s ARG 94 N -4.21 0.73 0.15 0.00 3.52 -1.26 -1.18 118.95 116.70 1bgx s ARG 94 Ca 0.39 1.01 0.03 0.00 -0.13 0.00 0.00 55.73 57.03 1bgx s ARG 94 Cb -0.02 0.27 -0.04 0.00 -1.56 0.00 0.00 34.95 33.61 1bgx s ARG 94 CO 0.27 -0.12 0.26 0.71 -0.81 0.00 0.00 175.30 175.61 1bgx s TYR 95 N 0.84 3.42 -0.25 5.12 2.02 0.14 -4.42 117.35 124.21 1bgx s TYR 95 Ca -0.04 0.09 0.01 0.00 -0.37 0.00 0.00 57.07 56.76 1bgx s TYR 95 Cb -0.05 -1.64 -0.16 0.00 -0.40 0.00 0.00 41.96 39.71 1bgx s TYR 95 CO -0.07 0.52 -0.23 0.98 -1.57 0.00 0.00 175.55 175.18 1bgx n TYR 96 N -0.52 0.00 -1.35 2.71 4.19 -1.25 -2.31 117.16 118.63 1bgx n TYR 96 Ca -0.07 0.00 0.03 0.00 3.31 0.00 0.00 57.90 61.17 1bgx n TYR 96 Cb 0.54 -0.97 -0.02 0.00 0.49 0.00 0.00 39.34 39.38 1bgx n TYR 96 CO 0.00 0.00 0.00 2.48 0.91 0.00 0.00 176.86 180.25 1bgx n TYR 97 N -3.31 -2.88 0.00 2.98 0.18 -1.26 -4.55 117.16 108.32 1bgx n TYR 97 Ca -0.45 1.57 0.00 0.00 1.88 0.00 0.00 57.90 60.89 1bgx n TYR 97 Cb 0.97 -2.46 0.00 0.00 -0.38 0.00 0.00 39.34 37.47 1bgx n TYR 97 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1bgx n GLY 98 N -2.81 3.06 2.63 -7.48 0.00 -1.26 -4.73 105.19 94.60 1bgx n GLY 98 Ca -0.02 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 44.92 1bgx n GLY 98 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bgx s TYR 99 N -0.14 0.07 0.14 1.61 -0.85 -1.26 -5.16 117.35 111.75 1bgx s TYR 99 Ca 0.00 -0.46 -0.30 0.00 -0.52 0.00 0.00 57.07 55.79 1bgx s TYR 99 Cb 0.00 -0.69 -0.07 0.00 0.38 0.00 0.00 41.96 41.58 1bgx s TYR 99 CO 0.00 -0.74 1.13 -1.58 -1.52 0.00 0.00 175.55 172.85 1bgx s TRP 100 N 2.19 3.53 -0.25 -3.49 0.52 -1.26 -4.69 118.94 115.49 1bgx s TRP 100 Ca 0.07 1.50 -0.31 0.00 0.02 0.00 0.00 56.10 57.39 1bgx s TRP 100 Cb -0.16 -3.32 0.17 0.00 -1.15 0.00 0.00 33.47 29.01 1bgx s TRP 100 CO -0.26 -0.83 1.26 1.52 0.02 0.00 0.00 176.95 178.66 1bgx s TYR 101 N 0.22 -0.12 -0.13 -1.98 1.13 -1.26 -4.99 117.35 110.21 1bgx s TYR 101 Ca 0.52 0.19 -0.04 0.00 -1.41 0.00 0.00 57.07 56.33 1bgx s TYR 101 Cb -0.29 0.49 -0.04 0.00 -1.10 0.00 0.00 41.96 41.02 1bgx s TYR 101 CO 0.33 -0.12 0.03 -0.06 -2.51 0.00 0.00 175.55 173.22 1bgx s PHE 102 N -1.26 3.22 0.24 -3.49 0.08 -1.26 -3.83 117.98 111.67 1bgx s PHE 102 Ca 0.07 0.12 0.00 0.00 0.12 0.00 0.00 56.93 57.24 1bgx s PHE 102 Cb -0.01 -1.92 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 1bgx s PHE 102 CO -0.05 0.33 0.00 -3.47 -0.10 0.00 0.00 175.22 171.93 1bgx n ASP 103 N 2.76 0.16 0.00 1.36 2.03 -1.26 -5.05 116.55 116.55 1bgx n ASP 103 Ca -0.18 0.39 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1bgx n ASP 103 Cb 0.53 0.21 0.00 0.00 -0.72 0.00 0.00 41.12 41.14 1bgx n ASP 103 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1bgx n VAL 104 N -3.46 0.00 -0.68 5.18 0.24 -1.26 -5.09 118.33 113.26 1bgx n VAL 104 Ca 0.00 1.21 0.00 0.00 -2.04 0.00 0.00 64.34 63.51 1bgx n VAL 104 Cb 0.00 -2.21 0.00 0.00 -1.47 0.00 0.00 33.84 30.16 1bgx n VAL 104 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1bgx n TRP 105 N -1.12 -1.81 -0.15 6.34 7.02 -1.26 -5.06 117.44 121.40 1bgx n TRP 105 Ca 0.00 0.95 0.00 0.00 -1.02 0.00 0.00 57.50 57.43 1bgx n TRP 105 Cb 0.00 -2.16 0.00 0.00 -2.42 0.00 0.00 31.31 26.73 1bgx n TRP 105 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bgx n GLY 106 N -0.58 -2.89 0.00 6.99 0.00 -0.37 -4.92 105.19 103.43 1bgx n GLY 106 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1bgx n GLY 106 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1bgx n GLN 107 N -0.96 0.00 0.00 1.61 -0.06 -1.26 -4.81 117.38 111.89 1bgx n GLN 107 Ca 0.00 0.24 0.00 0.00 -2.00 0.00 0.00 57.00 55.24 1bgx n GLN 107 Cb 0.00 -0.79 0.00 0.00 -4.06 0.00 0.00 30.24 25.39 1bgx n GLN 107 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1bgx n GLY 108 N 1.95 -0.77 2.00 1.69 0.00 -1.25 -5.01 105.19 103.80 1bgx n GLY 108 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1bgx n GLY 108 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bgx n THR 109 N 0.00 -3.12 -3.03 2.61 5.66 -1.26 -2.58 114.28 112.56 1bgx n THR 109 Ca 0.00 0.75 -0.44 0.00 -3.05 0.00 0.00 64.05 61.31 1bgx n THR 109 Cb 0.00 -2.39 -0.04 0.00 -1.55 0.00 0.00 70.33 66.35 1bgx n THR 109 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1bgx s THR 110 N -0.13 4.72 -0.07 1.09 -4.23 -1.26 -3.67 115.64 112.07 1bgx s THR 110 Ca 0.00 -0.99 -0.06 0.00 -1.18 0.00 0.00 61.69 59.46 1bgx s THR 110 Cb 0.00 -4.58 -0.04 0.00 1.34 0.00 0.00 72.50 69.22 1bgx s THR 110 CO 0.00 -1.27 0.18 -0.22 -0.54 0.00 0.00 174.62 172.77 1bgx s LEU 111 N 2.92 4.39 0.00 4.79 2.96 -1.26 -4.54 118.68 127.94 1bgx s LEU 111 Ca 0.18 0.47 0.04 0.00 -0.22 0.00 0.00 54.13 54.60 1bgx s LEU 111 Cb -0.19 -2.29 -0.01 0.00 0.50 0.00 0.00 46.19 44.19 1bgx s LEU 111 CO 0.04 0.35 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.41 1bgx s THR 112 N -1.13 0.96 -0.41 3.68 2.01 -1.24 -4.57 115.64 114.94 1bgx s THR 112 Ca 0.20 -0.64 -0.16 0.00 0.31 0.00 0.00 61.69 61.40 1bgx s THR 112 Cb -0.13 -0.83 0.02 0.00 0.01 0.00 0.00 72.50 71.58 1bgx s THR 112 CO 0.09 0.18 0.35 -0.69 -0.69 0.00 0.00 174.62 173.86 1bgx s VAL 113 N -0.45 5.20 0.13 3.82 1.01 -1.26 -3.40 120.40 125.45 1bgx s VAL 113 Ca 0.03 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 1bgx s VAL 113 Cb -0.05 -3.96 0.01 0.00 0.00 0.00 0.00 36.38 32.38 1bgx s VAL 113 CO -0.00 -0.33 0.31 -0.55 0.00 0.00 0.00 175.10 174.52 1bgx s SER 114 N 1.73 -0.04 0.00 3.32 0.15 -0.85 -4.86 113.70 113.14 1bgx s SER 114 Ca 0.08 -0.60 0.24 0.00 0.70 0.00 0.00 55.95 56.37 1bgx s SER 114 Cb -0.18 0.43 0.36 0.00 -1.71 0.00 0.00 66.02 64.92 1bgx s SER 114 CO 0.11 -0.84 1.31 -1.20 1.20 0.00 0.00 173.24 173.82 1bgx n SER 115 N -0.18 1.04 -4.77 5.45 7.64 -1.26 -4.06 113.62 117.48 1bgx n SER 115 Ca -0.13 -0.83 -0.30 0.00 1.01 0.00 0.00 58.87 58.63 1bgx n SER 115 Cb 0.63 0.39 0.11 0.00 -1.01 0.00 0.00 64.21 64.33 1bgx n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bgx s ALA 116 N -2.74 1.95 0.42 -0.43 0.00 -1.26 -5.07 121.76 114.62 1bgx s ALA 116 Ca 0.16 -0.21 -0.04 0.00 0.00 0.00 0.00 51.96 51.88 1bgx s ALA 116 Cb 0.18 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 1bgx s ALA 116 CO 0.65 -2.01 0.69 0.21 0.00 0.00 0.00 175.76 175.29 1bgx s LYS 117 N -5.10 3.54 -0.08 0.00 2.47 -1.26 -5.03 119.74 114.28 1bgx s LYS 117 Ca 0.62 0.02 -0.29 0.00 -1.56 0.00 0.00 55.97 54.76 1bgx s LYS 117 Cb -0.16 -2.49 -0.02 0.00 -1.46 0.00 0.00 37.83 33.71 1bgx s LYS 117 CO 0.55 -0.05 0.98 0.99 0.16 0.00 0.00 175.35 177.98 1bgx s THR 118 N -2.54 4.82 0.12 3.43 2.01 -1.26 -4.81 115.64 117.41 1bgx s THR 118 Ca 0.45 2.00 0.09 0.00 0.31 0.00 0.00 61.69 64.54 1bgx s THR 118 Cb -0.10 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 1bgx s THR 118 CO 0.40 0.06 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.32 1bgx s THR 119 N 1.69 2.82 0.37 -0.82 2.01 -0.94 -4.95 115.64 115.81 1bgx s THR 119 Ca 0.48 -1.51 -0.15 0.00 0.31 0.00 0.00 61.69 60.82 1bgx s THR 119 Cb -0.19 -2.29 -0.09 0.00 0.01 0.00 0.00 72.50 69.95 1bgx s THR 119 CO 0.21 0.11 0.80 0.00 -0.69 0.00 0.00 174.62 175.04 1bgx s ALA 120 N -1.13 3.26 0.42 7.40 0.00 -1.26 -2.91 121.76 127.53 1bgx s ALA 120 Ca 0.18 0.07 -0.12 0.00 0.00 0.00 0.00 51.96 52.08 1bgx s ALA 120 Cb -0.11 -2.85 -0.07 0.00 0.00 0.00 0.00 23.12 20.09 1bgx s ALA 120 CO 0.10 0.19 0.81 -1.25 0.00 0.00 0.00 175.76 175.61 1bgx s PRO 121 N -3.26 3.84 -0.17 0.00 0.04 -1.26 -4.14 135.00 130.05 1bgx s PRO 121 Ca 0.55 0.60 0.00 0.00 0.04 0.00 0.00 61.00 62.19 1bgx s PRO 121 Cb -0.10 -2.34 0.03 0.00 0.04 0.00 0.00 34.50 32.13 1bgx s PRO 121 CO 0.20 -0.06 -0.11 -1.12 0.04 0.00 0.00 177.00 175.96 1bgx s SER 122 N -3.02 3.00 -0.17 6.66 0.01 -1.08 -5.00 113.70 114.09 1bgx s SER 122 Ca 0.53 -0.68 -0.11 0.00 1.31 0.00 0.00 55.95 57.00 1bgx s SER 122 Cb -0.10 -1.14 -0.05 0.00 0.21 0.00 0.00 66.02 64.94 1bgx s SER 122 CO 0.29 -0.12 0.19 -0.69 0.41 0.00 0.00 173.24 173.32 1bgx s VAL 123 N 1.48 5.38 -0.04 3.43 1.01 -1.26 -2.36 120.40 128.04 1bgx s VAL 123 Ca 0.02 0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.36 1bgx s VAL 123 Cb -0.15 -3.52 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1bgx s VAL 123 CO -0.09 0.45 -0.18 -0.31 0.00 0.00 0.00 175.10 174.97 1bgx s TYR 124 N 0.20 1.78 0.31 5.22 2.02 -0.45 -5.02 117.35 121.41 1bgx s TYR 124 Ca 0.12 -0.49 -0.15 0.00 -0.37 0.00 0.00 57.07 56.18 1bgx s TYR 124 Cb -0.12 -1.19 -0.09 0.00 -0.40 0.00 0.00 41.96 40.16 1bgx s TYR 124 CO 0.01 -0.15 0.72 -1.25 -1.57 0.00 0.00 175.55 173.30 1bgx s PRO 125 N -0.05 3.99 -0.02 -1.71 0.04 -1.26 -2.51 135.00 133.47 1bgx s PRO 125 Ca -0.02 0.63 0.06 0.00 0.04 0.00 0.00 61.00 61.71 1bgx s PRO 125 Cb -0.11 -2.47 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 1bgx s PRO 125 CO 0.02 0.18 -0.19 -0.51 0.04 0.00 0.00 177.00 176.54 1bgx s LEU 126 N -2.93 2.01 -0.06 -3.56 1.43 -1.23 -4.96 118.68 109.38 1bgx s LEU 126 Ca 0.53 -0.36 -0.25 0.00 -1.03 0.00 0.00 54.13 53.02 1bgx s LEU 126 Cb -0.10 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1bgx s LEU 126 CO 0.18 0.22 0.78 0.00 0.23 0.00 0.00 176.35 177.76 1bgx s ALA 127 N -0.33 3.31 0.12 4.21 0.00 -1.26 -4.22 121.76 123.59 1bgx s ALA 127 Ca 0.05 0.22 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 1bgx s ALA 127 Cb -0.09 -3.07 -0.09 0.00 0.00 0.00 0.00 23.12 19.88 1bgx s ALA 127 CO 0.00 -0.19 1.51 -1.25 0.00 0.00 0.00 175.76 175.84 1bgx s PRO 128 N 0.98 4.25 -0.03 0.00 0.04 -1.26 -4.95 135.00 134.03 1bgx s PRO 128 Ca 0.41 2.24 0.04 0.00 0.04 0.00 0.00 61.00 63.73 1bgx s PRO 128 Cb -0.18 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.06 1bgx s PRO 128 CO 0.20 -0.57 -0.16 0.08 0.04 0.00 0.00 177.00 176.59 1bgx s VAL 129 N 1.47 1.30 -0.09 -0.36 1.01 -1.26 -4.79 120.40 117.69 1bgx s VAL 129 Ca 0.68 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 1bgx s VAL 129 Cb -0.40 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1bgx s VAL 129 CO 0.31 0.37 0.13 -1.20 0.00 0.00 0.00 175.10 174.71 1bgx n SER 130 N 2.94 -3.79 -1.77 3.32 7.64 -1.26 -4.11 113.62 116.59 1bgx n SER 130 Ca -0.16 1.33 -0.19 0.00 1.01 0.00 0.00 58.87 60.86 1bgx n SER 130 Cb 0.54 -4.61 -0.06 0.00 -1.01 0.00 0.00 64.21 59.06 1bgx n SER 130 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1bgx n SER 131 N 1.50 -5.06 -2.74 6.43 2.88 -1.26 -4.01 113.62 111.36 1bgx n SER 131 Ca -0.22 0.35 -0.02 0.00 -1.33 0.00 0.00 58.87 57.66 1bgx n SER 131 Cb 0.33 -4.44 -0.01 0.00 -0.75 0.00 0.00 64.21 59.34 1bgx n SER 131 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1bgx n VAL 132 N -2.65-11.28 -3.69 2.46 0.31 -1.26 -4.67 118.33 97.55 1bgx n VAL 132 Ca -0.20 1.96 -0.30 0.00 -0.01 0.00 0.00 64.34 65.79 1bgx n VAL 132 Cb 0.63 -6.44 -0.15 0.00 -0.91 0.00 0.00 33.84 26.97 1bgx n VAL 132 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1bgx s THR 133 N -1.30 0.66 0.98 2.52 2.01 -1.26 -2.92 115.64 116.33 1bgx s THR 133 Ca -0.08 -1.27 -0.15 0.00 0.31 0.00 0.00 61.69 60.51 1bgx s THR 133 Cb 0.01 -1.51 0.18 0.00 0.01 0.00 0.00 72.50 71.18 1bgx s THR 133 CO 0.71 -0.69 1.19 -0.76 -0.69 0.00 0.00 174.62 174.38 1bgx s LEU 134 N 1.71 1.98 0.14 4.42 1.02 -0.10 -3.99 118.68 123.86 1bgx s LEU 134 Ca 0.10 0.69 -0.23 0.00 0.02 0.00 0.00 54.13 54.71 1bgx s LEU 134 Cb -0.17 -2.83 0.07 0.00 0.02 0.00 0.00 46.19 43.28 1bgx s LEU 134 CO -0.28 -2.87 0.59 -0.83 0.02 0.00 0.00 176.35 172.98 1bgx s GLY 135 N -4.28 -0.58 -0.04 -3.19 0.00 -1.26 -2.94 107.32 95.02 1bgx s GLY 135 Ca 0.68 0.50 -0.02 0.00 0.00 0.00 0.00 44.72 45.88 1bgx s GLY 135 CO 0.53 0.17 0.06 0.00 0.00 0.00 0.00 173.10 173.87 1bgx s LEU 137 N 2.09 3.81 -0.24 0.00 2.96 -1.04 -2.74 118.68 123.52 1bgx s LEU 137 Ca 0.04 -0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 53.39 1bgx s LEU 137 Cb -0.12 -1.92 0.02 0.00 0.50 0.00 0.00 46.19 44.67 1bgx s LEU 137 CO -0.03 -0.15 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.08 1bgx s VAL 138 N 1.56 2.89 0.04 1.68 1.01 -0.81 -1.34 120.40 125.42 1bgx s VAL 138 Ca 0.04 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 61.02 1bgx s VAL 138 Cb -0.17 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1bgx s VAL 138 CO 0.04 0.28 0.17 -1.59 0.00 0.00 0.00 175.10 173.99 1bgx s LYS 139 N 1.35 0.65 0.00 2.72 -2.85 -1.00 -1.29 119.74 119.33 1bgx s LYS 139 Ca 0.02 -0.63 0.00 0.00 -1.00 0.00 0.00 55.97 54.36 1bgx s LYS 139 Cb -0.16 0.27 0.00 0.00 -2.06 0.00 0.00 37.83 35.88 1bgx s LYS 139 CO -0.05 -0.18 0.00 0.41 0.10 0.00 0.00 175.35 175.63 1bgx n GLY 140 N 0.78 0.97 3.36 0.59 0.00 -1.03 -2.63 105.19 107.23 1bgx n GLY 140 Ca -0.19 -0.45 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 1bgx n GLY 140 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bgx s TYR 141 N -2.65 1.77 -0.25 1.61 1.13 -1.24 -4.24 117.35 113.49 1bgx s TYR 141 Ca 0.00 -0.55 -0.13 0.00 -1.41 0.00 0.00 57.07 54.98 1bgx s TYR 141 Cb 0.00 -0.82 0.08 0.00 -1.10 0.00 0.00 41.96 40.13 1bgx s TYR 141 CO 0.00 0.40 0.60 0.12 -2.51 0.00 0.00 175.55 174.15 1bgx s PHE 142 N -2.92 -0.98 0.00 -3.49 5.36 -1.14 -2.03 117.98 112.77 1bgx s PHE 142 Ca 0.23 1.92 0.00 0.00 -0.96 0.00 0.00 56.93 58.12 1bgx s PHE 142 Cb -0.01 0.55 0.00 0.00 -0.34 0.00 0.00 43.02 43.22 1bgx s PHE 142 CO 0.08 -0.50 0.00 -0.35 -1.46 0.00 0.00 175.22 172.98 1bgx n PRO 143 N 4.56 3.86 -2.89 10.12 -0.04 -1.26 -2.21 135.00 147.13 1bgx n PRO 143 Ca -0.19 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.92 1bgx n PRO 143 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.95 1bgx n PRO 143 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1bgx s GLU 144 N 3.08 4.36 0.41 0.54 0.41 -1.26 -4.82 118.70 121.42 1bgx s GLU 144 Ca 0.00 1.11 0.04 0.00 -0.41 0.00 0.00 54.97 55.71 1bgx s GLU 144 Cb 0.00 -2.61 -0.02 0.00 -1.78 0.00 0.00 34.13 29.72 1bgx s GLU 144 CO 0.00 0.21 0.14 -1.25 -0.49 0.00 0.00 175.26 173.87 1bgx s PRO 145 N -2.44 1.94 -0.07 0.39 0.04 -1.26 -4.79 135.00 128.81 1bgx s PRO 145 Ca 0.52 -2.19 0.05 0.00 0.04 0.00 0.00 61.00 59.43 1bgx s PRO 145 Cb -0.15 -0.56 -0.01 0.00 0.04 0.00 0.00 34.50 33.83 1bgx s PRO 145 CO 0.20 -0.50 -0.24 0.14 0.04 0.00 0.00 177.00 176.63 1bgx s VAL 146 N -3.21 2.02 -0.38 -0.36 -7.23 -1.26 -4.35 120.40 105.63 1bgx s VAL 146 Ca 0.24 -1.03 -0.20 0.00 -1.81 0.00 0.00 61.98 59.17 1bgx s VAL 146 Cb 0.02 -1.73 0.01 0.00 0.56 0.00 0.00 36.38 35.24 1bgx s VAL 146 CO 0.15 0.56 0.63 -0.89 -0.31 0.00 0.00 175.10 175.24 1bgx s THR 147 N 0.04 4.88 -0.18 5.32 2.01 -0.72 -4.94 115.64 122.05 1bgx s THR 147 Ca -0.10 0.44 -0.03 0.00 0.31 0.00 0.00 61.69 62.31 1bgx s THR 147 Cb -0.15 -4.11 -0.02 0.00 0.01 0.00 0.00 72.50 68.23 1bgx s THR 147 CO 0.06 -0.39 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.32 1bgx s LEU 148 N 2.73 3.05 -0.01 4.42 0.20 -1.26 -2.32 118.68 125.49 1bgx s LEU 148 Ca 0.24 -0.25 0.00 0.00 0.69 0.00 0.00 54.13 54.81 1bgx s LEU 148 Cb -0.14 -1.74 0.01 0.00 -0.43 0.00 0.00 46.19 43.88 1bgx s LEU 148 CO 0.16 0.10 0.00 0.42 -0.29 0.00 0.00 176.35 176.74 1bgx s THR 149 N 0.76 0.06 -0.19 3.68 -4.23 -0.85 -5.03 115.64 109.85 1bgx s THR 149 Ca -0.02 0.03 -0.18 0.00 -1.18 0.00 0.00 61.69 60.34 1bgx s THR 149 Cb -0.15 -0.10 -0.03 0.00 1.34 0.00 0.00 72.50 73.56 1bgx s THR 149 CO 0.02 0.05 0.49 0.26 -0.54 0.00 0.00 174.62 174.91 1bgx s TRP 150 N 0.36 3.39 -1.29 3.99 0.52 -1.26 -1.91 118.94 122.74 1bgx s TRP 150 Ca -0.03 0.77 -0.04 0.00 0.02 0.00 0.00 56.10 56.81 1bgx s TRP 150 Cb -0.05 -2.63 0.01 0.00 -1.15 0.00 0.00 33.47 29.65 1bgx s TRP 150 CO -0.01 -0.05 1.03 0.09 0.02 0.00 0.00 176.95 178.04 1bgx n ASN 151 N 4.57 -3.66 -1.87 2.95 4.13 -0.92 -2.47 115.26 117.98 1bgx n ASN 151 Ca -0.06 -0.63 -0.21 0.00 1.68 0.00 0.00 54.58 55.37 1bgx n ASN 151 Cb 0.51 -4.88 -0.06 0.00 -1.54 0.00 0.00 39.78 33.80 1bgx n ASN 151 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1bgx n SER 152 N -3.06 -5.67 0.00 6.41 7.64 -1.26 -2.66 113.62 115.02 1bgx n SER 152 Ca -0.16 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1bgx n SER 152 Cb 0.62 -4.90 0.00 0.00 -1.01 0.00 0.00 64.21 58.92 1bgx n SER 152 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bgx n GLY 153 N -0.60 1.25 0.13 0.23 0.00 -1.03 -5.01 105.19 100.16 1bgx n GLY 153 Ca -0.22 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 1bgx n GLY 153 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bgx n SER 154 N 0.69 1.98 -4.58 1.61 7.64 -1.09 -4.88 113.62 114.99 1bgx n SER 154 Ca 0.00 0.04 -0.41 0.00 1.01 0.00 0.00 58.87 59.51 1bgx n SER 154 Cb 0.12 -0.58 -0.07 0.00 -1.01 0.00 0.00 64.21 62.68 1bgx n SER 154 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1bgx s LEU 155 N -6.89 4.21 0.00 -3.43 2.96 -1.13 -4.87 118.68 109.53 1bgx s LEU 155 Ca -0.35 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1bgx s LEU 155 Cb 0.11 -2.78 0.00 0.00 0.50 0.00 0.00 46.19 44.01 1bgx s LEU 155 CO 0.58 -0.54 0.00 -1.54 -1.32 0.00 0.00 176.35 173.53 1bgx n SER 156 N 5.95 1.41 -4.70 3.68 3.41 -1.26 -4.40 113.62 117.71 1bgx n SER 156 Ca -0.01 -0.29 -0.42 0.00 -0.26 0.00 0.00 58.87 57.88 1bgx n SER 156 Cb 0.49 0.87 -0.03 0.00 -0.26 0.00 0.00 64.21 65.28 1bgx n SER 156 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1bgx s SER 157 N -1.15 7.32 -0.00 4.04 0.01 -1.26 -3.62 113.70 119.05 1bgx s SER 157 Ca 0.00 1.61 0.00 0.00 1.31 0.00 0.00 55.95 58.87 1bgx s SER 157 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1bgx s SER 157 CO 0.00 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 173.93 1bgx n GLY 158 N 2.97 0.49 3.64 3.44 0.00 -1.26 -4.53 105.19 109.94 1bgx n GLY 158 Ca 0.07 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1bgx n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bgx s VAL 159 N -1.99 4.82 -0.26 1.61 1.01 -1.24 -3.22 120.40 121.13 1bgx s VAL 159 Ca 0.00 1.52 0.02 0.00 0.00 0.00 0.00 61.98 63.52 1bgx s VAL 159 Cb 0.00 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.31 1bgx s VAL 159 CO 0.00 -0.11 -0.06 -1.00 0.00 0.00 0.00 175.10 173.93 1bgx s HIS 160 N 2.89 2.98 -0.23 5.22 3.76 -0.59 -5.02 115.29 124.29 1bgx s HIS 160 Ca 0.35 -2.20 -0.16 0.00 -0.15 0.00 0.00 55.06 52.90 1bgx s HIS 160 Cb -0.15 -1.94 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 1bgx s HIS 160 CO 0.08 -0.85 0.41 0.99 -0.85 0.00 0.00 174.74 174.52 1bgx s THR 161 N 1.19 5.17 0.06 1.30 2.01 -1.26 -2.28 115.64 121.84 1bgx s THR 161 Ca -0.04 0.68 -0.13 0.00 0.31 0.00 0.00 61.69 62.51 1bgx s THR 161 Cb -0.19 -3.73 -0.06 0.00 0.01 0.00 0.00 72.50 68.52 1bgx s THR 161 CO -0.07 0.20 0.45 -0.36 -0.69 0.00 0.00 174.62 174.15 1bgx s PHE 162 N 1.70 3.66 0.74 4.92 0.08 -0.76 -5.03 117.98 123.29 1bgx s PHE 162 Ca 0.18 0.95 -0.11 0.00 0.12 0.00 0.00 56.93 58.07 1bgx s PHE 162 Cb -0.15 -2.27 0.04 0.00 -0.57 0.00 0.00 43.02 40.06 1bgx s PHE 162 CO 0.09 0.55 1.09 -1.25 -0.10 0.00 0.00 175.22 175.60 1bgx s PRO 163 N -1.56 2.55 0.14 0.24 0.04 -1.26 -4.01 135.00 131.14 1bgx s PRO 163 Ca 0.30 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.69 1bgx s PRO 163 Cb -0.16 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1bgx s PRO 163 CO 0.17 -1.29 0.91 0.00 0.04 0.00 0.00 177.00 176.83 1bgx s ALA 164 N -3.21 3.30 -0.10 8.56 0.00 -1.26 -4.67 121.76 124.39 1bgx s ALA 164 Ca 0.59 0.53 -0.03 0.00 0.00 0.00 0.00 51.96 53.05 1bgx s ALA 164 Cb -0.13 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1bgx s ALA 164 CO 0.54 0.08 0.03 0.08 0.00 0.00 0.00 175.76 176.49 1bgx s VAL 165 N -0.44 4.57 -0.26 0.00 1.01 -1.12 -4.90 120.40 119.26 1bgx s VAL 165 Ca 0.43 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 62.10 1bgx s VAL 165 Cb -0.24 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 1bgx s VAL 165 CO 0.29 0.60 0.43 -0.22 0.00 0.00 0.00 175.10 176.20 1bgx s LEU 166 N -0.85 4.04 -0.47 3.92 1.98 -1.26 -2.90 118.68 123.15 1bgx s LEU 166 Ca 0.13 0.38 0.03 0.00 -2.89 0.00 0.00 54.13 51.78 1bgx s LEU 166 Cb -0.12 -2.52 0.15 0.00 0.66 0.00 0.00 46.19 44.37 1bgx s LEU 166 CO 0.03 -0.22 0.31 0.00 -1.89 0.00 0.00 176.35 174.58 1bgx s GLN 167 N 2.15 1.26 -0.51 1.98 0.00 -0.65 -4.96 119.66 118.94 1bgx s GLN 167 Ca 0.17 -2.18 -0.14 0.00 -0.00 0.00 0.00 55.36 53.22 1bgx s GLN 167 Cb -0.16 -2.07 0.02 0.00 0.00 0.00 0.00 33.01 30.80 1bgx s GLN 167 CO 0.10 -1.27 0.63 0.43 0.00 0.00 0.00 175.29 175.18 1bgx n SER 168 N 3.10 -7.72 -2.69 12.60 7.64 -1.26 -3.71 113.62 121.59 1bgx n SER 168 Ca 0.18 0.33 -0.18 0.00 1.01 0.00 0.00 58.87 60.21 1bgx n SER 168 Cb 0.39 -5.08 0.00 0.00 -1.01 0.00 0.00 64.21 58.51 1bgx n SER 168 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1bgx n ASP 169 N -0.67 -4.72 -3.83 6.43 9.92 -1.26 -4.98 116.55 117.44 1bgx n ASP 169 Ca 0.07 -0.04 -0.12 0.00 -0.53 0.00 0.00 54.79 54.18 1bgx n ASP 169 Cb 0.49 -3.93 -0.10 0.00 -0.64 0.00 0.00 41.12 36.93 1bgx n ASP 169 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1bgx s LEU 170 N -6.05 1.29 0.13 0.64 2.96 -1.24 -4.89 118.68 111.52 1bgx s LEU 170 Ca 0.12 0.06 0.09 0.00 -0.22 0.00 0.00 54.13 54.18 1bgx s LEU 170 Cb -0.06 0.81 -0.04 0.00 0.50 0.00 0.00 46.19 47.40 1bgx s LEU 170 CO 0.15 -0.29 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.41 1bgx s TYR 171 N -0.88 2.55 -0.15 5.38 2.02 -0.86 -1.63 117.35 123.77 1bgx s TYR 171 Ca -0.10 -0.26 -0.05 0.00 -0.37 0.00 0.00 57.07 56.30 1bgx s TYR 171 Cb -0.05 -1.33 0.06 0.00 -0.40 0.00 0.00 41.96 40.24 1bgx s TYR 171 CO 0.02 0.42 0.08 0.99 -1.57 0.00 0.00 175.55 175.49 1bgx s THR 172 N -1.27 -0.07 0.10 -0.71 2.01 -1.14 -2.46 115.64 112.09 1bgx s THR 172 Ca 0.19 -0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.18 1bgx s THR 172 Cb -0.10 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1bgx s THR 172 CO 0.11 -0.22 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.44 1bgx s LEU 173 N 2.14 2.77 0.15 4.42 0.20 -0.41 -2.78 118.68 125.16 1bgx s LEU 173 Ca 0.02 -0.50 -0.04 0.00 0.69 0.00 0.00 54.13 54.31 1bgx s LEU 173 Cb -0.16 -1.61 -0.03 0.00 -0.43 0.00 0.00 46.19 43.97 1bgx s LEU 173 CO -0.08 0.19 0.14 -0.94 -0.29 0.00 0.00 176.35 175.37 1bgx s SER 174 N -2.04 0.21 0.12 3.68 1.04 -1.26 -1.92 113.70 113.53 1bgx s SER 174 Ca 0.18 -1.13 -0.18 0.00 0.48 0.00 0.00 55.95 55.31 1bgx s SER 174 Cb -0.11 0.35 0.04 0.00 0.10 0.00 0.00 66.02 66.41 1bgx s SER 174 CO 0.10 -0.80 0.44 -0.55 0.98 0.00 0.00 173.24 173.42 1bgx s SER 175 N -3.04 -0.31 -0.09 7.02 0.15 -1.11 -1.83 113.70 114.50 1bgx s SER 175 Ca 0.24 -0.20 -0.13 0.00 0.70 0.00 0.00 55.95 56.56 1bgx s SER 175 Cb 0.06 0.49 0.03 0.00 -1.71 0.00 0.00 66.02 64.89 1bgx s SER 175 CO 0.02 -0.84 0.33 -0.94 1.20 0.00 0.00 173.24 173.02 1bgx s SER 176 N -2.65 -0.30 -0.00 5.45 1.04 -0.97 -2.10 113.70 114.18 1bgx s SER 176 Ca 0.01 0.48 0.03 0.00 0.48 0.00 0.00 55.95 56.95 1bgx s SER 176 Cb 0.01 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.68 1bgx s SER 176 CO -0.10 -0.24 -0.11 0.54 0.98 0.00 0.00 173.24 174.31 1bgx s VAL 177 N -0.36 0.86 -0.18 5.02 0.11 -1.15 -1.55 120.40 123.15 1bgx s VAL 177 Ca -0.05 -0.54 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1bgx s VAL 177 Cb -0.03 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 1bgx s VAL 177 CO 0.02 0.19 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.92 1bgx s THR 178 N -0.36 2.36 0.38 5.04 2.01 -1.20 -0.92 115.64 122.95 1bgx s THR 178 Ca 0.03 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.23 1bgx s THR 178 Cb -0.05 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.43 1bgx s THR 178 CO -0.00 0.52 0.14 0.68 -0.69 0.00 0.00 174.62 175.27 1bgx s VAL 179 N 1.23 0.53 0.76 3.82 -7.23 -1.15 -4.62 120.40 113.74 1bgx s VAL 179 Ca 0.03 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.08 1bgx s VAL 179 Cb -0.14 -2.41 0.05 0.00 0.56 0.00 0.00 36.38 34.44 1bgx s VAL 179 CO -0.09 0.00 1.12 0.42 -0.31 0.00 0.00 175.10 176.24 1bgx s THR 180 N -3.30 2.94 -0.52 5.32 -4.23 -1.26 -4.54 115.64 110.05 1bgx s THR 180 Ca 0.28 0.30 0.26 0.00 -1.18 0.00 0.00 61.69 61.35 1bgx s THR 180 Cb 0.03 -3.24 0.31 0.00 1.34 0.00 0.00 72.50 70.94 1bgx s THR 180 CO 0.16 -0.40 1.74 0.28 -0.54 0.00 0.00 174.62 175.87 1bgx h SER 181 N -0.89 0.00 1.16 3.99 0.02 -1.89 -3.13 113.55 112.82 1bgx h SER 181 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1bgx h SER 181 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1bgx h SER 181 CO 0.63 0.00 -0.01 -1.54 -1.14 0.00 0.00 176.83 174.77 1bgx n SER 182 N -2.59 0.30 -0.08 3.07 3.41 -1.26 -3.95 113.62 112.54 1bgx n SER 182 Ca 0.04 0.51 -0.10 0.00 -0.26 0.00 0.00 58.87 59.06 1bgx n SER 182 Cb 0.41 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.72 1bgx n SER 182 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1bgx h THR 183 N 0.00 0.49 -3.37 6.66 2.02 -1.94 -3.44 112.91 113.33 1bgx h THR 183 Ca 0.00 -1.52 -0.56 0.00 0.77 0.00 0.00 66.41 65.10 1bgx h THR 183 Cb 0.59 1.08 -0.05 0.00 -1.74 0.00 0.00 68.15 68.03 1bgx h THR 183 CO 0.00 0.17 0.09 0.86 0.37 0.00 0.00 175.52 177.01 1bgx s TRP 184 N -2.15 3.60 -0.33 3.16 -0.00 -1.25 -1.08 118.94 120.89 1bgx s TRP 184 Ca -0.17 1.27 0.07 0.00 -0.00 0.00 0.00 56.10 57.27 1bgx s TRP 184 Cb 0.02 -2.80 0.49 0.00 -0.00 0.00 0.00 33.47 31.19 1bgx s TRP 184 CO 0.35 0.12 1.47 -0.35 -0.00 0.00 0.00 176.95 178.54 1bgx n PRO 185 N 3.65 2.26 0.16 5.86 -0.04 -1.26 -4.86 135.00 140.77 1bgx n PRO 185 Ca -0.02 -3.40 0.01 0.00 -0.04 0.00 0.00 63.50 60.05 1bgx n PRO 185 Cb 0.51 -1.96 0.27 0.00 -0.04 0.00 0.00 33.50 32.28 1bgx n PRO 185 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1bgx h SER 186 N 1.33 0.00 -3.90 3.54 0.02 -1.60 -3.43 113.55 109.52 1bgx h SER 186 Ca 0.29 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.56 1bgx h SER 186 Cb 1.55 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.83 1bgx h SER 186 CO 0.59 0.49 -0.79 -1.10 -1.14 0.00 0.00 176.83 174.88 1bgx s GLN 187 N -3.88 2.69 -0.22 3.45 -0.21 -0.24 -5.11 119.66 116.15 1bgx s GLN 187 Ca -0.02 -0.73 -0.29 0.00 0.02 0.00 0.00 55.36 54.34 1bgx s GLN 187 Cb 0.13 -2.39 0.01 0.00 1.00 0.00 0.00 33.01 31.76 1bgx s GLN 187 CO 0.74 0.50 1.02 -1.12 -2.12 0.00 0.00 175.29 174.31 1bgx s SER 188 N -0.41 7.09 -0.18 5.90 0.01 -1.26 -4.65 113.70 120.20 1bgx s SER 188 Ca 0.04 1.36 -0.03 0.00 1.31 0.00 0.00 55.95 58.63 1bgx s SER 188 Cb -0.12 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 1bgx s SER 188 CO 0.02 -0.64 -0.04 -0.63 0.41 0.00 0.00 173.24 172.36 1bgx s ILE 189 N 3.08 3.64 0.09 1.44 -1.09 -1.26 -5.01 121.20 122.08 1bgx s ILE 189 Ca 0.44 -0.43 0.07 0.00 -2.23 0.00 0.00 60.65 58.50 1bgx s ILE 189 Cb -0.15 -2.61 -0.03 0.00 -1.58 0.00 0.00 42.46 38.08 1bgx s ILE 189 CO 0.07 0.46 -0.19 0.28 -1.23 0.00 0.00 174.94 174.34 1bgx s THR 190 N 0.79 1.53 -0.35 2.92 -1.32 -1.26 -3.22 115.64 114.73 1bgx s THR 190 Ca -0.02 -1.46 -0.11 0.00 -1.21 0.00 0.00 61.69 58.90 1bgx s THR 190 Cb -0.15 -1.41 0.02 0.00 -1.51 0.00 0.00 72.50 69.45 1bgx s THR 190 CO 0.02 -0.10 0.19 0.00 -2.21 0.00 0.00 174.62 172.52 1bgx s ASN 192 N 1.58 6.11 -0.06 0.00 0.01 -0.80 -2.45 114.94 119.33 1bgx s ASN 192 Ca 0.03 -0.63 0.03 0.00 -0.71 0.00 0.00 52.86 51.58 1bgx s ASN 192 Cb -0.18 -2.16 -0.02 0.00 0.41 0.00 0.00 41.25 39.29 1bgx s ASN 192 CO 0.07 -0.38 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.45 1bgx s VAL 193 N 1.78 3.04 -0.03 1.60 1.01 -1.22 -2.00 120.40 124.58 1bgx s VAL 193 Ca 0.07 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 1bgx s VAL 193 Cb -0.18 -2.20 0.03 0.00 0.00 0.00 0.00 36.38 34.03 1bgx s VAL 193 CO 0.11 0.58 0.04 0.00 0.00 0.00 0.00 175.10 175.83 1bgx s ALA 194 N -0.58 0.15 -0.19 5.51 0.00 -0.98 -3.29 121.76 122.38 1bgx s ALA 194 Ca 0.08 0.26 -0.02 0.00 0.00 0.00 0.00 51.96 52.28 1bgx s ALA 194 Cb -0.11 -0.39 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 1bgx s ALA 194 CO 0.01 -0.25 -0.11 -1.58 0.00 0.00 0.00 175.76 173.83 1bgx s HIS 195 N 1.47 2.87 -0.47 0.00 2.46 -1.14 -1.76 115.29 118.72 1bgx s HIS 195 Ca -0.04 -1.11 0.24 0.00 0.47 0.00 0.00 55.06 54.61 1bgx s HIS 195 Cb -0.13 -2.00 0.37 0.00 -0.13 0.00 0.00 32.58 30.70 1bgx s HIS 195 CO -0.03 -0.57 1.54 -1.35 -2.47 0.00 0.00 174.74 171.86 1bgx h PRO 196 N 7.80 0.00 -0.04 2.88 0.11 -1.91 -2.56 132.00 138.28 1bgx h PRO 196 Ca -0.40 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.61 1bgx h PRO 196 Cb 1.16 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.28 1bgx h PRO 196 CO 0.60 0.00 -0.37 0.00 -0.21 0.00 0.00 178.00 178.03 1bgx h ALA 197 N 2.12 0.10 -0.01 -0.75 0.00 -1.92 -3.35 119.26 115.44 1bgx h ALA 197 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1bgx h ALA 197 Cb 0.94 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1bgx h ALA 197 CO 0.00 0.20 -0.46 -1.13 0.00 0.00 0.00 179.25 177.86 1bgx n SER 198 N -4.40 1.88 -2.57 0.00 3.41 -1.26 -4.99 113.62 105.70 1bgx n SER 198 Ca -0.09 -1.44 -0.21 0.00 -0.26 0.00 0.00 58.87 56.87 1bgx n SER 198 Cb 0.54 0.50 0.01 0.00 -0.26 0.00 0.00 64.21 65.00 1bgx n SER 198 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1bgx n SER 199 N -0.11 -5.92 -4.38 4.04 7.64 -0.97 -4.97 113.62 108.95 1bgx n SER 199 Ca 0.08 -0.12 -0.45 0.00 1.01 0.00 0.00 58.87 59.40 1bgx n SER 199 Cb 0.43 -4.86 -0.07 0.00 -1.01 0.00 0.00 64.21 58.70 1bgx n SER 199 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1bgx s THR 200 N -3.08 5.15 -0.22 0.44 2.01 -1.19 -4.98 115.64 113.78 1bgx s THR 200 Ca 0.11 -1.07 -0.04 0.00 0.31 0.00 0.00 61.69 61.00 1bgx s THR 200 Cb -0.05 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 1bgx s THR 200 CO 0.14 -0.72 -0.04 -0.54 -0.69 0.00 0.00 174.62 172.77 1bgx s LYS 201 N 1.85 3.39 -0.07 4.92 3.01 -1.26 -2.89 119.74 128.69 1bgx s LYS 201 Ca 0.06 -0.62 -0.06 0.00 -1.01 0.00 0.00 55.97 54.34 1bgx s LYS 201 Cb -0.25 -3.00 0.02 0.00 -1.01 0.00 0.00 37.83 33.59 1bgx s LYS 201 CO 0.07 -0.18 0.18 0.54 0.51 0.00 0.00 175.35 176.46 1bgx s VAL 202 N 1.43 -0.00 -0.13 3.17 0.11 -1.21 -5.08 120.40 118.70 1bgx s VAL 202 Ca 0.05 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.05 1bgx s VAL 202 Cb -0.14 -0.25 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 1bgx s VAL 202 CO -0.03 0.00 0.05 -1.81 -3.33 0.00 0.00 175.10 169.98 1bgx s ASP 203 N 0.10 5.59 -0.07 3.54 1.11 -1.26 -3.39 116.67 122.29 1bgx s ASP 203 Ca -0.00 0.18 0.01 0.00 0.18 0.00 0.00 52.55 52.92 1bgx s ASP 203 Cb -0.01 -1.78 0.02 0.00 1.07 0.00 0.00 42.92 42.22 1bgx s ASP 203 CO 0.00 0.31 -0.08 -0.75 1.18 0.00 0.00 175.17 175.83 1bgx s LYS 204 N -0.44 1.32 0.12 8.23 2.47 -1.03 -5.03 119.74 125.39 1bgx s LYS 204 Ca 0.09 -0.25 -0.09 0.00 -1.56 0.00 0.00 55.97 54.17 1bgx s LYS 204 Cb -0.12 -1.24 -0.06 0.00 -1.46 0.00 0.00 37.83 34.95 1bgx s LYS 204 CO 0.02 -0.09 0.43 0.21 0.16 0.00 0.00 175.35 176.07 1bgx s LYS 205 N 1.05 3.74 -0.57 4.03 2.20 -1.26 -1.43 119.74 127.50 1bgx s LYS 205 Ca -0.08 0.14 -0.18 0.00 -0.36 0.00 0.00 55.97 55.49 1bgx s LYS 205 Cb -0.14 -2.90 0.10 0.00 -1.51 0.00 0.00 37.83 33.38 1bgx s LYS 205 CO -0.01 0.49 0.65 0.42 -0.36 0.00 0.00 175.35 176.55 1bgx s ILE 206 N -1.54 4.90 0.16 5.43 -1.09 -1.20 -4.88 121.20 122.98 1bgx s ILE 206 Ca 0.38 -1.02 -0.06 0.00 -2.23 0.00 0.00 60.65 57.72 1bgx s ILE 206 Cb -0.13 -4.43 -0.06 0.00 -1.58 0.00 0.00 42.46 36.26 1bgx s ILE 206 CO 0.20 -1.03 0.41 -1.61 -1.23 0.00 0.00 174.94 171.68 1bgx s GLU 207 N 2.48 3.67 -1.30 2.79 0.41 -1.26 -4.85 118.70 120.64 1bgx s GLU 207 Ca 0.10 0.01 -0.18 0.00 -0.41 0.00 0.00 54.97 54.49 1bgx s GLU 207 Cb -0.24 -2.82 0.03 0.00 -1.78 0.00 0.00 34.13 29.32 1bgx s GLU 207 CO 0.06 0.44 1.91 -0.35 -0.49 0.00 0.00 175.26 176.83 1bgx n PRO 208 N 0.10 2.82 0.00 0.39 -0.04 -1.26 -4.88 135.00 132.13 1bgx n PRO 208 Ca -0.02 -2.92 0.04 0.00 -0.04 0.00 0.00 63.50 60.56 1bgx n PRO 208 Cb 0.52 -3.43 0.03 0.00 -0.04 0.00 0.00 33.50 30.58 1bgx n PRO 208 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00