#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cgb s TYR 3 N 0.00 3.07 -0.06 3.10 1.51 -0.27 -0.12 117.35 124.58 3cgb s TYR 3 Ca 0.00 -0.14 0.06 0.00 -1.01 0.00 0.00 57.07 55.97 3cgb s TYR 3 Cb 0.00 -1.93 -0.01 0.00 -0.11 0.00 0.00 41.96 39.91 3cgb s TYR 3 CO 0.00 0.10 -0.23 0.08 -1.11 0.00 0.00 175.55 174.38 3cgb s VAL 4 N 0.08 2.19 -0.09 0.71 1.01 -0.66 -1.37 120.40 122.28 3cgb s VAL 4 Ca 0.01 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.99 3cgb s VAL 4 Cb -0.13 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.46 3cgb s VAL 4 CO 0.02 0.57 -0.13 -0.63 0.00 0.00 0.00 175.10 174.93 3cgb s ILE 5 N -0.17 1.30 -0.25 2.22 1.01 -0.55 -1.00 121.20 123.75 3cgb s ILE 5 Ca -0.03 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 60.00 3cgb s ILE 5 Cb -0.14 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.10 3cgb s ILE 5 CO 0.04 0.40 0.10 -0.63 0.00 0.00 0.00 174.94 174.85 3cgb s ILE 6 N 0.92 4.58 0.00 2.92 1.01 0.17 -0.42 121.20 130.37 3cgb s ILE 6 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.48 3cgb s ILE 6 Cb -0.15 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3cgb s ILE 6 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.87 3cgb n GLY 7 N 4.90 2.74 2.07 6.18 0.00 0.29 0.07 105.19 121.44 3cgb n GLY 7 Ca -0.16 -1.27 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 3cgb n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cgb n GLY 8 N 1.41 5.98 0.00 -0.02 0.00 -1.26 -4.30 105.19 106.99 3cgb n GLY 8 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.70 3cgb n GLY 8 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3cgb n ASP 9 N -0.85 0.00 0.09 1.61 2.03 -1.26 -1.12 116.55 117.05 3cgb n ASP 9 Ca 0.51 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.70 3cgb n ASP 9 Cb 0.87 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 41.21 3cgb n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3cgb h ALA 10 N 1.00 -0.39 -0.10 -1.67 0.00 -1.93 -2.93 119.26 113.24 3cgb h ALA 10 Ca 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 3cgb h ALA 10 Cb 0.00 0.41 0.01 0.00 0.00 0.00 0.00 17.79 18.21 3cgb h ALA 10 CO 0.00 -0.77 -0.55 0.00 0.00 0.00 0.00 179.25 177.93 3cgb h ALA 11 N 0.35 0.21 0.00 0.00 0.00 -1.89 -1.81 119.26 116.11 3cgb h ALA 11 Ca 0.04 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3cgb h ALA 11 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3cgb h ALA 11 CO -0.17 0.43 0.00 0.41 0.00 0.00 0.00 179.25 179.92 3cgb n GLY 12 N 0.72 0.40 1.70 0.00 0.00 -1.10 -2.23 105.19 104.68 3cgb n GLY 12 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3cgb n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3cgb n SER 14 N 0.03 0.00 -0.05 1.61 7.64 -0.68 -1.27 113.62 120.90 3cgb n SER 14 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 3cgb n SER 14 Cb 0.09 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.21 3cgb n SER 14 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3cgb h ALA 15 N 0.00 0.17 0.00 -0.43 0.00 -1.21 -3.05 119.26 114.75 3cgb h ALA 15 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3cgb h ALA 15 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3cgb h ALA 15 CO 0.00 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.31 3cgb n ALA 16 N -2.43 0.84 0.00 0.00 0.00 -0.40 -1.75 120.51 116.78 3cgb n ALA 16 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3cgb n ALA 16 Cb 0.37 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.08 3cgb n ALA 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3cgb n GLN 18 N 0.51 0.00 -0.07 0.00 1.13 -1.15 -1.29 117.38 116.50 3cgb n GLN 18 Ca 0.00 0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 54.96 3cgb n GLN 18 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.31 3cgb n GLN 18 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3cgb h ILE 19 N 0.00 1.18 -0.80 5.09 2.04 -1.61 -2.18 117.51 121.23 3cgb h ILE 19 Ca 0.00 -0.56 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 3cgb h ILE 19 Cb 0.00 1.09 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 3cgb h ILE 19 CO 0.00 0.18 0.34 0.58 0.00 0.00 0.00 178.15 179.26 3cgb h VAL 20 N 0.23 1.26 0.00 1.67 2.07 -1.44 0.39 116.25 120.43 3cgb h VAL 20 Ca 0.08 -0.78 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 3cgb h VAL 20 Cb 0.20 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3cgb h VAL 20 CO -0.00 0.32 -0.41 0.03 0.02 0.00 0.00 177.57 177.53 3cgb h ARG 21 N 1.15 0.00 -0.01 1.57 3.08 -1.78 -3.36 114.38 115.03 3cgb h ARG 21 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3cgb h ARG 21 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3cgb h ARG 21 CO -0.03 0.41 0.00 0.09 -1.07 0.00 0.00 179.97 179.37 3cgb n ASN 22 N -3.48 1.28 -3.48 7.04 4.13 -0.83 -4.88 115.26 115.05 3cgb n ASN 22 Ca 0.00 -1.16 -0.21 0.00 1.68 0.00 0.00 54.58 54.89 3cgb n ASN 22 Cb 0.55 -0.00 -0.12 0.00 -1.54 0.00 0.00 39.78 38.67 3cgb n ASN 22 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3cgb s ASP 23 N -0.27 2.19 0.44 6.41 -1.08 0.09 -5.02 116.67 119.42 3cgb s ASP 23 Ca 0.03 -0.77 0.24 0.00 -0.52 0.00 0.00 52.55 51.54 3cgb s ASP 23 Cb 0.02 0.18 0.70 0.00 -1.46 0.00 0.00 42.92 42.37 3cgb s ASP 23 CO 0.04 -0.39 1.73 -0.33 0.52 0.00 0.00 175.17 176.74 3cgb h GLU 24 N 8.33 0.00 -0.00 4.34 4.39 -1.83 -2.88 114.58 126.94 3cgb h GLU 24 Ca -0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.54 3cgb h GLU 24 Cb 1.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 3cgb h GLU 24 CO 0.35 0.16 -0.00 0.09 -1.16 0.00 0.00 179.01 178.45 3cgb n ASN 25 N -3.21 0.01 -4.73 1.42 5.03 -1.26 -4.95 115.26 107.56 3cgb n ASN 25 Ca 0.02 0.11 -0.42 0.00 0.87 0.00 0.00 54.58 55.16 3cgb n ASN 25 Cb 0.49 -0.37 -0.03 0.00 -1.02 0.00 0.00 39.78 38.85 3cgb n ASN 25 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3cgb s ALA 26 N -2.74 3.53 -0.48 5.41 0.00 -1.09 -4.94 121.76 121.46 3cgb s ALA 26 Ca 0.23 1.10 -0.13 0.00 0.00 0.00 0.00 51.96 53.16 3cgb s ALA 26 Cb 0.20 -3.49 0.10 0.00 0.00 0.00 0.00 23.12 19.93 3cgb s ALA 26 CO 0.49 -0.54 0.38 1.21 0.00 0.00 0.00 175.76 177.30 3cgb s ASN 27 N 0.53 5.94 -0.27 0.00 2.47 -1.26 -5.02 114.94 117.32 3cgb s ASN 27 Ca 0.58 -1.63 -0.10 0.00 0.42 0.00 0.00 52.86 52.13 3cgb s ASN 27 Cb -0.36 -2.11 -0.04 0.00 -1.45 0.00 0.00 41.25 37.29 3cgb s ASN 27 CO 0.36 -0.69 0.15 -0.69 -3.72 0.00 0.00 177.10 172.51 3cgb s VAL 28 N 1.52 4.95 -0.16 -5.21 1.01 -1.26 -1.11 120.40 120.14 3cgb s VAL 28 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 3cgb s VAL 28 Cb -0.26 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 3cgb s VAL 28 CO 0.03 0.26 -0.09 -0.69 0.00 0.00 0.00 175.10 174.61 3cgb s VAL 29 N 1.71 3.24 -0.05 2.92 1.01 -0.47 -0.47 120.40 128.28 3cgb s VAL 29 Ca 0.07 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.50 3cgb s VAL 29 Cb -0.16 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 3cgb s VAL 29 CO 0.08 0.49 -0.13 0.42 0.00 0.00 0.00 175.10 175.96 3cgb s THR 30 N 0.68 3.14 -0.24 3.92 -4.23 -0.69 -1.49 115.64 116.73 3cgb s THR 30 Ca -0.05 -0.69 0.02 0.00 -1.18 0.00 0.00 61.69 59.79 3cgb s THR 30 Cb -0.15 -2.24 0.05 0.00 1.34 0.00 0.00 72.50 71.50 3cgb s THR 30 CO 0.02 0.59 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.81 3cgb s LEU 31 N -0.71 3.16 -0.09 4.79 1.43 0.44 -1.08 118.68 126.62 3cgb s LEU 31 Ca 0.11 -1.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.05 3cgb s LEU 31 Cb -0.11 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.56 3cgb s LEU 31 CO 0.01 -0.15 -0.24 -0.70 0.23 0.00 0.00 176.35 175.50 3cgb s GLU 32 N 1.16 2.91 0.14 1.70 2.56 -0.94 -0.55 118.70 125.68 3cgb s GLU 32 Ca -0.05 -0.89 -0.13 0.00 0.00 0.00 0.00 54.97 53.90 3cgb s GLU 32 Cb -0.18 -2.26 -0.02 0.00 2.00 0.00 0.00 34.13 33.67 3cgb s GLU 32 CO -0.07 0.24 1.53 -0.22 -0.56 0.00 0.00 175.26 176.18 3cgb h LYS 33 N 6.53 0.84 0.00 4.30 3.64 -1.81 -0.32 116.57 129.76 3cgb h LYS 33 Ca -0.23 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 3cgb h LYS 33 Cb 1.22 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3cgb h LYS 33 CO 0.47 0.97 0.00 0.41 -2.27 0.00 0.00 179.45 179.03 3cgb n GLY 34 N -0.16 0.66 0.36 5.01 0.00 -1.26 -3.21 105.19 106.59 3cgb n GLY 34 Ca -0.01 -1.82 0.05 0.00 0.00 0.00 0.00 46.02 44.24 3cgb n GLY 34 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cgb n GLU 35 N 0.00 0.84 -4.07 1.61 1.02 -1.26 -0.73 120.64 118.05 3cgb n GLU 35 Ca 0.00 -0.98 -0.32 0.00 -0.02 0.00 0.00 57.16 55.84 3cgb n GLU 35 Cb 0.00 -1.16 -0.16 0.00 -0.02 0.00 0.00 31.44 30.10 3cgb n GLU 35 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3cgb s ILE 36 N -0.97 1.91 0.47 -3.67 1.01 -1.26 -4.99 121.20 113.71 3cgb s ILE 36 Ca 0.11 -1.02 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 3cgb s ILE 36 Cb 0.08 -1.84 -0.06 0.00 0.01 0.00 0.00 42.46 40.66 3cgb s ILE 36 CO 0.16 0.35 0.85 -0.31 0.00 0.00 0.00 174.94 175.99 3cgb s TYR 37 N 1.31 3.51 -0.45 3.97 1.51 -1.26 -4.83 117.35 121.12 3cgb s TYR 37 Ca 0.01 1.11 -0.17 0.00 -1.01 0.00 0.00 57.07 57.01 3cgb s TYR 37 Cb -0.15 -2.52 0.02 0.00 -0.11 0.00 0.00 41.96 39.21 3cgb s TYR 37 CO -0.10 -0.28 0.47 0.43 -1.11 0.00 0.00 175.55 174.95 3cgb n SER 38 N -1.78 -3.76 -4.29 2.29 7.64 -0.28 -4.73 113.62 108.71 3cgb n SER 38 Ca 0.03 -0.38 -0.16 0.00 1.01 0.00 0.00 58.87 59.37 3cgb n SER 38 Cb 0.54 -1.16 -0.10 0.00 -1.01 0.00 0.00 64.21 62.48 3cgb n SER 38 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 3cgb s TYR 39 N -1.77 1.46 -0.77 1.43 -0.85 -1.26 -0.07 117.35 115.52 3cgb s TYR 39 Ca 0.16 -0.67 -0.18 0.00 -0.52 0.00 0.00 57.07 55.86 3cgb s TYR 39 Cb -0.02 -0.71 0.14 0.00 0.38 0.00 0.00 41.96 41.75 3cgb s TYR 39 CO 0.65 0.20 0.90 0.00 -1.52 0.00 0.00 175.55 175.78 3cgb s ALA 40 N -3.10 3.51 0.47 9.51 0.00 0.20 -4.85 121.76 127.51 3cgb s ALA 40 Ca 0.19 -2.63 0.27 0.00 0.00 0.00 0.00 51.96 49.79 3cgb s ALA 40 Cb 0.01 -3.75 1.32 0.00 0.00 0.00 0.00 23.12 20.70 3cgb s ALA 40 CO 0.03 -2.61 1.81 1.96 0.00 0.00 0.00 175.76 176.95 3cgb h GLN 41 N 8.80 0.19 0.00 0.00 4.20 -1.89 -1.60 115.11 124.80 3cgb h GLN 41 Ca -0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 3cgb h GLN 41 Cb 1.05 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.79 3cgb h GLN 41 CO 1.04 0.12 -0.05 0.00 -0.67 0.00 0.00 178.83 179.27 3cgb n GLY 43 N -1.22 -1.67 0.32 0.00 0.00 -0.60 -4.32 105.19 97.71 3cgb n GLY 43 Ca -0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 3cgb n GLY 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3cgb h LEU 44 N 0.00 -1.03 -2.64 0.99 4.07 -1.52 -0.27 115.31 114.91 3cgb h LEU 44 Ca 0.00 0.20 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3cgb h LEU 44 Cb 0.74 0.51 0.00 0.00 1.08 0.00 0.00 40.66 42.99 3cgb h LEU 44 CO 0.00 -0.30 0.00 -0.65 -1.08 0.00 0.00 178.44 176.41 3cgb h PRO 45 N -0.19 0.00 0.00 1.13 0.11 -1.80 -1.78 132.00 129.47 3cgb h PRO 45 Ca 0.21 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.25 3cgb h PRO 45 Cb 0.53 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 3cgb h PRO 45 CO -0.59 0.00 -1.47 0.66 -0.21 0.00 0.00 178.00 176.39 3cgb n TYR 46 N -3.02 0.65 -0.06 0.65 4.02 -0.23 -2.24 117.16 116.94 3cgb n TYR 46 Ca -0.02 0.20 -0.14 0.00 -0.01 0.00 0.00 57.90 57.93 3cgb n TYR 46 Cb 0.10 -0.88 -0.07 0.00 -0.02 0.00 0.00 39.34 38.48 3cgb n TYR 46 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3cgb h VAL 47 N 0.00 1.35 -0.66 -0.72 2.07 -0.77 -0.39 116.25 117.13 3cgb h VAL 47 Ca -0.08 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 3cgb h VAL 47 Cb 1.24 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.89 3cgb h VAL 47 CO 0.01 0.45 0.35 0.40 0.02 0.00 0.00 177.57 178.80 3cgb h ILE 48 N 0.11 1.20 0.00 4.57 2.04 -1.36 -0.97 117.51 123.09 3cgb h ILE 48 Ca 0.01 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3cgb h ILE 48 Cb 0.84 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3cgb h ILE 48 CO 0.06 0.22 0.00 -1.54 0.00 0.00 0.00 178.15 176.89 3cgb n SER 49 N -4.37 0.34 0.00 1.72 3.41 -0.95 -4.90 113.62 108.87 3cgb n SER 49 Ca 0.06 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 3cgb n SER 49 Cb 0.10 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 3cgb n SER 49 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cgb n GLY 50 N 0.72 1.37 0.30 5.00 0.00 -0.37 -4.88 105.19 107.32 3cgb n GLY 50 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 3cgb n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cgb h ALA 51 N 0.00 2.15 -3.99 4.61 0.00 -1.51 -3.40 119.26 117.13 3cgb h ALA 51 Ca 0.00 -0.01 -0.69 0.00 0.00 0.00 0.00 54.91 54.21 3cgb h ALA 51 Cb 0.00 0.01 -0.23 0.00 0.00 0.00 0.00 17.79 17.56 3cgb h ALA 51 CO 0.00 -0.20 -0.76 0.42 0.00 0.00 0.00 179.25 178.70 3cgb s ILE 52 N -5.07 3.11 0.19 0.00 1.01 -0.26 -4.98 121.20 115.19 3cgb s ILE 52 Ca -0.05 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3cgb s ILE 52 Cb 0.18 -2.22 0.09 0.00 0.01 0.00 0.00 42.46 40.52 3cgb s ILE 52 CO 0.69 0.59 1.81 0.00 0.00 0.00 0.00 174.94 178.03 3cgb h ALA 53 N 5.38 0.73 -2.56 9.38 0.00 -1.89 -3.40 119.26 126.89 3cgb h ALA 53 Ca -0.46 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.56 3cgb h ALA 53 Cb 1.16 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 3cgb h ALA 53 CO 0.51 0.02 0.39 -1.54 0.00 0.00 0.00 179.25 178.63 3cgb s SER 54 N -5.59 -0.28 0.49 0.00 1.04 -1.26 -5.04 113.70 103.06 3cgb s SER 54 Ca -0.13 -0.32 0.24 0.00 0.48 0.00 0.00 55.95 56.22 3cgb s SER 54 Cb 0.14 0.54 1.29 0.00 0.10 0.00 0.00 66.02 68.08 3cgb s SER 54 CO 0.75 -0.96 2.02 0.71 0.98 0.00 0.00 173.24 176.74 3cgb h THR 55 N 2.00 0.71 0.00 2.02 1.35 -1.95 -2.04 112.91 115.00 3cgb h THR 55 Ca -0.24 -0.65 -0.00 0.00 -0.55 0.00 0.00 66.41 64.96 3cgb h THR 55 Cb 1.25 1.40 -0.00 0.00 -1.73 0.00 0.00 68.15 69.07 3cgb h THR 55 CO 0.28 0.16 -0.02 -0.08 -0.25 0.00 0.00 175.52 175.60 3cgb h GLU 56 N 0.00 0.00 0.00 4.72 4.81 -1.99 -0.08 114.58 122.04 3cgb h GLU 56 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3cgb h GLU 56 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.77 3cgb h GLU 56 CO 0.02 0.02 0.00 0.87 -0.73 0.00 0.00 179.01 179.19 3cgb h LYS 57 N 0.00 0.00 -0.00 1.92 1.79 -1.79 -2.94 116.57 115.55 3cgb h LYS 57 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3cgb h LYS 57 Cb 0.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 3cgb h LYS 57 CO 0.00 0.00 -0.21 1.28 -1.08 0.00 0.00 179.45 179.44 3cgb n LEU 58 N -2.94 0.40 -4.66 2.94 4.77 -0.04 -4.84 117.00 112.62 3cgb n LEU 58 Ca 0.01 0.11 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 3cgb n LEU 58 Cb 0.33 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 3cgb n LEU 58 CO 0.27 0.08 0.98 -0.63 -1.33 0.00 0.00 177.39 176.77 3cgb s ILE 59 N -2.77 4.48 -0.06 -0.08 1.01 -1.11 -0.63 121.20 122.04 3cgb s ILE 59 Ca 0.19 1.79 0.06 0.00 0.00 0.00 0.00 60.65 62.69 3cgb s ILE 59 Cb 0.19 -4.16 -0.24 0.00 0.01 0.00 0.00 42.46 38.26 3cgb s ILE 59 CO 0.56 -0.14 0.61 0.00 0.00 0.00 0.00 174.94 175.97 3cgb h ALA 60 N 7.75 0.64 -2.27 9.38 0.00 -0.77 -3.47 119.26 130.53 3cgb h ALA 60 Ca -0.24 -1.41 -0.03 0.00 0.00 0.00 0.00 54.91 53.23 3cgb h ALA 60 Cb 1.09 0.52 -0.23 0.00 0.00 0.00 0.00 17.79 19.17 3cgb h ALA 60 CO 0.96 1.47 -0.13 0.50 0.00 0.00 0.00 179.25 182.06 3cgb s ARG 61 N -2.59 0.56 0.50 0.00 3.52 -1.21 -5.08 118.95 114.65 3cgb s ARG 61 Ca -0.10 1.07 -0.01 0.00 -0.13 0.00 0.00 55.73 56.56 3cgb s ARG 61 Cb 0.08 0.13 0.01 0.00 -1.56 0.00 0.00 34.95 33.60 3cgb s ARG 61 CO 0.81 -0.16 0.75 0.54 -0.81 0.00 0.00 175.30 176.43 3cgb s ASN 62 N 1.67 5.69 0.43 -2.12 6.03 -1.26 -4.36 114.94 121.02 3cgb s ASN 62 Ca -0.09 0.37 0.09 0.00 -1.03 0.00 0.00 52.86 52.20 3cgb s ASN 62 Cb -0.07 -1.50 0.95 0.00 -3.03 0.00 0.00 41.25 37.61 3cgb s ASN 62 CO -0.17 -0.87 2.07 1.62 -2.03 0.00 0.00 177.10 177.72 3cgb h VAL 63 N 0.19 1.09 -0.63 3.54 3.04 -1.95 -0.79 116.25 120.74 3cgb h VAL 63 Ca -0.45 -0.20 -0.00 0.00 -1.01 0.00 0.00 66.70 65.04 3cgb h VAL 63 Cb 1.26 0.69 -0.03 0.00 -2.01 0.00 0.00 31.29 31.20 3cgb h VAL 63 CO 0.58 0.09 0.38 0.50 -1.01 0.00 0.00 177.57 178.11 3cgb h LYS 64 N 0.39 0.84 -0.35 4.17 3.64 -1.98 -0.39 116.57 122.90 3cgb h LYS 64 Ca 0.10 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 3cgb h LYS 64 Cb -0.01 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 3cgb h LYS 64 CO -0.02 0.60 0.04 1.15 -2.27 0.00 0.00 179.45 178.95 3cgb h THR 65 N 0.85 1.24 -0.67 1.00 2.02 -1.56 0.20 112.91 115.99 3cgb h THR 65 Ca 0.23 -0.87 0.07 0.00 0.77 0.00 0.00 66.41 66.61 3cgb h THR 65 Cb -0.04 1.14 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 3cgb h THR 65 CO -0.04 0.29 0.35 -0.26 0.37 0.00 0.00 175.52 176.22 3cgb h PHE 66 N 0.41 0.63 0.24 3.16 0.04 -1.16 0.03 116.94 120.29 3cgb h PHE 66 Ca 0.10 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 3cgb h PHE 66 Cb 0.38 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.35 3cgb h PHE 66 CO 0.03 0.26 -0.11 0.00 -0.60 0.00 0.00 178.31 177.89 3cgb h ARG 67 N 0.62 -0.31 -0.14 1.51 3.08 -0.99 -2.15 114.38 116.01 3cgb h ARG 67 Ca 0.32 0.02 -0.21 0.00 0.07 0.00 0.00 59.98 60.18 3cgb h ARG 67 Cb 0.27 0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.40 3cgb h ARG 67 CO -0.23 -0.04 -0.73 -0.44 -1.07 0.00 0.00 179.97 177.47 3cgb h ASP 68 N -1.02 0.89 0.32 7.04 3.32 -0.62 -2.24 116.42 124.11 3cgb h ASP 68 Ca -0.03 -0.63 -0.33 0.00 0.02 0.00 0.00 57.03 56.05 3cgb h ASP 68 Cb 0.41 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3cgb h ASP 68 CO 0.05 1.38 -1.71 0.50 -1.72 0.00 0.00 179.24 177.74 3cgb h LYS 69 N 0.46 0.27 -0.01 3.56 3.64 -1.14 -3.40 116.57 119.94 3cgb h LYS 69 Ca -0.05 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3cgb h LYS 69 Cb 1.36 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 3cgb h LYS 69 CO 0.15 1.13 -0.13 0.66 -2.27 0.00 0.00 179.45 178.98 3cgb n TYR 70 N -3.45 0.00 -1.29 1.91 4.02 -1.13 -4.99 117.16 112.22 3cgb n TYR 70 Ca -0.22 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.57 3cgb n TYR 70 Cb 1.05 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.33 3cgb n TYR 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3cgb n GLY 71 N 0.80 1.12 3.74 2.72 0.00 -0.84 -4.98 105.19 107.75 3cgb n GLY 71 Ca 0.05 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 3cgb n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cgb s ILE 72 N -2.24 4.07 -1.24 -0.61 1.01 -0.82 -4.72 121.20 116.65 3cgb s ILE 72 Ca 0.00 1.93 -0.15 0.00 0.00 0.00 0.00 60.65 62.44 3cgb s ILE 72 Cb 0.00 -4.23 0.14 0.00 0.01 0.00 0.00 42.46 38.38 3cgb s ILE 72 CO 0.00 0.40 1.55 -0.67 0.00 0.00 0.00 174.94 176.22 3cgb n ASP 73 N 1.92 5.13 -4.62 3.58 2.03 0.38 -3.88 116.55 121.08 3cgb n ASP 73 Ca -0.00 -2.97 -0.42 0.00 0.52 0.00 0.00 54.79 51.93 3cgb n ASP 73 Cb 0.47 -1.61 -0.05 0.00 -0.72 0.00 0.00 41.12 39.21 3cgb n ASP 73 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3cgb s ALA 74 N 2.21 3.56 -0.10 -1.67 0.00 -1.26 -1.70 121.76 122.80 3cgb s ALA 74 Ca 0.46 -0.41 -0.06 0.00 0.00 0.00 0.00 51.96 51.95 3cgb s ALA 74 Cb -0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 3cgb s ALA 74 CO 0.02 -1.09 0.15 0.15 0.00 0.00 0.00 175.76 174.99 3cgb s LYS 75 N 2.83 3.43 0.32 0.00 -0.14 -0.24 -4.95 119.74 120.99 3cgb s LYS 75 Ca 0.31 -0.18 0.09 0.00 -1.36 0.00 0.00 55.97 54.83 3cgb s LYS 75 Cb -0.15 -3.16 -0.04 0.00 -1.68 0.00 0.00 37.83 32.80 3cgb s LYS 75 CO 0.11 0.76 0.10 0.14 -0.76 0.00 0.00 175.35 175.69 3cgb s VAL 76 N -1.09 3.09 -1.30 3.17 -7.23 -1.26 -2.22 120.40 113.55 3cgb s VAL 76 Ca 0.18 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 58.58 3cgb s VAL 76 Cb -0.12 -2.94 0.00 0.00 0.56 0.00 0.00 36.38 33.88 3cgb s VAL 76 CO 0.07 -0.23 0.00 0.54 -0.31 0.00 0.00 175.10 175.18 3cgb n ARG 77 N -1.08 -2.01 -3.88 4.82 1.74 0.10 -4.89 116.66 111.47 3cgb n ARG 77 Ca -0.04 0.74 -0.35 0.00 -0.77 0.00 0.00 57.85 57.43 3cgb n ARG 77 Cb 0.61 -5.33 -0.13 0.00 -1.02 0.00 0.00 32.46 26.58 3cgb n ARG 77 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3cgb s HIS 78 N -2.71 3.36 -0.27 -1.55 3.76 -0.21 -1.32 115.29 116.36 3cgb s HIS 78 Ca 0.00 -2.02 -0.13 0.00 -0.15 0.00 0.00 55.06 52.76 3cgb s HIS 78 Cb 0.00 -2.41 -0.04 0.00 1.11 0.00 0.00 32.58 31.24 3cgb s HIS 78 CO 0.00 -0.84 0.26 -2.00 -0.85 0.00 0.00 174.74 171.31 3cgb s GLU 79 N 1.22 4.00 0.09 1.40 2.12 -0.23 -2.64 118.70 124.65 3cgb s GLU 79 Ca -0.01 -0.15 -0.31 0.00 0.36 0.00 0.00 54.97 54.86 3cgb s GLU 79 Cb -0.20 -3.64 -0.06 0.00 0.26 0.00 0.00 34.13 30.49 3cgb s GLU 79 CO -0.02 -0.18 1.24 0.08 -0.54 0.00 0.00 175.26 175.84 3cgb s VAL 80 N 1.76 3.83 -0.02 3.70 1.01 -1.26 0.08 120.40 129.49 3cgb s VAL 80 Ca 0.11 1.33 0.05 0.00 0.00 0.00 0.00 61.98 63.47 3cgb s VAL 80 Cb -0.16 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.30 3cgb s VAL 80 CO 0.10 0.12 0.12 0.35 0.00 0.00 0.00 175.10 175.78 3cgb n THR 81 N 3.78 0.00 -3.66 3.92 -2.24 0.15 -4.93 114.28 111.30 3cgb n THR 81 Ca 0.09 -0.13 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 3cgb n THR 81 Cb 0.45 0.43 -0.08 0.00 -2.10 0.00 0.00 70.33 69.04 3cgb n THR 81 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3cgb s LYS 82 N -2.28 0.75 -0.10 -0.78 2.20 -1.18 -4.79 119.74 113.55 3cgb s LYS 82 Ca -0.02 0.82 0.04 0.00 -0.36 0.00 0.00 55.97 56.45 3cgb s LYS 82 Cb 0.03 0.36 0.00 0.00 -1.51 0.00 0.00 37.83 36.72 3cgb s LYS 82 CO 0.21 -0.10 -0.23 0.08 -0.36 0.00 0.00 175.35 174.95 3cgb s VAL 83 N 0.23 1.98 -0.45 4.02 1.01 -1.26 -0.98 120.40 124.95 3cgb s VAL 83 Ca -0.01 -0.97 -0.14 0.00 0.00 0.00 0.00 61.98 60.86 3cgb s VAL 83 Cb -0.04 -1.72 0.07 0.00 0.00 0.00 0.00 36.38 34.69 3cgb s VAL 83 CO 0.01 0.54 0.35 -0.62 0.00 0.00 0.00 175.10 175.39 3cgb s ASP 84 N 0.40 6.03 0.25 3.32 -1.08 0.02 -4.80 116.67 120.79 3cgb s ASP 84 Ca -0.18 -1.32 0.25 0.00 -0.52 0.00 0.00 52.55 50.78 3cgb s ASP 84 Cb -0.18 -2.14 0.67 0.00 -1.46 0.00 0.00 42.92 39.82 3cgb s ASP 84 CO 0.08 -0.60 1.70 0.71 0.52 0.00 0.00 175.17 177.57 3cgb h THR 85 N 5.82 0.00 0.06 1.71 1.35 -1.91 0.17 112.91 120.10 3cgb h THR 85 Ca -0.27 -0.59 -0.14 0.00 -0.55 0.00 0.00 66.41 64.86 3cgb h THR 85 Cb 1.11 1.54 -0.00 0.00 -1.73 0.00 0.00 68.15 69.07 3cgb h THR 85 CO 0.84 0.00 -0.72 -0.33 -0.25 0.00 0.00 175.52 175.06 3cgb h GLU 86 N 0.00 0.12 0.00 4.72 4.39 -1.96 -3.33 114.58 118.52 3cgb h GLU 86 Ca 0.00 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.50 3cgb h GLU 86 Cb 0.79 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 3cgb h GLU 86 CO 0.00 1.10 0.00 1.63 -1.16 0.00 0.00 179.01 180.58 3cgb n LYS 87 N -4.32 0.11 -3.46 2.33 4.76 -1.23 -4.95 118.16 111.40 3cgb n LYS 87 Ca -0.18 0.11 -0.19 0.00 -2.87 0.00 0.00 58.31 55.17 3cgb n LYS 87 Cb 0.68 -1.64 0.06 0.00 -1.84 0.00 0.00 35.03 32.30 3cgb n LYS 87 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3cgb n LYS 88 N -1.84 -3.83 -4.54 1.97 5.02 0.51 -4.89 118.16 110.56 3cgb n LYS 88 Ca 0.06 0.75 -0.23 0.00 -2.02 0.00 0.00 58.31 56.87 3cgb n LYS 88 Cb 0.37 -5.45 -0.16 0.00 -0.02 0.00 0.00 35.03 29.77 3cgb n LYS 88 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3cgb s ILE 89 N -3.46 1.03 -0.18 -0.18 1.01 -0.61 -1.59 121.20 117.22 3cgb s ILE 89 Ca 0.24 -0.46 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 3cgb s ILE 89 Cb -0.05 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3cgb s ILE 89 CO 0.77 0.32 0.05 -0.69 0.00 0.00 0.00 174.94 175.39 3cgb s VAL 90 N 0.38 4.70 -0.21 2.92 1.01 0.72 -0.80 120.40 129.10 3cgb s VAL 90 Ca -0.08 -0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 3cgb s VAL 90 Cb -0.12 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 3cgb s VAL 90 CO 0.02 0.46 0.03 -0.31 0.00 0.00 0.00 175.10 175.30 3cgb s TYR 91 N 0.39 3.08 0.02 5.22 1.51 -0.15 -0.35 117.35 127.08 3cgb s TYR 91 Ca 0.02 -0.37 0.08 0.00 -1.01 0.00 0.00 57.07 55.80 3cgb s TYR 91 Cb -0.13 -2.14 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 3cgb s TYR 91 CO 0.00 -0.23 -0.24 0.00 -1.11 0.00 0.00 175.55 173.98 3cgb s ALA 92 N 1.12 2.04 -0.17 3.71 0.00 0.74 -0.68 121.76 128.52 3cgb s ALA 92 Ca 0.03 -1.13 -0.08 0.00 0.00 0.00 0.00 51.96 50.78 3cgb s ALA 92 Cb -0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 3cgb s ALA 92 CO 0.02 0.48 0.11 -2.00 0.00 0.00 0.00 175.76 174.38 3cgb s GLU 93 N -0.99 3.86 0.04 0.00 2.12 0.11 0.65 118.70 124.49 3cgb s GLU 93 Ca 0.10 -0.23 -0.31 0.00 0.36 0.00 0.00 54.97 54.89 3cgb s GLU 93 Cb -0.09 -3.27 -0.06 0.00 0.26 0.00 0.00 34.13 30.96 3cgb s GLU 93 CO 0.01 0.45 1.40 -1.58 -0.54 0.00 0.00 175.26 175.01 3cgb s HIS 94 N -0.11 2.98 0.01 5.30 5.65 0.39 -1.07 115.29 128.45 3cgb s HIS 94 Ca 0.09 0.85 0.32 0.00 0.25 0.00 0.00 55.06 56.57 3cgb s HIS 94 Cb -0.12 -3.68 1.30 0.00 -1.18 0.00 0.00 32.58 28.91 3cgb s HIS 94 CO 0.00 -2.46 1.94 1.79 -0.65 0.00 0.00 174.74 175.36 3cgb h THR 95 N 4.68 0.00 0.00 0.89 1.35 -1.54 0.32 112.91 118.60 3cgb h THR 95 Ca -0.40 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 3cgb h THR 95 Cb 1.19 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 3cgb h THR 95 CO 0.89 0.00 -0.48 1.17 -0.25 0.00 0.00 175.52 176.85 3cgb n LYS 96 N -2.96 0.31 0.19 4.72 4.81 -1.26 -4.65 118.16 119.31 3cgb n LYS 96 Ca 0.01 0.27 0.06 0.00 -0.87 0.00 0.00 58.31 57.77 3cgb n LYS 96 Cb 0.30 -1.20 0.37 0.00 0.02 0.00 0.00 35.03 34.52 3cgb n LYS 96 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 3cgb h THR 97 N -0.62 0.93 0.00 3.15 1.35 -1.96 -3.46 112.91 112.29 3cgb h THR 97 Ca 0.00 -1.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.43 3cgb h THR 97 Cb 0.48 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 3cgb h THR 97 CO 0.00 0.36 0.00 0.29 -0.25 0.00 0.00 175.52 175.92 3cgb n LYS 98 N -3.62 -0.61 -1.91 4.72 4.76 0.11 -4.98 118.16 116.63 3cgb n LYS 98 Ca -0.01 0.15 -0.40 0.00 -2.87 0.00 0.00 58.31 55.19 3cgb n LYS 98 Cb 0.48 -3.67 0.00 0.00 -1.84 0.00 0.00 35.03 30.00 3cgb n LYS 98 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3cgb s ASP 99 N -2.13 6.18 -0.16 4.39 1.01 -1.26 -4.55 116.67 120.15 3cgb s ASP 99 Ca 0.00 2.84 -0.11 0.00 0.71 0.00 0.00 52.55 55.99 3cgb s ASP 99 Cb 0.00 -2.65 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 3cgb s ASP 99 CO 0.00 -0.96 0.21 -0.69 0.21 0.00 0.00 175.17 173.95 3cgb s VAL 100 N -1.20 5.36 0.16 -1.27 1.01 -1.26 -0.46 120.40 122.74 3cgb s VAL 100 Ca 0.57 0.38 0.11 0.00 0.00 0.00 0.00 61.98 63.04 3cgb s VAL 100 Cb -0.42 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 3cgb s VAL 100 CO 0.55 0.46 -0.25 -0.36 0.00 0.00 0.00 175.10 175.50 3cgb s PHE 101 N 0.10 2.24 0.07 5.22 0.08 0.21 -4.98 117.98 120.93 3cgb s PHE 101 Ca 0.13 -0.38 0.07 0.00 0.12 0.00 0.00 56.93 56.88 3cgb s PHE 101 Cb -0.12 -1.16 -0.03 0.00 -0.57 0.00 0.00 43.02 41.14 3cgb s PHE 101 CO 0.02 0.41 -0.20 -1.83 -0.10 0.00 0.00 175.22 173.52 3cgb s GLU 102 N -2.41 1.23 -0.07 0.44 -1.05 -1.26 -0.19 118.70 115.40 3cgb s GLU 102 Ca 0.17 -1.02 -0.01 0.00 -0.15 0.00 0.00 54.97 53.97 3cgb s GLU 102 Cb -0.09 -1.39 0.03 0.00 -0.44 0.00 0.00 34.13 32.24 3cgb s GLU 102 CO 0.08 0.34 -0.02 -0.06 0.95 0.00 0.00 175.26 176.55 3cgb s PHE 103 N -0.96 0.74 0.16 4.83 0.40 0.52 -4.95 117.98 118.72 3cgb s PHE 103 Ca 0.06 -0.22 -0.27 0.00 -0.60 0.00 0.00 56.93 55.91 3cgb s PHE 103 Cb -0.09 -0.79 -0.08 0.00 0.51 0.00 0.00 43.02 42.57 3cgb s PHE 103 CO 0.03 -0.30 0.84 0.45 0.70 0.00 0.00 175.22 176.93 3cgb s SER 104 N 1.66 7.44 0.08 1.36 0.15 -1.26 -0.20 113.70 122.93 3cgb s SER 104 Ca 0.01 1.70 0.07 0.00 0.70 0.00 0.00 55.95 58.43 3cgb s SER 104 Cb -0.13 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.62 3cgb s SER 104 CO -0.04 0.13 -0.19 -0.72 1.20 0.00 0.00 173.24 173.62 3cgb s TYR 105 N -0.83 1.63 -0.18 3.44 -0.85 -0.62 -4.84 117.35 115.09 3cgb s TYR 105 Ca 0.39 -0.42 -0.13 0.00 -0.52 0.00 0.00 57.07 56.39 3cgb s TYR 105 Cb -0.23 -0.91 -0.21 0.00 0.38 0.00 0.00 41.96 40.98 3cgb s TYR 105 CO 0.28 0.15 0.19 -0.25 -1.52 0.00 0.00 175.55 174.39 3cgb n ASP 106 N 1.27 1.99 -4.09 -0.18 10.43 0.83 -4.85 116.55 121.95 3cgb n ASP 106 Ca -0.19 0.28 -0.20 0.00 2.57 0.00 0.00 54.79 57.25 3cgb n ASP 106 Cb 0.54 -0.87 -0.14 0.00 1.84 0.00 0.00 41.12 42.49 3cgb n ASP 106 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3cgb s ARG 107 N -2.47 0.89 -0.02 -1.24 0.52 -1.00 -4.86 118.95 110.77 3cgb s ARG 107 Ca -0.28 -0.57 0.07 0.00 -0.52 0.00 0.00 55.73 54.43 3cgb s ARG 107 Cb 0.07 -0.86 -0.02 0.00 0.52 0.00 0.00 34.95 34.66 3cgb s ARG 107 CO 0.66 0.22 -0.21 -1.17 0.02 0.00 0.00 175.30 174.82 3cgb s LEU 108 N -0.70 2.04 -0.12 2.53 2.96 -0.08 -1.65 118.68 123.66 3cgb s LEU 108 Ca 0.02 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.58 3cgb s LEU 108 Cb -0.06 -1.10 0.00 0.00 0.50 0.00 0.00 46.19 45.54 3cgb s LEU 108 CO 0.00 0.26 -0.21 -0.22 -1.32 0.00 0.00 176.35 174.86 3cgb s LEU 109 N -0.49 2.20 -0.30 -0.68 2.96 -0.17 -0.18 118.68 122.02 3cgb s LEU 109 Ca 0.08 -0.54 -0.14 0.00 -0.22 0.00 0.00 54.13 53.31 3cgb s LEU 109 Cb -0.08 -1.46 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 3cgb s LEU 109 CO -0.01 0.12 0.34 -0.63 -1.32 0.00 0.00 176.35 174.86 3cgb s ILE 110 N 0.56 5.19 -0.33 6.68 1.01 -0.16 -0.66 121.20 133.50 3cgb s ILE 110 Ca -0.13 0.32 0.17 0.00 0.00 0.00 0.00 60.65 61.02 3cgb s ILE 110 Cb -0.17 -3.71 0.45 0.00 0.01 0.00 0.00 42.46 39.04 3cgb s ILE 110 CO 0.04 0.08 0.94 0.00 0.00 0.00 0.00 174.94 176.01 3cgb n ALA 111 N 5.31 3.39 0.47 9.38 0.00 0.11 -2.47 120.51 136.70 3cgb n ALA 111 Ca -0.10 -3.17 0.12 0.00 0.00 0.00 0.00 53.44 50.29 3cgb n ALA 111 Cb 0.50 -0.93 0.23 0.00 0.00 0.00 0.00 19.45 19.26 3cgb n ALA 111 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3cgb n THR 112 N -0.05 0.44 -4.83 0.00 -2.24 -1.21 -4.15 114.28 102.24 3cgb n THR 112 Ca 0.11 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 3cgb n THR 112 Cb 0.81 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.96 3cgb n THR 112 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cgb n GLY 113 N 1.45 0.34 3.63 3.38 0.00 -1.26 -4.41 105.19 108.31 3cgb n GLY 113 Ca 0.19 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 3cgb n GLY 113 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cgb s VAL 114 N 0.00 2.31 0.06 1.61 -7.23 -1.26 -1.06 120.40 114.82 3cgb s VAL 114 Ca 0.00 -1.99 0.08 0.00 -1.81 0.00 0.00 61.98 58.27 3cgb s VAL 114 Cb 0.00 -2.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.06 3cgb s VAL 114 CO 0.00 -0.11 -0.23 0.00 -0.31 0.00 0.00 175.10 174.45 3cgb s ARG 115 N -3.72 1.46 0.42 4.82 1.70 0.38 -4.81 118.95 119.20 3cgb s ARG 115 Ca 0.35 -1.05 -0.25 0.00 -0.47 0.00 0.00 55.73 54.31 3cgb s ARG 115 Cb 0.04 -1.65 -0.08 0.00 -0.57 0.00 0.00 34.95 32.69 3cgb s ARG 115 CO 0.19 0.41 1.26 -1.25 -1.08 0.00 0.00 175.30 174.83 3cgb s PRO 116 N -1.37 3.92 0.00 3.89 0.04 -1.26 -0.39 135.00 139.83 3cgb s PRO 116 Ca 0.09 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.18 3cgb s PRO 116 Cb -0.09 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.77 3cgb s PRO 116 CO 0.03 -0.50 0.00 0.28 0.04 0.00 0.00 177.00 176.85 3cgb n VAL 117 N -0.00 0.00 -4.17 -0.36 0.31 0.50 -4.84 118.33 109.76 3cgb n VAL 117 Ca 0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.27 3cgb n VAL 117 Cb 0.45 -1.39 -0.10 0.00 -0.91 0.00 0.00 33.84 31.88 3cgb n VAL 117 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3cgb s PRO 119 N 1.24 0.83 -1.52 5.55 0.02 -1.26 -4.59 135.00 135.27 3cgb s PRO 119 Ca 0.00 -1.34 -0.11 0.00 0.02 0.00 0.00 61.00 59.57 3cgb s PRO 119 Cb 0.00 -0.16 -0.05 0.00 0.02 0.00 0.00 34.50 34.30 3cgb s PRO 119 CO 0.00 -0.04 2.70 -1.91 -0.33 0.00 0.00 177.00 177.42 3cgb n GLU 120 N -0.04 3.34 -3.66 5.54 4.07 -1.26 -4.92 120.64 123.71 3cgb n GLU 120 Ca -0.12 -2.26 -0.37 0.00 -0.06 0.00 0.00 57.16 54.35 3cgb n GLU 120 Cb 0.61 -2.91 -0.06 0.00 -0.06 0.00 0.00 31.44 29.02 3cgb n GLU 120 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 3cgb s TRP 121 N 2.58 3.66 0.26 4.31 0.51 -1.26 -5.05 118.94 123.95 3cgb s TRP 121 Ca 0.62 0.79 -0.31 0.00 -2.12 0.00 0.00 56.10 55.08 3cgb s TRP 121 Cb 0.16 -2.14 -0.13 0.00 -0.81 0.00 0.00 33.47 30.56 3cgb s TRP 121 CO -0.06 0.67 1.39 -1.91 -0.51 0.00 0.00 176.95 176.52 3cgb n GLU 122 N 1.76 2.07 -0.26 4.98 2.13 -1.26 -1.65 120.64 128.41 3cgb n GLU 122 Ca -0.15 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.40 3cgb n GLU 122 Cb 0.53 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.86 3cgb n GLU 122 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cgb n GLY 123 N 1.90 1.36 0.24 8.31 0.00 -1.25 -0.11 105.19 115.64 3cgb n GLY 123 Ca 0.10 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.36 3cgb n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cgb n ARG 124 N -2.00 -0.05 0.06 1.61 1.74 -0.66 -0.50 116.66 116.86 3cgb n ARG 124 Ca 0.00 1.05 0.12 0.00 -0.77 0.00 0.00 57.85 58.25 3cgb n ARG 124 Cb 0.00 -1.88 0.20 0.00 -1.02 0.00 0.00 32.46 29.76 3cgb n ARG 124 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3cgb n ASP 125 N -4.74 0.68 -4.67 0.55 5.75 -1.26 -4.82 116.55 108.03 3cgb n ASP 125 Ca 0.28 0.13 -0.43 0.00 -0.01 0.00 0.00 54.79 54.76 3cgb n ASP 125 Cb 0.95 0.09 -0.01 0.00 -1.03 0.00 0.00 41.12 41.12 3cgb n ASP 125 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3cgb n LEU 126 N -2.06 3.11 -4.69 -2.12 4.77 0.34 -4.89 117.00 111.46 3cgb n LEU 126 Ca 0.04 1.19 -0.44 0.00 -0.03 0.00 0.00 56.01 56.77 3cgb n LEU 126 Cb 0.43 -1.43 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 3cgb n LEU 126 CO 0.36 -0.68 1.20 0.00 -1.33 0.00 0.00 177.39 176.93 3cgb n GLN 127 N 0.77 2.35 -0.10 3.23 1.13 -1.01 -2.21 117.38 121.55 3cgb n GLN 127 Ca 0.07 0.84 0.00 0.00 -1.94 0.00 0.00 57.00 55.97 3cgb n GLN 127 Cb 0.35 -2.61 0.00 0.00 0.11 0.00 0.00 30.24 28.09 3cgb n GLN 127 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3cgb n GLY 128 N 3.05 0.53 3.67 1.08 0.00 -1.26 -1.52 105.19 110.74 3cgb n GLY 128 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3cgb n GLY 128 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cgb s VAL 129 N -2.25 5.06 0.05 1.61 1.01 -0.94 -0.88 120.40 124.06 3cgb s VAL 129 Ca 0.00 1.14 0.04 0.00 0.00 0.00 0.00 61.98 63.16 3cgb s VAL 129 Cb 0.00 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 3cgb s VAL 129 CO 0.00 0.16 -0.11 -1.00 0.00 0.00 0.00 175.10 174.15 3cgb s HIS 130 N 1.64 0.94 0.23 5.22 0.09 0.62 -4.93 115.29 119.09 3cgb s HIS 130 Ca 0.28 -0.46 0.08 0.00 -0.00 0.00 0.00 55.06 54.97 3cgb s HIS 130 Cb -0.16 -0.55 -0.04 0.00 -0.00 0.00 0.00 32.58 31.83 3cgb s HIS 130 CO 0.11 -0.01 0.04 -0.51 -0.00 0.00 0.00 174.74 174.37 3cgb s LEU 131 N -1.57 3.37 -0.19 0.89 1.43 -1.26 -0.53 118.68 120.81 3cgb s LEU 131 Ca -0.05 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3cgb s LEU 131 Cb -0.10 -1.94 0.04 0.00 0.03 0.00 0.00 46.19 44.23 3cgb s LEU 131 CO 0.01 0.03 -0.08 -0.22 0.23 0.00 0.00 176.35 176.32 3cgb s LEU 132 N -3.44 2.10 0.00 1.79 2.96 -1.26 -4.83 118.68 115.99 3cgb s LEU 132 Ca 0.30 -0.86 0.00 0.00 -0.22 0.00 0.00 54.13 53.36 3cgb s LEU 132 Cb -0.08 -1.12 0.00 0.00 0.50 0.00 0.00 46.19 45.49 3cgb s LEU 132 CO 0.20 -0.17 0.00 1.17 -1.32 0.00 0.00 176.35 176.23 3cgb n LYS 133 N 4.75 0.00 -4.39 1.98 3.00 -1.26 -4.92 118.16 117.32 3cgb n LYS 133 Ca -0.13 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 57.92 3cgb n LYS 133 Cb 0.47 -0.32 -0.09 0.00 0.00 0.00 0.00 35.03 35.09 3cgb n LYS 133 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 3cgb s THR 134 N -1.16 2.29 0.11 3.15 -4.23 -1.26 -4.84 115.64 109.70 3cgb s THR 134 Ca 0.00 -1.92 -0.22 0.00 -1.18 0.00 0.00 61.69 58.37 3cgb s THR 134 Cb 0.00 -2.91 -0.10 0.00 1.34 0.00 0.00 72.50 70.84 3cgb s THR 134 CO 0.00 -0.08 1.72 0.40 -0.54 0.00 0.00 174.62 176.12 3cgb h ILE 135 N 1.71 0.88 -0.97 2.99 2.04 -1.98 -2.14 117.51 120.03 3cgb h ILE 135 Ca -0.43 0.00 0.21 0.00 1.00 0.00 0.00 64.86 65.64 3cgb h ILE 135 Cb 1.25 0.88 -0.09 0.00 -0.74 0.00 0.00 36.82 38.12 3cgb h ILE 135 CO 0.73 0.00 0.62 -0.65 0.00 0.00 0.00 178.15 178.84 3cgb h PRO 136 N -0.03 0.56 -0.79 2.37 0.11 -1.99 0.69 132.00 132.91 3cgb h PRO 136 Ca 0.04 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 66.18 3cgb h PRO 136 Cb 0.09 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 31.02 3cgb h PRO 136 CO -0.09 0.37 0.48 -0.44 -0.21 0.00 0.00 178.00 178.11 3cgb h ASP 137 N 0.57 0.74 -0.04 -2.05 3.32 -1.78 -0.66 116.42 116.53 3cgb h ASP 137 Ca 0.54 0.02 -0.17 0.00 0.02 0.00 0.00 57.03 57.44 3cgb h ASP 137 Cb 1.09 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.51 3cgb h ASP 137 CO -0.29 0.48 -0.57 0.00 -1.72 0.00 0.00 179.24 177.14 3cgb h ALA 138 N 1.38 0.62 -0.63 3.45 0.00 -0.31 -2.55 119.26 121.22 3cgb h ALA 138 Ca 0.35 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3cgb h ALA 138 Cb 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3cgb h ALA 138 CO -0.17 0.69 0.07 0.93 0.00 0.00 0.00 179.25 180.77 3cgb h GLU 139 N 0.48 1.06 -0.11 0.00 4.39 -0.77 -1.36 114.58 118.26 3cgb h GLU 139 Ca 0.00 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.37 3cgb h GLU 139 Cb 1.14 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.67 3cgb h GLU 139 CO 0.11 1.00 -0.08 0.00 -1.16 0.00 0.00 179.01 178.88 3cgb h ARG 140 N 0.97 0.16 -0.19 2.33 3.08 -1.04 0.15 114.38 119.84 3cgb h ARG 140 Ca 0.19 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 60.00 3cgb h ARG 140 Cb 0.48 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.51 3cgb h ARG 140 CO 0.02 0.26 -0.71 0.82 -1.07 0.00 0.00 179.97 179.29 3cgb h ILE 141 N 0.16 1.28 -0.56 2.04 2.04 -1.08 -2.40 117.51 118.99 3cgb h ILE 141 Ca 0.04 -1.90 -0.11 0.00 1.00 0.00 0.00 64.86 63.88 3cgb h ILE 141 Cb 0.26 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 3cgb h ILE 141 CO 0.01 0.61 -0.09 -0.07 0.00 0.00 0.00 178.15 178.61 3cgb h LEU 142 N 0.56 1.04 -0.64 1.44 3.38 -0.87 -1.79 115.31 118.44 3cgb h LEU 142 Ca -0.04 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.60 3cgb h LEU 142 Cb 1.34 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 3cgb h LEU 142 CO 0.15 1.14 0.42 0.50 0.09 0.00 0.00 178.44 180.74 3cgb h LYS 143 N 0.93 0.83 -0.68 1.13 1.63 -0.72 0.30 116.57 119.99 3cgb h LYS 143 Ca 0.15 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.90 3cgb h LYS 143 Cb 0.66 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.07 3cgb h LYS 143 CO 0.05 0.55 0.42 1.15 -3.45 0.00 0.00 179.45 178.17 3cgb h THR 144 N 0.86 1.19 -0.32 1.00 2.02 -1.24 -0.44 112.91 115.98 3cgb h THR 144 Ca 0.23 -0.42 -0.09 0.00 0.77 0.00 0.00 66.41 66.90 3cgb h THR 144 Cb -0.10 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.54 3cgb h THR 144 CO -0.05 0.20 -0.20 -0.07 0.37 0.00 0.00 175.52 175.77 3cgb h LEU 145 N 0.93 0.60 -0.08 2.58 3.38 -0.68 -2.28 115.31 119.76 3cgb h LEU 145 Ca 0.25 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3cgb h LEU 145 Cb -0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.55 3cgb h LEU 145 CO -0.05 0.80 -0.26 -0.08 0.09 0.00 0.00 178.44 178.94 3cgb h GLU 146 N 0.54 0.31 -0.34 1.13 4.22 -0.08 -3.34 114.58 117.01 3cgb h GLU 146 Ca 0.08 -0.23 0.00 0.00 0.08 0.00 0.00 59.36 59.29 3cgb h GLU 146 Cb 0.64 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3cgb h GLU 146 CO 0.05 0.86 0.00 0.25 -2.18 0.00 0.00 179.01 177.98 3cgb n THR 147 N -4.48 0.43 -4.28 0.32 -2.24 -0.20 -4.93 114.28 98.90 3cgb n THR 147 Ca -0.08 -0.67 -0.15 0.00 -2.27 0.00 0.00 64.05 60.88 3cgb n THR 147 Cb 0.46 0.90 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 3cgb n THR 147 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3cgb s ASN 148 N -1.52 1.67 -0.78 3.42 0.01 -0.86 -5.04 114.94 111.84 3cgb s ASN 148 Ca 0.37 -1.13 -0.19 0.00 -0.71 0.00 0.00 52.86 51.20 3cgb s ASN 148 Cb 0.22 0.03 0.12 0.00 0.41 0.00 0.00 41.25 42.03 3cgb s ASN 148 CO 0.31 -0.46 0.95 -1.59 -1.51 0.00 0.00 177.10 174.79 3cgb s LYS 149 N -3.83 3.37 -0.24 -0.60 0.00 -1.26 -4.81 119.74 112.35 3cgb s LYS 149 Ca 0.23 -1.56 -0.15 0.00 0.00 0.00 0.00 55.97 54.50 3cgb s LYS 149 Cb 0.05 -4.56 -0.04 0.00 0.00 0.00 0.00 37.83 33.28 3cgb s LYS 149 CO 0.05 -1.66 0.36 0.08 0.00 0.00 0.00 175.35 174.17 3cgb s VAL 150 N 2.64 5.20 0.00 1.79 1.01 -1.26 -4.90 120.40 124.88 3cgb s VAL 150 Ca 0.23 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.79 3cgb s VAL 150 Cb -0.13 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3cgb s VAL 150 CO -0.02 0.21 0.00 -1.84 0.00 0.00 0.00 175.10 173.45 3cgb n GLU 151 N 4.94 1.88 -4.02 2.72 0.28 -1.26 -4.94 120.64 120.24 3cgb n GLU 151 Ca -0.09 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.56 3cgb n GLU 151 Cb 0.51 -0.83 -0.12 0.00 1.43 0.00 0.00 31.44 32.43 3cgb n GLU 151 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3cgb s ASP 152 N -2.69 5.00 -0.08 -1.84 1.01 -1.26 -0.86 116.67 115.94 3cgb s ASP 152 Ca 0.00 -0.16 0.05 0.00 0.71 0.00 0.00 52.55 53.15 3cgb s ASP 152 Cb 0.00 -1.86 -0.01 0.00 1.01 0.00 0.00 42.92 42.06 3cgb s ASP 152 CO 0.00 0.07 -0.24 -0.69 0.21 0.00 0.00 175.17 174.52 3cgb s VAL 153 N 1.00 2.14 -0.11 -1.27 1.01 -0.22 -0.14 120.40 122.82 3cgb s VAL 153 Ca 0.02 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.01 3cgb s VAL 153 Cb -0.14 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 3cgb s VAL 153 CO 0.02 0.56 -0.17 -0.89 0.00 0.00 0.00 175.10 174.63 3cgb s THR 154 N 0.12 2.73 -0.19 3.92 2.01 -0.88 -0.45 115.64 122.90 3cgb s THR 154 Ca -0.12 -0.79 -0.05 0.00 0.31 0.00 0.00 61.69 61.04 3cgb s THR 154 Cb -0.16 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 3cgb s THR 154 CO 0.07 0.54 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.91 3cgb s ILE 155 N 0.21 4.00 -0.24 1.82 1.01 0.68 -0.94 121.20 127.74 3cgb s ILE 155 Ca -0.10 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.10 3cgb s ILE 155 Cb -0.16 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 3cgb s ILE 155 CO 0.06 0.44 0.34 -0.63 0.00 0.00 0.00 174.94 175.15 3cgb s ILE 156 N 0.83 5.22 0.00 2.92 -1.09 0.55 -0.70 121.20 128.92 3cgb s ILE 156 Ca 0.01 0.53 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 3cgb s ILE 156 Cb -0.14 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.07 3cgb s ILE 156 CO 0.02 0.22 0.00 0.61 -1.23 0.00 0.00 174.94 174.56 3cgb n GLY 157 N 4.39 0.86 0.00 6.18 0.00 0.28 -0.18 105.19 116.71 3cgb n GLY 157 Ca -0.10 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.15 3cgb n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cgb n GLY 158 N 0.86 1.32 7.00 -0.02 0.00 -1.26 -4.68 105.19 108.41 3cgb n GLY 158 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3cgb n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cgb n GLY 159 N 5.00 -0.95 0.31 -0.02 0.00 -1.26 -2.03 105.19 106.23 3cgb n GLY 159 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 3cgb n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cgb h ALA 160 N -0.93 -0.53 -0.55 4.61 0.00 -1.98 -1.62 119.26 118.26 3cgb h ALA 160 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3cgb h ALA 160 Cb 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3cgb h ALA 160 CO 0.00 -0.84 0.22 0.82 0.00 0.00 0.00 179.25 179.45 3cgb h ILE 161 N -0.54 1.22 -0.25 0.00 2.04 -1.97 -0.60 117.51 117.41 3cgb h ILE 161 Ca 0.01 -0.68 0.01 0.00 1.00 0.00 0.00 64.86 65.20 3cgb h ILE 161 Cb 0.53 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3cgb h ILE 161 CO -0.10 0.26 0.15 1.23 0.00 0.00 0.00 178.15 179.69 3cgb h GLY 162 N 0.75 0.35 0.96 5.37 0.00 -1.27 -3.00 103.07 106.23 3cgb h GLY 162 Ca 0.18 -0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.35 3cgb h GLY 162 CO -0.02 0.11 0.09 1.41 0.00 0.00 0.00 176.54 178.13 3cgb h LEU 163 N 0.32 0.71 -1.43 3.11 3.38 -1.09 0.10 115.31 120.41 3cgb h LEU 163 Ca 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3cgb h LEU 163 Cb -0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.55 3cgb h LEU 163 CO -0.04 0.77 0.00 -0.62 0.09 0.00 0.00 178.44 178.65 3cgb n GLU 164 N -4.48 0.13 0.00 1.13 1.02 -0.25 -2.16 120.64 116.03 3cgb n GLU 164 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3cgb n GLU 164 Cb 0.23 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3cgb n GLU 164 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cgb n ALA 166 N 0.65 0.00 -0.16 0.62 0.00 0.02 -1.25 120.51 120.39 3cgb n ALA 166 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3cgb n ALA 166 Cb 0.05 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.55 3cgb n ALA 166 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3cgb h GLU 167 N 0.00 0.07 -0.71 0.00 4.81 -1.71 -0.51 114.58 116.53 3cgb h GLU 167 Ca 0.00 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 3cgb h GLU 167 Cb 0.00 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 3cgb h GLU 167 CO 0.00 0.04 0.41 1.15 -0.73 0.00 0.00 179.01 179.88 3cgb h THR 168 N 0.07 0.99 -0.03 0.32 2.02 -1.45 -0.01 112.91 114.81 3cgb h THR 168 Ca 0.25 -0.26 -0.20 0.00 0.77 0.00 0.00 66.41 66.97 3cgb h THR 168 Cb 0.38 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3cgb h THR 168 CO -0.46 0.14 -0.84 -0.26 0.37 0.00 0.00 175.52 174.47 3cgb h PHE 169 N 0.75 0.55 -0.44 3.16 0.04 -1.77 -1.83 116.94 117.40 3cgb h PHE 169 Ca 0.31 -0.27 0.03 0.00 2.80 0.00 0.00 57.97 60.84 3cgb h PHE 169 Cb 0.17 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 3cgb h PHE 169 CO -0.07 1.07 0.23 0.28 -0.60 0.00 0.00 178.31 179.22 3cgb h VAL 170 N 0.24 0.98 0.00 -0.55 2.07 -0.70 0.16 116.25 118.45 3cgb h VAL 170 Ca -0.05 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 3cgb h VAL 170 Cb 1.45 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3cgb h VAL 170 CO 0.14 0.08 -0.15 -0.33 0.02 0.00 0.00 177.57 177.34 3cgb h GLU 171 N 0.46 0.00 -0.10 1.57 5.08 -0.84 0.88 114.58 121.63 3cgb h GLU 171 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3cgb h GLU 171 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3cgb h GLU 171 CO -0.12 0.15 0.00 1.28 -1.00 0.00 0.00 179.01 179.32 3cgb n LEU 172 N -3.56 0.83 0.00 1.33 4.77 -0.70 -4.91 117.00 114.76 3cgb n LEU 172 Ca -0.01 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 3cgb n LEU 172 Cb 0.29 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3cgb n LEU 172 CO 0.31 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3cgb n GLY 173 N 0.92 0.39 3.93 -0.72 0.00 0.30 -5.04 105.19 104.97 3cgb n GLY 173 Ca 0.13 -1.07 -0.25 0.00 0.00 0.00 0.00 46.02 44.82 3cgb n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cgb s LYS 174 N -2.08 3.27 -0.32 1.61 -0.14 -0.01 -5.00 119.74 117.07 3cgb s LYS 174 Ca 0.00 -0.14 -0.17 0.00 -1.36 0.00 0.00 55.97 54.30 3cgb s LYS 174 Cb 0.00 -2.46 -0.01 0.00 -1.68 0.00 0.00 37.83 33.68 3cgb s LYS 174 CO 0.00 -0.26 0.49 0.21 -0.76 0.00 0.00 175.35 175.03 3cgb s LYS 175 N -4.66 3.76 -0.16 1.68 2.20 -0.04 -4.41 119.74 118.11 3cgb s LYS 175 Ca 0.48 -0.05 -0.04 0.00 -0.36 0.00 0.00 55.97 56.00 3cgb s LYS 175 Cb -0.10 -3.76 -0.03 0.00 -1.51 0.00 0.00 37.83 32.44 3cgb s LYS 175 CO 0.41 -0.53 -0.03 0.08 -0.36 0.00 0.00 175.35 174.93 3cgb s VAL 176 N 2.31 3.98 0.00 4.02 1.01 -1.26 -1.05 120.40 129.40 3cgb s VAL 176 Ca 0.18 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.83 3cgb s VAL 176 Cb -0.16 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.48 3cgb s VAL 176 CO 0.12 0.49 0.00 -1.14 0.00 0.00 0.00 175.10 174.57 3cgb n ARG 177 N 3.51 2.17 -3.20 2.72 0.63 0.40 -1.75 116.66 121.15 3cgb n ARG 177 Ca -0.17 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.80 3cgb n ARG 177 Cb 0.52 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.42 3cgb n ARG 177 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3cgb s ILE 179 N -0.31 -0.71 0.15 5.15 1.01 0.12 -0.23 121.20 126.38 3cgb s ILE 179 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.59 3cgb s ILE 179 Cb 0.00 -1.00 -0.06 0.00 0.01 0.00 0.00 42.46 41.41 3cgb s ILE 179 CO 0.00 0.00 0.41 -1.83 0.00 0.00 0.00 174.94 173.52 3cgb s GLU 180 N 2.87 3.67 -0.14 2.79 -1.05 -0.36 -0.56 118.70 125.92 3cgb s GLU 180 Ca 0.09 0.01 -0.16 0.00 -0.15 0.00 0.00 54.97 54.76 3cgb s GLU 180 Cb -0.12 -2.84 -0.04 0.00 -0.44 0.00 0.00 34.13 30.69 3cgb s GLU 180 CO -0.17 0.46 0.39 1.03 0.95 0.00 0.00 175.26 177.91 3cgb s ARG 181 N -2.57 4.30 0.48 -4.83 0.52 -1.26 -4.34 118.95 111.24 3cgb s ARG 181 Ca 0.41 0.27 0.28 0.00 -0.52 0.00 0.00 55.73 56.17 3cgb s ARG 181 Cb -0.12 -3.43 0.79 0.00 0.52 0.00 0.00 34.95 32.70 3cgb s ARG 181 CO 0.23 0.19 1.77 -0.91 0.02 0.00 0.00 175.30 176.60 3cgb h ASN 182 N 6.71 0.00 0.55 0.23 2.35 -1.98 -1.78 115.58 121.67 3cgb h ASN 182 Ca -0.41 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.33 3cgb h ASN 182 Cb 1.17 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.54 3cgb h ASN 182 CO 0.76 0.00 -0.04 -2.24 -1.65 0.00 0.00 177.43 174.26 3cgb h ASP 183 N 0.00 0.00 -0.35 5.81 3.04 -2.04 -2.85 116.42 120.03 3cgb h ASP 183 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3cgb h ASP 183 Cb 0.78 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.07 3cgb h ASP 183 CO 0.00 0.04 0.00 1.41 -2.04 0.00 0.00 179.24 178.65 3cgb n HIS 184 N -3.23 0.45 -2.43 4.15 8.25 -0.67 -4.85 115.22 116.89 3cgb n HIS 184 Ca -0.01 -0.23 -0.42 0.00 -0.26 0.00 0.00 57.72 56.80 3cgb n HIS 184 Cb 0.22 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.31 3cgb n HIS 184 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3cgb s ILE 185 N -1.55 4.19 0.00 1.59 1.01 -1.08 -3.09 121.20 122.28 3cgb s ILE 185 Ca 0.37 1.52 0.00 0.00 0.00 0.00 0.00 60.65 62.54 3cgb s ILE 185 Cb 0.21 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.70 3cgb s ILE 185 CO 0.30 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.85 3cgb n GLY 186 N 3.40 1.61 0.17 6.18 0.00 -1.25 -4.92 105.19 110.37 3cgb n GLY 186 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.09 3cgb n GLY 186 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3cgb h THR 187 N 0.00 1.39 0.00 2.61 1.35 -1.87 -3.39 112.91 113.00 3cgb h THR 187 Ca 0.00 -1.96 -0.15 0.00 -0.55 0.00 0.00 66.41 63.75 3cgb h THR 187 Cb 0.00 1.99 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 3cgb h THR 187 CO 0.00 0.58 -1.33 -0.38 -0.25 0.00 0.00 175.52 174.14 3cgb n ILE 188 N -3.88 1.12 -4.93 6.82 5.41 -1.26 -4.99 119.36 117.66 3cgb n ILE 188 Ca -0.02 -0.02 -0.31 0.00 1.00 0.00 0.00 62.75 63.40 3cgb n ILE 188 Cb 0.61 -1.86 -0.14 0.00 -0.71 0.00 0.00 39.64 37.53 3cgb n ILE 188 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3cgb s TYR 189 N -2.41 2.50 0.96 1.39 1.51 -1.26 -4.89 117.35 115.15 3cgb s TYR 189 Ca -0.20 -0.30 -0.11 0.00 -1.01 0.00 0.00 57.07 55.44 3cgb s TYR 189 Cb 0.06 -1.50 0.17 0.00 -0.11 0.00 0.00 41.96 40.57 3cgb s TYR 189 CO 0.27 0.14 1.11 -0.51 -1.11 0.00 0.00 175.55 175.45 3cgb s ASP 190 N -1.01 2.64 0.27 2.29 1.01 -1.26 -3.83 116.67 116.78 3cgb s ASP 190 Ca 0.12 1.93 0.01 0.00 0.71 0.00 0.00 52.55 55.32 3cgb s ASP 190 Cb -0.10 -2.47 0.36 0.00 1.01 0.00 0.00 42.92 41.72 3cgb s ASP 190 CO 0.02 -3.23 1.70 1.23 0.21 0.00 0.00 175.17 175.10 3cgb h GLY 191 N -1.96 0.60 -1.40 0.21 0.00 -1.99 -0.16 103.07 98.37 3cgb h GLY 191 Ca -0.48 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.36 3cgb h GLY 191 CO 0.46 0.45 0.00 2.09 0.00 0.00 0.00 176.54 179.54 3cgb n ASP 192 N -4.12 0.95 0.00 0.19 3.85 -1.26 -2.72 116.55 113.44 3cgb n ASP 192 Ca -0.00 -1.05 0.00 0.00 -0.71 0.00 0.00 54.79 53.03 3cgb n ASP 192 Cb 0.41 -0.26 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 3cgb n ASP 192 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3cgb n ALA 194 N 0.44 0.00 -0.33 2.12 0.00 -0.07 -4.48 120.51 118.18 3cgb n ALA 194 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 3cgb n ALA 194 Cb 0.18 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.02 3cgb n ALA 194 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3cgb h GLU 195 N 0.00 0.62 0.00 0.00 5.08 -1.78 0.87 114.58 119.37 3cgb h GLU 195 Ca 0.00 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 3cgb h GLU 195 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3cgb h GLU 195 CO 0.00 0.41 -0.35 1.88 -1.00 0.00 0.00 179.01 179.96 3cgb h TYR 196 N 0.64 0.00 -0.01 4.33 -1.99 -1.90 -1.62 116.97 116.43 3cgb h TYR 196 Ca 0.57 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.29 3cgb h TYR 196 Cb 1.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.79 3cgb h TYR 196 CO -0.00 0.35 -0.04 0.82 -0.00 0.00 0.00 178.16 179.28 3cgb h ILE 197 N 0.00 1.54 -0.61 -2.88 2.04 -1.29 -1.86 117.51 114.44 3cgb h ILE 197 Ca -0.00 -1.64 0.09 0.00 1.00 0.00 0.00 64.86 64.30 3cgb h ILE 197 Cb 0.66 2.63 -0.07 0.00 -0.74 0.00 0.00 36.82 39.30 3cgb h ILE 197 CO 0.05 0.43 0.25 1.88 0.00 0.00 0.00 178.15 180.76 3cgb h TYR 198 N -0.63 0.44 -0.40 1.37 0.99 -1.12 -0.60 116.97 117.03 3cgb h TYR 198 Ca -0.00 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.78 3cgb h TYR 198 Cb 0.73 -0.11 -0.03 0.00 1.00 0.00 0.00 36.73 38.32 3cgb h TYR 198 CO 0.16 0.14 0.21 0.87 -0.00 0.00 0.00 178.16 179.54 3cgb h LYS 199 N 0.45 0.41 -0.44 4.88 1.57 -1.31 -1.11 116.57 121.02 3cgb h LYS 199 Ca 0.30 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.97 3cgb h LYS 199 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3cgb h LYS 199 CO -0.28 0.27 -0.09 1.49 -0.57 0.00 0.00 179.45 180.27 3cgb h GLU 200 N 0.42 0.78 0.58 3.15 4.57 -0.87 -1.08 114.58 122.13 3cgb h GLU 200 Ca 0.17 -0.25 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 3cgb h GLU 200 Cb 0.06 -0.07 0.01 0.00 -0.16 0.00 0.00 28.75 28.59 3cgb h GLU 200 CO -0.11 0.85 -0.28 0.00 -1.18 0.00 0.00 179.01 178.29 3cgb h ALA 201 N 1.19 -0.78 -0.80 2.92 0.00 -0.92 -2.83 119.26 118.04 3cgb h ALA 201 Ca 0.12 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.00 3cgb h ALA 201 Cb 0.57 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 18.55 3cgb h ALA 201 CO 0.03 -0.87 0.33 0.22 0.00 0.00 0.00 179.25 178.96 3cgb h ASP 202 N -0.90 0.30 -0.38 0.00 -0.00 -1.15 0.48 116.42 114.77 3cgb h ASP 202 Ca -0.08 0.12 0.05 0.00 -0.00 0.00 0.00 57.03 57.12 3cgb h ASP 202 Cb 0.64 0.10 -0.02 0.00 -0.00 0.00 0.00 39.33 40.04 3cgb h ASP 202 CO 0.13 0.09 0.26 0.50 -0.00 0.00 0.00 179.24 180.22 3cgb h LYS 203 N 0.44 0.30 -0.59 0.28 3.64 -1.09 -1.94 116.57 117.62 3cgb h LYS 203 Ca 0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 3cgb h LYS 203 Cb 0.73 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 3cgb h LYS 203 CO -0.43 0.20 0.00 0.72 -2.27 0.00 0.00 179.45 177.66 3cgb n HIS 204 N -4.48 1.12 -2.61 1.91 8.25 0.09 -4.94 115.22 114.55 3cgb n HIS 204 Ca 0.04 -0.58 -0.11 0.00 -0.26 0.00 0.00 57.72 56.82 3cgb n HIS 204 Cb 0.23 -0.14 0.02 0.00 1.12 0.00 0.00 29.99 31.21 3cgb n HIS 204 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3cgb n HIS 205 N 1.04 -0.92 -3.41 4.41 8.25 -0.73 -5.00 115.22 118.85 3cgb n HIS 205 Ca 0.23 0.25 -0.41 0.00 -0.26 0.00 0.00 57.72 57.52 3cgb n HIS 205 Cb 0.73 -2.65 -0.09 0.00 1.12 0.00 0.00 29.99 29.10 3cgb n HIS 205 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3cgb s ILE 206 N -2.83 5.18 -0.20 1.59 1.01 -0.77 -4.47 121.20 120.71 3cgb s ILE 206 Ca 0.14 -0.10 -0.28 0.00 0.00 0.00 0.00 60.65 60.41 3cgb s ILE 206 Cb -0.06 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.56 3cgb s ILE 206 CO 0.18 -0.15 0.99 -0.70 0.00 0.00 0.00 174.94 175.26 3cgb s GLU 207 N 1.97 4.29 -0.22 2.79 2.12 -0.72 -3.94 118.70 124.99 3cgb s GLU 207 Ca 0.10 1.29 -0.05 0.00 0.36 0.00 0.00 54.97 56.67 3cgb s GLU 207 Cb -0.17 -3.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.58 3cgb s GLU 207 CO 0.12 -0.53 0.01 0.42 -0.54 0.00 0.00 175.26 174.73 3cgb s ILE 208 N 2.84 3.89 -0.24 -3.70 1.01 -1.26 -4.33 121.20 119.41 3cgb s ILE 208 Ca 0.43 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.68 3cgb s ILE 208 Cb -0.16 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 3cgb s ILE 208 CO 0.09 0.40 0.10 -0.76 0.00 0.00 0.00 174.94 174.78 3cgb s LEU 209 N 1.32 3.70 0.18 2.97 1.43 -1.26 -5.01 118.68 122.01 3cgb s LEU 209 Ca 0.04 -0.08 0.05 0.00 -1.03 0.00 0.00 54.13 53.11 3cgb s LEU 209 Cb -0.15 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 3cgb s LEU 209 CO 0.01 0.01 0.18 -0.89 0.23 0.00 0.00 176.35 175.88 3cgb s THR 210 N 1.37 4.63 -1.40 5.49 2.01 -1.26 -1.22 115.64 125.25 3cgb s THR 210 Ca 0.06 -1.08 -0.05 0.00 0.31 0.00 0.00 61.69 60.93 3cgb s THR 210 Cb -0.15 -3.39 0.00 0.00 0.01 0.00 0.00 72.50 68.97 3cgb s THR 210 CO 0.05 -0.16 0.37 -3.20 -0.69 0.00 0.00 174.62 170.99 3cgb n ASN 211 N -0.56 -0.76 -3.77 3.53 5.15 -1.26 -4.96 115.26 112.63 3cgb n ASN 211 Ca -0.08 -1.10 -0.13 0.00 -0.60 0.00 0.00 54.58 52.67 3cgb n ASN 211 Cb 0.55 -2.63 -0.14 0.00 -0.53 0.00 0.00 39.78 37.03 3cgb n ASN 211 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3cgb s GLU 212 N -6.77 0.09 -0.19 1.20 2.12 -1.26 -5.05 118.70 108.84 3cgb s GLU 212 Ca 0.08 0.30 -0.05 0.00 0.36 0.00 0.00 54.97 55.66 3cgb s GLU 212 Cb -0.04 -0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.21 3cgb s GLU 212 CO 0.92 -0.13 0.00 -0.80 -0.54 0.00 0.00 175.26 174.71 3cgb s ASN 213 N 0.86 4.88 0.52 -1.70 0.01 -1.26 -4.80 114.94 113.46 3cgb s ASN 213 Ca -0.07 -0.17 -0.22 0.00 -0.71 0.00 0.00 52.86 51.69 3cgb s ASN 213 Cb -0.09 -1.83 -0.06 0.00 0.41 0.00 0.00 41.25 39.69 3cgb s ASN 213 CO -0.04 0.08 1.25 -0.69 -1.51 0.00 0.00 177.10 176.20 3cgb s VAL 214 N 0.88 2.58 0.00 1.60 1.01 -1.26 -0.33 120.40 124.89 3cgb s VAL 214 Ca 0.01 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.41 3cgb s VAL 214 Cb -0.14 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3cgb s VAL 214 CO 0.02 -0.02 0.00 2.29 0.00 0.00 0.00 175.10 177.39 3cgb n LYS 215 N -0.92 3.21 -3.53 2.72 2.85 0.42 -4.81 118.16 118.11 3cgb n LYS 215 Ca 0.10 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.22 3cgb n LYS 215 Cb 0.47 -0.65 -0.05 0.00 -0.65 0.00 0.00 35.03 34.15 3cgb n LYS 215 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3cgb s ALA 216 N -0.83 -1.82 -0.16 0.58 0.00 -1.11 -4.14 121.76 114.27 3cgb s ALA 216 Ca 0.00 1.30 -0.07 0.00 0.00 0.00 0.00 51.96 53.19 3cgb s ALA 216 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 3cgb s ALA 216 CO 0.00 -0.43 0.06 -0.06 0.00 0.00 0.00 175.76 175.33 3cgb s PHE 217 N -1.67 3.27 0.01 0.00 0.08 0.84 -0.97 117.98 119.53 3cgb s PHE 217 Ca -0.04 0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.15 3cgb s PHE 217 Cb -0.00 -2.03 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 3cgb s PHE 217 CO 0.02 0.24 -0.04 0.15 -0.10 0.00 0.00 175.22 175.49 3cgb s LYS 218 N 0.09 2.62 0.00 0.44 -0.14 0.43 -3.89 119.74 119.29 3cgb s LYS 218 Ca 0.05 -0.70 0.00 0.00 -1.36 0.00 0.00 55.97 53.96 3cgb s LYS 218 Cb -0.12 -2.56 0.00 0.00 -1.68 0.00 0.00 37.83 33.47 3cgb s LYS 218 CO 0.01 0.60 0.00 0.41 -0.76 0.00 0.00 175.35 175.61 3cgb n GLY 219 N 1.41 2.39 0.00 -3.33 0.00 -1.26 -0.30 105.19 104.11 3cgb n GLY 219 Ca -0.15 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.78 3cgb n GLY 219 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3cgb n ASN 220 N 0.00 0.00 -0.09 1.61 0.23 -1.26 -4.82 115.26 110.93 3cgb n ASN 220 Ca 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 53.97 3cgb n ASN 220 Cb 0.00 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.54 3cgb n ASN 220 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 3cgb n GLU 221 N -0.56 0.68 -4.47 -3.83 2.13 -1.26 -4.99 120.64 108.34 3cgb n GLU 221 Ca 0.00 -0.01 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 3cgb n GLU 221 Cb 0.00 -1.54 -0.10 0.00 0.27 0.00 0.00 31.44 30.07 3cgb n GLU 221 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3cgb s ARG 222 N -2.59 1.91 0.50 5.31 0.52 -1.26 -2.40 118.95 120.94 3cgb s ARG 222 Ca -0.09 -1.87 -0.22 0.00 -0.52 0.00 0.00 55.73 53.02 3cgb s ARG 222 Cb 0.07 -1.78 -0.06 0.00 0.52 0.00 0.00 34.95 33.69 3cgb s ARG 222 CO 0.84 0.13 1.18 0.14 0.02 0.00 0.00 175.30 177.61 3cgb s VAL 223 N -2.58 2.98 0.00 3.52 -7.23 -0.58 -4.13 120.40 112.38 3cgb s VAL 223 Ca 0.33 0.69 0.00 0.00 -1.81 0.00 0.00 61.98 61.19 3cgb s VAL 223 Cb 0.02 -3.33 0.00 0.00 0.56 0.00 0.00 36.38 33.63 3cgb s VAL 223 CO 0.18 -0.05 0.00 -1.84 -0.31 0.00 0.00 175.10 173.07 3cgb n GLU 224 N -0.84 1.05 -3.56 4.82 0.28 0.59 -4.62 120.64 118.36 3cgb n GLU 224 Ca 0.09 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.97 3cgb n GLU 224 Cb 0.49 -0.09 -0.04 0.00 1.43 0.00 0.00 31.44 33.22 3cgb n GLU 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3cgb s ALA 225 N 0.00 -1.28 -0.12 -1.84 0.00 -1.02 -1.03 121.76 116.48 3cgb s ALA 225 Ca 0.00 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.40 3cgb s ALA 225 Cb 0.00 0.56 -0.00 0.00 0.00 0.00 0.00 23.12 23.67 3cgb s ALA 225 CO 0.00 -0.59 -0.20 0.08 0.00 0.00 0.00 175.76 175.05 3cgb s VAL 226 N -3.04 2.42 -0.15 0.00 1.01 0.01 -0.43 120.40 120.22 3cgb s VAL 226 Ca -0.02 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 3cgb s VAL 226 Cb -0.00 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 3cgb s VAL 226 CO -0.06 0.54 0.09 -0.70 0.00 0.00 0.00 175.10 174.96 3cgb s GLU 227 N 0.44 3.72 0.44 2.72 2.12 -0.15 -0.97 118.70 127.02 3cgb s GLU 227 Ca -0.14 -0.27 0.03 0.00 0.36 0.00 0.00 54.97 54.95 3cgb s GLU 227 Cb -0.17 -3.18 -0.03 0.00 0.26 0.00 0.00 34.13 31.02 3cgb s GLU 227 CO 0.06 0.49 0.07 0.95 -0.54 0.00 0.00 175.26 176.29 3cgb s THR 228 N -0.21 0.91 -2.00 -1.70 -4.23 0.49 -0.43 115.64 108.46 3cgb s THR 228 Ca 0.09 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.71 3cgb s THR 228 Cb -0.12 -2.34 0.31 0.00 1.34 0.00 0.00 72.50 71.69 3cgb s THR 228 CO 0.01 0.00 1.07 -0.90 -0.54 0.00 0.00 174.62 174.26 3cgb n ASP 229 N -1.24 0.00 0.00 3.99 5.75 0.56 -3.29 116.55 122.32 3cgb n ASP 229 Ca -0.10 -0.48 0.00 0.00 -0.01 0.00 0.00 54.79 54.19 3cgb n ASP 229 Cb 0.66 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.75 3cgb n ASP 229 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3cgb n LYS 230 N -0.91 0.12 0.00 0.11 5.02 -1.26 -4.99 118.16 116.25 3cgb n LYS 230 Ca 0.08 -0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 3cgb n LYS 230 Cb 0.04 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 3cgb n LYS 230 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cgb n GLY 231 N -0.04 -0.78 2.85 0.72 0.00 -1.21 -5.13 105.19 101.61 3cgb n GLY 231 Ca 0.00 -1.19 -0.21 0.00 0.00 0.00 0.00 46.02 44.62 3cgb n GLY 231 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cgb s THR 232 N -2.00 0.48 -0.04 2.61 2.01 -1.26 -0.38 115.64 117.07 3cgb s THR 232 Ca 0.00 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.00 3cgb s THR 232 Cb 0.00 -0.55 -0.00 0.00 0.01 0.00 0.00 72.50 71.95 3cgb s THR 232 CO 0.00 0.23 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.68 3cgb s TYR 233 N 1.24 1.70 0.27 4.92 1.51 -0.14 -4.94 117.35 121.92 3cgb s TYR 233 Ca -0.06 -0.46 -0.31 0.00 -1.01 0.00 0.00 57.07 55.23 3cgb s TYR 233 Cb -0.14 -1.14 -0.12 0.00 -0.11 0.00 0.00 41.96 40.45 3cgb s TYR 233 CO -0.02 -0.14 1.58 1.17 -1.11 0.00 0.00 175.55 177.03 3cgb n LYS 234 N 3.06 2.60 -3.71 -0.62 4.81 -1.26 -0.81 118.16 122.23 3cgb n LYS 234 Ca -0.18 0.93 -0.11 0.00 -0.87 0.00 0.00 58.31 58.08 3cgb n LYS 234 Cb 0.53 -2.70 -0.11 0.00 0.02 0.00 0.00 35.03 32.78 3cgb n LYS 234 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3cgb s ALA 235 N 0.13 -1.04 -1.69 3.14 0.00 -0.19 -4.76 121.76 117.34 3cgb s ALA 235 Ca 0.66 1.42 0.17 0.00 0.00 0.00 0.00 51.96 54.21 3cgb s ALA 235 Cb -0.52 -0.85 0.02 0.00 0.00 0.00 0.00 23.12 21.76 3cgb s ALA 235 CO 0.47 -0.24 0.93 -0.25 0.00 0.00 0.00 175.76 176.66 3cgb n ASP 236 N 3.83 1.83 -3.63 0.00 8.00 0.81 -3.11 116.55 124.27 3cgb n ASP 236 Ca -0.20 -1.42 -0.05 0.00 0.71 0.00 0.00 54.79 53.83 3cgb n ASP 236 Cb 0.56 0.39 -0.06 0.00 -0.02 0.00 0.00 41.12 41.99 3cgb n ASP 236 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3cgb s LEU 237 N -2.02 -0.88 -0.12 0.64 0.20 -1.22 -4.84 118.68 110.44 3cgb s LEU 237 Ca 0.15 1.36 0.03 0.00 0.69 0.00 0.00 54.13 56.36 3cgb s LEU 237 Cb 0.14 2.22 0.01 0.00 -0.43 0.00 0.00 46.19 48.13 3cgb s LEU 237 CO 0.40 -0.21 -0.21 -0.69 -0.29 0.00 0.00 176.35 175.35 3cgb s VAL 238 N 1.82 1.95 -0.24 1.68 1.01 -0.06 -2.06 120.40 124.50 3cgb s VAL 238 Ca -0.09 -0.93 -0.08 0.00 0.00 0.00 0.00 61.98 60.88 3cgb s VAL 238 Cb -0.06 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 3cgb s VAL 238 CO -0.19 0.53 0.09 -0.22 0.00 0.00 0.00 175.10 175.32 3cgb s LEU 239 N 0.73 3.64 -0.28 3.92 2.96 -0.11 -0.28 118.68 129.26 3cgb s LEU 239 Ca -0.10 -0.10 -0.12 0.00 -0.22 0.00 0.00 54.13 53.59 3cgb s LEU 239 Cb -0.16 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 3cgb s LEU 239 CO 0.01 0.01 0.25 -0.69 -1.32 0.00 0.00 176.35 174.61 3cgb s VAL 240 N 1.36 5.26 -0.40 1.68 1.01 0.30 -0.33 120.40 129.28 3cgb s VAL 240 Ca 0.06 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.36 3cgb s VAL 240 Cb -0.15 -3.60 0.23 0.00 0.00 0.00 0.00 36.38 32.86 3cgb s VAL 240 CO 0.05 0.19 0.49 -0.24 0.00 0.00 0.00 175.10 175.58 3cgb n SER 241 N 5.16 0.13 -0.25 3.32 2.88 0.75 -4.53 113.62 121.08 3cgb n SER 241 Ca -0.12 -2.64 0.03 0.00 -1.33 0.00 0.00 58.87 54.81 3cgb n SER 241 Cb 0.51 -0.62 0.03 0.00 -0.75 0.00 0.00 64.21 63.38 3cgb n SER 241 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3cgb n VAL 242 N 1.70 0.02 0.00 2.46 0.24 -1.25 -4.01 118.33 117.49 3cgb n VAL 242 Ca 0.23 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 3cgb n VAL 242 Cb 0.52 1.11 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 3cgb n VAL 242 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3cgb n GLY 243 N 0.34 2.79 3.26 7.63 0.00 -1.26 -4.98 105.19 112.96 3cgb n GLY 243 Ca 0.04 -1.24 -0.16 0.00 0.00 0.00 0.00 46.02 44.65 3cgb n GLY 243 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cgb s VAL 244 N -2.00 1.31 -0.05 1.61 -7.23 -1.26 -0.37 120.40 112.41 3cgb s VAL 244 Ca 0.00 -1.95 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 3cgb s VAL 244 Cb 0.00 -1.75 0.02 0.00 0.56 0.00 0.00 36.38 35.21 3cgb s VAL 244 CO 0.00 -0.60 -0.05 -0.75 -0.31 0.00 0.00 175.10 173.39 3cgb s LYS 245 N -3.32 0.90 0.28 4.82 2.20 0.47 -4.86 119.74 120.25 3cgb s LYS 245 Ca 0.14 -0.13 -0.30 0.00 -0.36 0.00 0.00 55.97 55.33 3cgb s LYS 245 Cb -0.01 -0.89 -0.13 0.00 -1.51 0.00 0.00 37.83 35.29 3cgb s LYS 245 CO 0.02 -0.07 1.38 -2.30 -0.36 0.00 0.00 175.35 174.02 3cgb n PRO 246 N 4.04 2.14 -1.63 4.03 -0.02 -1.26 -0.47 135.00 141.83 3cgb n PRO 246 Ca -0.24 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.58 3cgb n PRO 246 Cb 0.51 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.58 3cgb n PRO 246 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3cgb n ASN 247 N 1.63 4.58 0.00 2.55 3.02 -0.22 -4.38 115.26 122.44 3cgb n ASN 247 Ca 0.09 -2.79 0.00 0.00 -0.03 0.00 0.00 54.58 51.85 3cgb n ASN 247 Cb 0.34 -1.61 0.00 0.00 -0.61 0.00 0.00 39.78 37.89 3cgb n ASN 247 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3cgb n THR 248 N 4.90 0.53 0.21 3.41 -2.24 -1.26 -4.78 114.28 115.05 3cgb n THR 248 Ca 0.56 -0.62 0.06 0.00 -2.27 0.00 0.00 64.05 61.78 3cgb n THR 248 Cb 0.36 0.81 0.48 0.00 -2.10 0.00 0.00 70.33 69.88 3cgb n THR 248 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3cgb h ASP 249 N 0.00 0.00 0.06 3.42 3.32 -1.92 -2.18 116.42 119.13 3cgb h ASP 249 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3cgb h ASP 249 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 3cgb h ASP 249 CO 0.00 0.27 0.00 2.19 -1.72 0.00 0.00 179.24 179.98 3cgb h PHE 250 N 0.00 0.00 -0.01 4.55 -5.15 -1.86 -2.48 116.94 111.99 3cgb h PHE 250 Ca -0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3cgb h PHE 250 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.72 3cgb h PHE 250 CO 0.00 0.00 -0.07 1.28 -2.00 0.00 0.00 178.31 177.52 3cgb n LEU 251 N -2.77 0.68 -4.65 2.10 4.77 -0.82 -4.46 117.00 111.85 3cgb n LEU 251 Ca -0.02 -0.14 -0.47 0.00 -0.03 0.00 0.00 56.01 55.35 3cgb n LEU 251 Cb 0.07 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 3cgb n LEU 251 CO 0.17 0.12 1.10 1.21 -1.33 0.00 0.00 177.39 178.65 3cgb n GLU 252 N -0.66 1.89 -0.29 3.23 4.07 -0.94 -1.22 120.64 126.73 3cgb n GLU 252 Ca 0.17 0.68 0.00 0.00 -0.06 0.00 0.00 57.16 57.95 3cgb n GLU 252 Cb 0.27 -2.40 0.00 0.00 -0.06 0.00 0.00 31.44 29.24 3cgb n GLU 252 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3cgb n GLY 253 N 3.06 0.70 0.04 8.31 0.00 -1.26 -4.96 105.19 111.07 3cgb n GLY 253 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 3cgb n GLY 253 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3cgb n THR 254 N -2.00 0.18 -0.94 2.61 -2.24 -0.36 -4.97 114.28 106.57 3cgb n THR 254 Ca 0.00 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3cgb n THR 254 Cb 0.00 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3cgb n THR 254 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3cgb n ASN 255 N -2.00 -0.16 -4.66 3.42 5.15 -1.26 -4.92 115.26 110.83 3cgb n ASN 255 Ca 0.02 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.57 3cgb n ASN 255 Cb 0.45 -0.35 -0.03 0.00 -0.53 0.00 0.00 39.78 39.32 3cgb n ASN 255 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3cgb s ILE 256 N -3.53 3.63 0.39 -1.44 1.01 -1.26 -4.86 121.20 115.13 3cgb s ILE 256 Ca 0.00 0.77 -0.25 0.00 0.00 0.00 0.00 60.65 61.17 3cgb s ILE 256 Cb 0.00 -3.50 -0.09 0.00 0.01 0.00 0.00 42.46 38.88 3cgb s ILE 256 CO 0.00 -0.07 1.10 -0.13 0.00 0.00 0.00 174.94 175.85 3cgb s ARG 257 N 3.94 4.16 0.03 2.79 0.52 -1.26 -4.98 118.95 124.14 3cgb s ARG 257 Ca 0.72 1.67 0.02 0.00 -0.52 0.00 0.00 55.73 57.62 3cgb s ARG 257 Cb -0.32 -2.66 -0.02 0.00 0.52 0.00 0.00 34.95 32.47 3cgb s ARG 257 CO 0.28 -0.18 -0.06 0.99 0.02 0.00 0.00 175.30 176.35 3cgb s THR 258 N -1.50 0.44 0.89 0.02 2.01 -1.26 -1.44 115.64 114.79 3cgb s THR 258 Ca 0.56 -0.85 -0.15 0.00 0.31 0.00 0.00 61.69 61.56 3cgb s THR 258 Cb -0.27 -0.49 0.21 0.00 0.01 0.00 0.00 72.50 71.96 3cgb s THR 258 CO 0.33 -0.29 1.08 -0.46 -0.69 0.00 0.00 174.62 174.60 3cgb n ASN 259 N 1.83 -0.43 -0.13 3.53 6.94 0.54 -4.86 115.26 122.68 3cgb n ASN 259 Ca -0.21 -1.32 0.13 0.00 -0.02 0.00 0.00 54.58 53.16 3cgb n ASN 259 Cb 0.56 -0.86 0.48 0.00 -2.36 0.00 0.00 39.78 37.60 3cgb n ASN 259 CO 0.00 0.00 0.00 -0.74 -1.03 0.00 0.00 177.26 175.49 3cgb h HIS 260 N -1.88 0.50 -0.01 -2.53 -0.00 -2.02 -1.53 115.15 107.68 3cgb h HIS 260 Ca -0.36 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.02 3cgb h HIS 260 Cb 1.02 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 28.27 3cgb h HIS 260 CO 0.00 0.22 -0.05 0.36 -0.00 0.00 0.00 177.93 178.46 3cgb n LYS 261 N -4.48 1.47 0.00 5.26 2.85 -1.26 -4.92 118.16 117.08 3cgb n LYS 261 Ca 0.12 -0.82 0.00 0.00 -1.05 0.00 0.00 58.31 56.56 3cgb n LYS 261 Cb 0.43 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.33 3cgb n LYS 261 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3cgb n GLY 262 N 1.20 0.81 3.73 2.58 0.00 -0.57 -4.30 105.19 108.64 3cgb n GLY 262 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3cgb n GLY 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cgb s ALA 263 N -2.00 3.30 0.00 4.61 0.00 -1.26 -4.68 121.76 121.73 3cgb s ALA 263 Ca 0.00 0.67 -0.30 0.00 0.00 0.00 0.00 51.96 52.33 3cgb s ALA 263 Cb 0.00 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 3cgb s ALA 263 CO 0.00 -0.08 1.34 0.42 0.00 0.00 0.00 175.76 177.43 3cgb s ILE 264 N -0.14 3.83 0.19 0.00 1.01 0.68 -0.34 121.20 126.44 3cgb s ILE 264 Ca 0.48 1.22 -0.30 0.00 0.00 0.00 0.00 60.65 62.05 3cgb s ILE 264 Cb -0.26 -3.79 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 3cgb s ILE 264 CO 0.32 0.02 1.17 -1.61 0.00 0.00 0.00 174.94 174.83 3cgb s GLU 265 N 2.11 4.53 0.01 2.79 0.41 -0.52 -1.04 118.70 126.98 3cgb s GLU 265 Ca 0.62 1.83 0.05 0.00 -0.41 0.00 0.00 54.97 57.06 3cgb s GLU 265 Cb -0.30 -3.24 -0.02 0.00 -1.78 0.00 0.00 34.13 28.79 3cgb s GLU 265 CO 0.26 -0.02 -0.16 0.14 -0.49 0.00 0.00 175.26 174.99 3cgb s VAL 266 N -0.21 1.28 0.00 2.63 -7.23 -1.26 -4.31 120.40 111.30 3cgb s VAL 266 Ca 0.51 -0.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.87 3cgb s VAL 266 Cb -0.32 -1.09 0.00 0.00 0.56 0.00 0.00 36.38 35.53 3cgb s VAL 266 CO 0.37 0.26 0.00 -0.46 -0.31 0.00 0.00 175.10 174.96 3cgb n ASN 267 N 2.42 0.00 0.30 4.85 0.23 -0.69 -4.89 115.26 117.48 3cgb n ASN 267 Ca -0.16 -0.74 0.17 0.00 -0.53 0.00 0.00 54.58 53.33 3cgb n ASN 267 Cb 0.54 0.00 0.98 0.00 -2.08 0.00 0.00 39.78 39.23 3cgb n ASN 267 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3cgb h ALA 268 N -1.73 1.43 0.00 -2.53 0.00 -1.97 -3.37 119.26 111.08 3cgb h ALA 268 Ca 0.00 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 3cgb h ALA 268 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3cgb h ALA 268 CO 0.00 -0.04 -1.56 0.66 0.00 0.00 0.00 179.25 178.32 3cgb n TYR 269 N -3.65 0.00 0.00 0.00 0.53 -1.26 -0.87 117.16 111.91 3cgb n TYR 269 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.85 3cgb n TYR 269 Cb 0.11 -0.44 0.00 0.00 -1.03 0.00 0.00 39.34 37.97 3cgb n TYR 269 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 3cgb n GLN 271 N -3.66 0.00 -1.63 -0.72 6.02 -1.26 -4.78 117.38 111.35 3cgb n GLN 271 Ca -0.23 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.50 3cgb n GLN 271 Cb 0.62 0.00 0.18 0.00 1.02 0.00 0.00 30.24 32.06 3cgb n GLN 271 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3cgb n THR 272 N -1.12 0.00 1.03 5.09 -2.24 -0.58 -1.70 114.28 114.75 3cgb n THR 272 Ca 0.00 -0.84 0.11 0.00 -2.27 0.00 0.00 64.05 61.05 3cgb n THR 272 Cb 0.00 -1.55 0.56 0.00 -2.10 0.00 0.00 70.33 67.24 3cgb n THR 272 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3cgb n ASN 273 N -3.79 0.00 -4.53 3.42 6.94 -1.26 -4.71 115.26 111.32 3cgb n ASN 273 Ca 0.15 0.07 -0.36 0.00 -0.02 0.00 0.00 54.58 54.41 3cgb n ASN 273 Cb 0.51 -0.33 -0.11 0.00 -2.36 0.00 0.00 39.78 37.49 3cgb n ASN 273 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3cgb s VAL 274 N -2.66 4.53 0.09 3.53 1.01 -1.26 -5.04 120.40 120.60 3cgb s VAL 274 Ca 0.20 -0.11 -0.36 0.00 0.00 0.00 0.00 61.98 61.70 3cgb s VAL 274 Cb 0.15 -3.08 -0.17 0.00 0.00 0.00 0.00 36.38 33.28 3cgb s VAL 274 CO 0.36 0.39 1.21 1.67 0.00 0.00 0.00 175.10 178.73 3cgb n GLN 275 N 4.31 0.82 -1.25 2.72 -0.06 -1.26 -1.94 117.38 120.72 3cgb n GLN 275 Ca -0.16 0.30 -0.09 0.00 -2.00 0.00 0.00 57.00 55.05 3cgb n GLN 275 Cb 0.52 -1.85 -0.04 0.00 -4.06 0.00 0.00 30.24 24.81 3cgb n GLN 275 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3cgb n ASP 276 N 2.15 -5.71 -4.46 1.69 8.00 -1.26 -4.99 116.55 111.97 3cgb n ASP 276 Ca 0.18 0.22 -0.33 0.00 0.71 0.00 0.00 54.79 55.56 3cgb n ASP 276 Cb 0.18 -3.97 -0.13 0.00 -0.02 0.00 0.00 41.12 37.18 3cgb n ASP 276 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3cgb s VAL 277 N -1.77 3.60 0.36 2.53 1.01 -0.82 -0.90 120.40 124.41 3cgb s VAL 277 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.59 3cgb s VAL 277 Cb 0.00 -2.55 -0.07 0.00 0.00 0.00 0.00 36.38 33.76 3cgb s VAL 277 CO 0.00 0.51 -0.05 -0.31 0.00 0.00 0.00 175.10 175.26 3cgb s TYR 278 N 0.27 2.39 0.08 5.22 1.51 0.74 -1.53 117.35 126.02 3cgb s TYR 278 Ca -0.05 -0.60 -0.12 0.00 -1.01 0.00 0.00 57.07 55.28 3cgb s TYR 278 Cb -0.15 -1.50 0.01 0.00 -0.11 0.00 0.00 41.96 40.22 3cgb s TYR 278 CO 0.04 0.48 0.28 0.00 -1.11 0.00 0.00 175.55 175.24 3cgb s ALA 279 N -2.72 -0.55 -0.17 3.71 0.00 -1.26 -0.99 121.76 119.78 3cgb s ALA 279 Ca 0.33 -0.27 -0.29 0.00 0.00 0.00 0.00 51.96 51.74 3cgb s ALA 279 Cb 0.06 0.49 0.11 0.00 0.00 0.00 0.00 23.12 23.77 3cgb s ALA 279 CO 0.17 -0.51 0.92 0.00 0.00 0.00 0.00 175.76 176.33 3cgb s ALA 280 N -3.42 -1.90 0.00 0.00 0.00 -1.03 -4.75 121.76 110.66 3cgb s ALA 280 Ca 0.01 1.63 0.00 0.00 0.00 0.00 0.00 51.96 53.60 3cgb s ALA 280 Cb 0.02 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.38 3cgb s ALA 280 CO -0.09 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.77 3cgb n GLY 281 N 1.25 -0.73 0.29 0.00 0.00 -1.26 -4.32 105.19 100.42 3cgb n GLY 281 Ca -0.13 -1.59 0.16 0.00 0.00 0.00 0.00 46.02 44.46 3cgb n GLY 281 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3cgb h ASP 282 N 2.23 0.00 0.78 1.61 5.19 -1.88 -1.28 116.42 123.07 3cgb h ASP 282 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3cgb h ASP 282 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 3cgb h ASP 282 CO 0.00 0.06 -0.03 0.00 -3.12 0.00 0.00 179.24 176.15 3cgb s ALA 284 N -2.81 3.73 0.57 0.00 0.00 -0.48 -0.23 121.76 122.55 3cgb s ALA 284 Ca 0.20 -2.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.07 3cgb s ALA 284 Cb 0.19 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 3cgb s ALA 284 CO 0.51 -0.17 0.91 0.95 0.00 0.00 0.00 175.76 177.95 3cgb s THR 285 N -2.55 4.24 -0.23 0.00 -4.23 -0.21 -4.66 115.64 108.01 3cgb s THR 285 Ca 0.43 0.29 -0.02 0.00 -1.18 0.00 0.00 61.69 61.21 3cgb s THR 285 Cb 0.01 -3.67 0.07 0.00 1.34 0.00 0.00 72.50 70.26 3cgb s THR 285 CO 0.24 -0.74 0.05 -1.00 -0.54 0.00 0.00 174.62 172.64 3cgb s HIS 286 N -2.99 1.18 0.31 3.99 4.02 0.88 -4.70 115.29 117.99 3cgb s HIS 286 Ca 0.52 -1.10 -0.30 0.00 1.02 0.00 0.00 55.06 55.20 3cgb s HIS 286 Cb -0.11 -1.20 -0.12 0.00 -1.02 0.00 0.00 32.58 30.14 3cgb s HIS 286 CO 0.48 -0.70 1.56 0.98 1.02 0.00 0.00 174.74 178.08 3cgb n TYR 287 N 5.00 2.86 -4.06 1.40 9.36 -1.26 -0.01 117.16 130.45 3cgb n TYR 287 Ca -0.07 0.31 -0.35 0.00 3.32 0.00 0.00 57.90 61.11 3cgb n TYR 287 Cb 0.45 -2.58 -0.13 0.00 -0.63 0.00 0.00 39.34 36.46 3cgb n TYR 287 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 3cgb s HIS 288 N -0.28 3.02 0.32 2.98 5.65 -0.04 -0.32 115.29 126.62 3cgb s HIS 288 Ca 0.61 -0.55 0.03 0.00 0.25 0.00 0.00 55.06 55.41 3cgb s HIS 288 Cb -0.50 -2.09 0.62 0.00 -1.18 0.00 0.00 32.58 29.44 3cgb s HIS 288 CO 0.52 -0.30 1.91 0.28 -0.65 0.00 0.00 174.74 176.51 3cgb h VAL 289 N 5.45 1.02 0.03 0.89 2.07 -1.41 0.45 116.25 124.74 3cgb h VAL 289 Ca -0.37 -0.31 -0.39 0.00 0.82 0.00 0.00 66.70 66.46 3cgb h VAL 289 Cb 1.18 0.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 3cgb h VAL 289 CO 0.60 0.17 -2.35 -0.38 0.02 0.00 0.00 177.57 175.63 3cgb n ILE 290 N -4.50 1.56 0.16 4.57 2.08 -1.26 -4.14 119.36 117.82 3cgb n ILE 290 Ca 0.14 -0.57 0.01 0.00 0.56 0.00 0.00 62.75 62.89 3cgb n ILE 290 Cb 0.25 -1.54 0.28 0.00 -0.75 0.00 0.00 39.64 37.88 3cgb n ILE 290 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3cgb h LYS 291 N -0.07 0.04 -2.63 0.38 1.57 -1.93 -3.47 116.57 110.46 3cgb h LYS 291 Ca -0.55 -0.02 -0.36 0.00 -1.87 0.00 0.00 60.65 57.85 3cgb h LYS 291 Cb 1.90 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.19 3cgb h LYS 291 CO -0.07 0.49 -0.47 0.39 -0.57 0.00 0.00 179.45 179.21 3cgb n GLU 292 N -4.00 -1.54 -4.23 3.15 1.02 0.16 -4.99 120.64 110.21 3cgb n GLU 292 Ca -0.02 0.88 -0.13 0.00 -0.02 0.00 0.00 57.16 57.87 3cgb n GLU 292 Cb 0.48 -5.39 -0.10 0.00 -0.02 0.00 0.00 31.44 26.41 3cgb n GLU 292 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 3cgb s ILE 293 N -2.91 0.76 -0.54 -3.67 1.10 -1.25 -4.93 121.20 109.75 3cgb s ILE 293 Ca 0.01 -1.98 -0.24 0.00 -0.51 0.00 0.00 60.65 57.92 3cgb s ILE 293 Cb -0.00 -2.01 0.04 0.00 0.15 0.00 0.00 42.46 40.64 3cgb s ILE 293 CO 0.01 -0.58 0.93 -1.00 -2.11 0.00 0.00 174.94 172.19 3cgb s HIS 294 N -3.60 2.81 0.26 3.50 3.76 -1.26 -0.86 115.29 119.90 3cgb s HIS 294 Ca 0.21 -0.00 0.01 0.00 -0.15 0.00 0.00 55.06 55.12 3cgb s HIS 294 Cb 0.05 -4.06 0.05 0.00 1.11 0.00 0.00 32.58 29.74 3cgb s HIS 294 CO 0.02 -1.33 0.36 -3.47 -0.85 0.00 0.00 174.74 169.47 3cgb n ASP 295 N 7.42 0.60 -3.60 1.40 4.64 0.98 -4.70 116.55 123.29 3cgb n ASP 295 Ca 0.02 -1.48 -0.28 0.00 -1.38 0.00 0.00 54.79 51.66 3cgb n ASP 295 Cb 0.47 -0.22 -0.16 0.00 -1.04 0.00 0.00 41.12 40.18 3cgb n ASP 295 CO 0.00 0.00 0.00 -2.28 -0.82 0.00 0.00 177.20 174.10 3cgb s HIS 296 N -0.85 0.58 -0.54 -0.67 5.65 -1.26 -0.08 115.29 118.12 3cgb s HIS 296 Ca 0.25 -0.90 0.04 0.00 0.25 0.00 0.00 55.06 54.70 3cgb s HIS 296 Cb -0.02 -1.00 0.16 0.00 -1.18 0.00 0.00 32.58 30.55 3cgb s HIS 296 CO 0.16 -0.75 0.39 0.42 -0.65 0.00 0.00 174.74 174.31 3cgb s ILE 297 N 2.01 1.56 -0.28 0.89 1.01 -1.26 -5.03 121.20 120.10 3cgb s ILE 297 Ca 0.07 -3.31 -0.29 0.00 0.00 0.00 0.00 60.65 57.12 3cgb s ILE 297 Cb -0.16 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.25 3cgb s ILE 297 CO -0.27 -1.09 1.44 -2.16 0.00 0.00 0.00 174.94 172.86 3cgb s PRO 298 N -0.53 3.83 0.15 2.79 0.04 -1.26 -4.95 135.00 135.07 3cgb s PRO 298 Ca 0.27 1.38 -0.07 0.00 0.04 0.00 0.00 61.00 62.61 3cgb s PRO 298 Cb -0.04 -3.96 -0.01 0.00 0.04 0.00 0.00 34.50 30.53 3cgb s PRO 298 CO -0.15 -1.24 0.22 0.96 0.04 0.00 0.00 177.00 176.83 3cgb s ILE 299 N 4.82 0.08 0.30 0.56 -4.36 -1.26 -5.03 121.20 116.31 3cgb s ILE 299 Ca 0.63 -1.47 0.14 0.00 -0.26 0.00 0.00 60.65 59.69 3cgb s ILE 299 Cb -0.20 -1.81 0.07 0.00 1.25 0.00 0.00 42.46 41.77 3cgb s ILE 299 CO 0.26 -0.39 1.75 1.23 0.24 0.00 0.00 174.94 178.03 3cgb h GLY 300 N 2.64 0.00 0.63 6.27 0.00 -1.98 -1.01 103.07 109.62 3cgb h GLY 300 Ca -0.33 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 3cgb h GLY 300 CO 0.52 0.00 -0.10 -0.91 0.00 0.00 0.00 176.54 176.04 3cgb h THR 301 N 0.00 0.86 -0.94 4.70 1.35 -1.98 -1.65 112.91 115.25 3cgb h THR 301 Ca -0.00 -0.71 0.14 0.00 -0.55 0.00 0.00 66.41 65.29 3cgb h THR 301 Cb 0.84 1.26 -0.08 0.00 -1.73 0.00 0.00 68.15 68.44 3cgb h THR 301 CO 0.06 0.15 0.60 0.74 -0.25 0.00 0.00 175.52 176.82 3cgb h THR 302 N -0.66 0.84 -0.45 6.82 2.02 -1.91 -1.41 112.91 118.17 3cgb h THR 302 Ca -0.03 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.84 3cgb h THR 302 Cb 0.47 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 3cgb h THR 302 CO 0.05 0.14 0.10 0.00 0.37 0.00 0.00 175.52 176.18 3cgb h ALA 303 N 1.59 0.59 -0.24 6.16 0.00 -1.02 0.22 119.26 126.56 3cgb h ALA 303 Ca 0.48 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 3cgb h ALA 303 Cb 0.68 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3cgb h ALA 303 CO -0.24 0.29 0.01 -0.91 0.00 0.00 0.00 179.25 178.40 3cgb h ASN 304 N 0.59 0.41 -0.56 0.00 2.35 -1.07 -0.81 115.58 116.50 3cgb h ASN 304 Ca 0.14 -0.30 0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3cgb h ASN 304 Cb 0.34 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 3cgb h ASN 304 CO 0.00 0.61 0.31 0.11 -1.65 0.00 0.00 177.43 176.81 3cgb h LYS 305 N 0.21 0.59 -0.15 0.81 1.57 -1.12 -1.35 116.57 117.12 3cgb h LYS 305 Ca 0.07 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.62 3cgb h LYS 305 Cb 0.39 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3cgb h LYS 305 CO 0.01 0.39 -0.68 1.96 -0.57 0.00 0.00 179.45 180.56 3cgb h GLN 306 N 0.60 0.62 -0.37 3.15 4.20 -0.91 -2.11 115.11 120.30 3cgb h GLN 306 Ca 0.24 -0.47 -0.02 0.00 0.06 0.00 0.00 58.65 58.46 3cgb h GLN 306 Cb 0.10 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 3cgb h GLN 306 CO -0.14 1.09 0.14 0.78 -0.67 0.00 0.00 178.83 180.03 3cgb h GLY 307 N 0.93 0.59 0.79 3.46 0.00 -1.00 0.19 103.07 108.02 3cgb h GLY 307 Ca -0.02 -0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.01 3cgb h GLY 307 CO 0.13 0.31 0.14 -0.09 0.00 0.00 0.00 176.54 177.02 3cgb h ARG 308 N 0.45 0.28 -0.63 4.80 2.43 -1.25 -1.74 114.38 118.72 3cgb h ARG 308 Ca 0.12 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3cgb h ARG 308 Cb 0.19 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3cgb h ARG 308 CO -0.01 0.19 0.30 -0.07 -1.51 0.00 0.00 179.97 178.86 3cgb h LEU 309 N 0.29 0.80 -0.51 3.80 3.38 -1.11 -1.77 115.31 120.19 3cgb h LEU 309 Ca 0.14 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3cgb h LEU 309 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3cgb h LEU 309 CO -0.12 0.68 -0.09 0.00 0.09 0.00 0.00 178.44 179.01 3cgb h ALA 310 N 1.44 0.70 -0.05 1.53 0.00 -0.43 0.13 119.26 122.58 3cgb h ALA 310 Ca 0.22 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3cgb h ALA 310 Cb 0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3cgb h ALA 310 CO -0.03 0.59 0.02 0.78 0.00 0.00 0.00 179.25 180.61 3cgb h GLY 311 N 0.82 0.08 0.77 0.00 0.00 -1.08 -2.98 103.07 100.69 3cgb h GLY 311 Ca 0.13 -0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.46 3cgb h GLY 311 CO 0.04 0.04 0.27 1.41 0.00 0.00 0.00 176.54 178.30 3cgb h LEU 312 N -0.06 0.40 -2.97 3.11 3.38 -1.15 -2.26 115.31 115.76 3cgb h LEU 312 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3cgb h LEU 312 Cb 0.15 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3cgb h LEU 312 CO -0.00 0.28 0.00 0.59 0.09 0.00 0.00 178.44 179.40 3cgb n ASN 313 N -4.86 2.08 0.00 -0.43 3.02 0.43 -0.82 115.26 114.68 3cgb n ASN 313 Ca 0.04 -1.39 0.00 0.00 -0.03 0.00 0.00 54.58 53.20 3cgb n ASN 313 Cb 0.12 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 3cgb n ASN 313 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3cgb n LEU 315 N 1.40 0.00 -1.95 3.41 4.77 -0.85 -4.32 117.00 119.46 3cgb n LEU 315 Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 3cgb n LEU 315 Cb 0.23 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 3cgb n LEU 315 CO 0.00 0.00 -0.22 0.47 -1.33 0.00 0.00 177.39 176.31 3cgb n ASP 316 N 0.00 -5.41 -4.43 -1.43 8.00 -1.12 -4.94 116.55 107.22 3cgb n ASP 316 Ca 0.00 0.13 -0.44 0.00 0.71 0.00 0.00 54.79 55.18 3cgb n ASP 316 Cb 0.00 -4.50 -0.00 0.00 -0.02 0.00 0.00 41.12 36.60 3cgb n ASP 316 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3cgb s LYS 317 N -4.55 4.05 0.09 -1.24 1.02 -0.00 -5.00 119.74 114.11 3cgb s LYS 317 Ca 0.00 -2.62 -0.31 0.00 0.02 0.00 0.00 55.97 53.06 3cgb s LYS 317 Cb 0.00 -4.93 -0.09 0.00 -0.52 0.00 0.00 37.83 32.29 3cgb s LYS 317 CO 0.00 -1.65 1.71 0.50 -0.92 0.00 0.00 175.35 174.99 3cgb s ARG 318 N 1.08 4.18 -0.26 1.68 6.06 -1.26 -3.90 118.95 126.52 3cgb s ARG 318 Ca 0.38 2.42 -0.12 0.00 -2.50 0.00 0.00 55.73 55.92 3cgb s ARG 318 Cb -0.05 -3.59 0.09 0.00 0.06 0.00 0.00 34.95 31.47 3cgb s ARG 318 CO -0.03 -0.77 0.60 0.50 -2.50 0.00 0.00 175.30 173.10 3cgb s ARG 319 N 2.64 0.56 0.29 5.12 3.52 -1.26 -5.04 118.95 124.78 3cgb s ARG 319 Ca 0.76 1.21 -0.27 0.00 -0.13 0.00 0.00 55.73 57.30 3cgb s ARG 319 Cb -0.42 0.39 -0.09 0.00 -1.56 0.00 0.00 34.95 33.26 3cgb s ARG 319 CO 0.34 -0.18 0.93 0.00 -0.81 0.00 0.00 175.30 175.57 3cgb s ALA 320 N 2.16 3.27 -0.10 6.12 0.00 -1.26 -4.67 121.76 127.27 3cgb s ALA 320 Ca -0.07 0.53 -0.30 0.00 0.00 0.00 0.00 51.96 52.12 3cgb s ALA 320 Cb -0.09 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 3cgb s ALA 320 CO -0.18 0.20 1.06 0.12 0.00 0.00 0.00 175.76 176.96 3cgb s PHE 321 N -1.46 3.41 -0.38 0.00 5.36 -0.05 -4.95 117.98 119.91 3cgb s PHE 321 Ca 0.47 1.48 0.23 0.00 -0.96 0.00 0.00 56.93 58.14 3cgb s PHE 321 Cb -0.21 -3.26 0.37 0.00 -0.34 0.00 0.00 43.02 39.59 3cgb s PHE 321 CO 0.26 -0.54 1.62 0.87 -1.46 0.00 0.00 175.22 175.97 3cgb h LYS 322 N 7.23 0.00 0.00 10.12 1.79 -1.96 -3.48 116.57 130.28 3cgb h LYS 322 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 3cgb h LYS 322 Cb 1.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 3cgb h LYS 322 CO 0.87 0.05 0.00 0.41 -1.08 0.00 0.00 179.45 179.71 3cgb n GLY 323 N 1.04 1.89 3.80 3.86 0.00 -1.26 -4.63 105.19 109.89 3cgb n GLY 323 Ca 0.04 -2.21 -0.26 0.00 0.00 0.00 0.00 46.02 43.58 3cgb n GLY 323 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3cgb s THR 324 N -1.59 4.50 -1.10 2.61 -1.32 0.56 -4.85 115.64 114.45 3cgb s THR 324 Ca 0.00 -1.08 0.13 0.00 -1.21 0.00 0.00 61.69 59.52 3cgb s THR 324 Cb 0.00 -3.30 -0.02 0.00 -1.51 0.00 0.00 72.50 67.67 3cgb s THR 324 CO 0.00 -0.11 0.71 0.18 -2.21 0.00 0.00 174.62 173.18 3cgb n LEU 325 N -0.37 1.29 -0.04 9.08 4.77 -1.26 -1.19 117.00 129.29 3cgb n LEU 325 Ca -0.08 -0.73 -0.00 0.00 -0.03 0.00 0.00 56.01 55.16 3cgb n LEU 325 Cb 0.55 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.64 3cgb n LEU 325 CO 0.43 0.26 -0.00 0.61 -1.33 0.00 0.00 177.39 177.36 3cgb n GLY 326 N 1.05 0.40 3.76 -0.72 0.00 -1.26 0.51 105.19 108.93 3cgb n GLY 326 Ca 0.05 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 3cgb n GLY 326 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cgb s THR 327 N -2.02 2.55 -0.16 2.61 2.01 -1.26 -4.33 115.64 115.04 3cgb s THR 327 Ca 0.00 0.52 -0.16 0.00 0.31 0.00 0.00 61.69 62.36 3cgb s THR 327 Cb 0.00 -3.33 0.04 0.00 0.01 0.00 0.00 72.50 69.22 3cgb s THR 327 CO 0.00 0.11 0.44 -0.83 -0.69 0.00 0.00 174.62 173.66 3cgb s GLY 328 N -0.14 -0.33 -0.01 4.40 0.00 -0.08 -4.98 107.32 106.19 3cgb s GLY 328 Ca 0.53 1.23 0.02 0.00 0.00 0.00 0.00 44.72 46.50 3cgb s GLY 328 CO 0.52 1.05 -0.06 -1.50 0.00 0.00 0.00 173.10 173.11 3cgb s ILE 329 N 0.16 0.51 -0.04 0.90 2.07 -1.26 -1.62 121.20 121.92 3cgb s ILE 329 Ca -0.01 -0.27 0.02 0.00 -1.41 0.00 0.00 60.65 58.98 3cgb s ILE 329 Cb -0.03 -0.43 0.01 0.00 0.13 0.00 0.00 42.46 42.14 3cgb s ILE 329 CO 0.01 0.14 -0.06 -0.63 -1.91 0.00 0.00 174.94 172.49 3cgb s ILE 330 N -0.13 0.63 -0.16 2.00 1.01 0.05 -4.97 121.20 119.64 3cgb s ILE 330 Ca 0.02 -0.22 -0.26 0.00 0.00 0.00 0.00 60.65 60.19 3cgb s ILE 330 Cb -0.03 -0.61 -0.01 0.00 0.01 0.00 0.00 42.46 41.82 3cgb s ILE 330 CO -0.00 0.23 0.85 -0.75 0.00 0.00 0.00 174.94 175.27 3cgb s LYS 331 N 0.59 4.32 0.00 2.79 2.20 -1.26 -0.48 119.74 127.90 3cgb s LYS 331 Ca -0.08 1.07 0.00 0.00 -0.36 0.00 0.00 55.97 56.59 3cgb s LYS 331 Cb -0.12 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.63 3cgb s LYS 331 CO 0.01 -0.32 0.32 0.34 -0.36 0.00 0.00 175.35 175.34 3cgb n PHE 332 N 5.17 0.00 0.00 4.03 7.35 -1.26 -4.54 117.46 128.22 3cgb n PHE 332 Ca 0.05 -0.05 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3cgb n PHE 332 Cb 0.49 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 40.31 3cgb n PHE 332 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 3cgb n ASN 334 N -0.05 0.00 -4.93 -2.13 5.03 -1.26 -4.68 115.26 107.23 3cgb n ASN 334 Ca 0.00 0.00 -0.28 0.00 0.87 0.00 0.00 54.58 55.18 3cgb n ASN 334 Cb 0.26 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.99 3cgb n ASN 334 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3cgb s LEU 335 N -0.30 4.33 -0.11 3.41 1.43 -1.26 -4.42 118.68 121.75 3cgb s LEU 335 Ca 0.00 0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 3cgb s LEU 335 Cb 0.00 -2.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 3cgb s LEU 335 CO 0.00 0.09 -0.10 -0.89 0.23 0.00 0.00 176.35 175.68 3cgb s THR 336 N -1.67 3.40 -0.20 5.49 2.01 0.73 -4.56 115.64 120.84 3cgb s THR 336 Ca 0.35 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.80 3cgb s THR 336 Cb -0.12 -2.42 0.03 0.00 0.01 0.00 0.00 72.50 70.00 3cgb s THR 336 CO 0.28 0.54 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.81 3cgb s LEU 337 N -0.06 2.39 0.06 4.42 1.43 0.37 -2.65 118.68 124.64 3cgb s LEU 337 Ca -0.01 -0.80 0.05 0.00 -1.03 0.00 0.00 54.13 52.34 3cgb s LEU 337 Cb -0.14 -1.49 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 3cgb s LEU 337 CO 0.03 -0.04 -0.13 0.00 0.23 0.00 0.00 176.35 176.44 3cgb s ALA 338 N 1.25 1.09 -0.01 4.21 0.00 -0.28 -0.77 121.76 127.26 3cgb s ALA 338 Ca 0.02 -0.92 -0.19 0.00 0.00 0.00 0.00 51.96 50.88 3cgb s ALA 338 Cb -0.14 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 22.91 3cgb s ALA 338 CO -0.11 0.16 0.40 -0.98 0.00 0.00 0.00 175.76 175.23 3cgb s ARG 339 N -1.54 0.80 0.02 0.00 1.04 -0.64 -0.75 118.95 117.87 3cgb s ARG 339 Ca -0.02 -0.14 -0.19 0.00 -1.04 0.00 0.00 55.73 54.34 3cgb s ARG 339 Cb -0.09 0.36 0.04 0.00 -2.04 0.00 0.00 34.95 33.22 3cgb s ARG 339 CO 0.02 -0.24 0.43 -0.08 -0.04 0.00 0.00 175.30 175.39 3cgb s THR 340 N -1.55 0.05 0.00 4.99 -1.32 -0.51 -0.90 115.64 116.40 3cgb s THR 340 Ca -0.11 -0.38 0.00 0.00 -1.21 0.00 0.00 61.69 59.99 3cgb s THR 340 Cb -0.03 -0.88 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 3cgb s THR 340 CO 0.04 -0.21 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 3cgb n GLY 341 N 0.75 0.45 3.81 6.08 0.00 0.18 -1.68 105.19 114.77 3cgb n GLY 341 Ca -0.19 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 3cgb n GLY 341 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cgb s LEU 342 N 0.00 4.48 0.00 0.99 1.43 -0.15 -4.80 118.68 120.63 3cgb s LEU 342 Ca 0.00 1.13 0.04 0.00 -1.03 0.00 0.00 54.13 54.27 3cgb s LEU 342 Cb 0.00 -2.80 0.04 0.00 0.03 0.00 0.00 46.19 43.46 3cgb s LEU 342 CO 0.00 0.25 0.31 -0.46 0.23 0.00 0.00 176.35 176.68 3cgb n ASN 343 N 2.01 0.81 -0.05 2.29 0.23 -1.26 -4.05 115.26 115.23 3cgb n ASN 343 Ca -0.11 -1.59 -0.06 0.00 -0.53 0.00 0.00 54.58 52.29 3cgb n ASN 343 Cb 0.51 -0.16 0.13 0.00 -2.08 0.00 0.00 39.78 38.18 3cgb n ASN 343 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3cgb h GLU 344 N 0.00 0.67 -0.58 -3.83 5.08 -1.96 -1.26 114.58 112.70 3cgb h GLU 344 Ca -0.10 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 57.95 3cgb h GLU 344 Cb 0.48 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 3cgb h GLU 344 CO 0.15 0.85 0.19 -0.22 -1.00 0.00 0.00 179.01 178.98 3cgb h LYS 345 N 0.59 0.89 -0.06 2.33 3.64 -1.96 -0.52 116.57 121.48 3cgb h LYS 345 Ca 0.08 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 3cgb h LYS 345 Cb 0.72 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3cgb h LYS 345 CO 0.05 0.80 -0.03 0.93 -2.27 0.00 0.00 179.45 178.93 3cgb h GLU 346 N 0.81 0.13 -0.56 1.90 5.08 -1.82 -0.70 114.58 119.42 3cgb h GLU 346 Ca 0.19 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 3cgb h GLU 346 Cb 0.27 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 3cgb h GLU 346 CO -0.01 0.51 0.29 0.00 -1.00 0.00 0.00 179.01 178.80 3cgb h ALA 347 N 0.61 0.73 -0.51 3.43 0.00 -1.20 -2.13 119.26 120.18 3cgb h ALA 347 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3cgb h ALA 347 Cb 0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3cgb h ALA 347 CO 0.01 -0.06 0.29 0.87 0.00 0.00 0.00 179.25 180.36 3cgb h LYS 348 N 0.55 0.71 0.00 0.00 1.57 -1.08 -2.09 116.57 116.24 3cgb h LYS 348 Ca 0.25 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 3cgb h LYS 348 Cb 0.16 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3cgb h LYS 348 CO -0.17 0.55 -0.09 0.78 -0.57 0.00 0.00 179.45 179.94 3cgb h GLY 349 N 0.68 0.00 0.76 3.86 0.00 -0.79 -1.85 103.07 105.73 3cgb h GLY 349 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3cgb h GLY 349 CO -0.03 0.00 -0.47 1.04 0.00 0.00 0.00 176.54 177.08 3cgb n LEU 350 N -3.93 0.66 -2.99 3.11 4.77 -0.83 -4.96 117.00 112.84 3cgb n LEU 350 Ca -0.02 -0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 55.64 3cgb n LEU 350 Cb 0.18 -0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.10 3cgb n LEU 350 CO 0.31 0.15 -0.02 1.41 -1.33 0.00 0.00 177.39 177.91 3cgb n HIS 351 N -1.30 -1.90 -3.02 -1.77 8.25 -0.70 -4.99 115.22 109.80 3cgb n HIS 351 Ca 0.07 0.48 -0.41 0.00 -0.26 0.00 0.00 57.72 57.60 3cgb n HIS 351 Cb 0.34 -4.42 -0.06 0.00 1.12 0.00 0.00 29.99 26.97 3cgb n HIS 351 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3cgb s ILE 352 N -3.16 4.91 -0.05 1.59 1.01 -0.86 -5.02 121.20 119.61 3cgb s ILE 352 Ca 0.28 1.24 -0.30 0.00 0.00 0.00 0.00 60.65 61.88 3cgb s ILE 352 Cb -0.13 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.27 3cgb s ILE 352 CO 0.35 -0.05 1.66 -2.16 0.00 0.00 0.00 174.94 174.74 3cgb s PRO 353 N 2.67 4.18 0.06 2.79 0.04 -1.26 -4.66 135.00 138.82 3cgb s PRO 353 Ca 0.29 2.20 -0.00 0.00 0.04 0.00 0.00 61.00 63.53 3cgb s PRO 353 Cb -0.15 -3.99 -0.04 0.00 0.04 0.00 0.00 34.50 30.36 3cgb s PRO 353 CO 0.09 -0.85 -0.04 1.52 0.04 0.00 0.00 177.00 177.76 3cgb s TYR 354 N 4.06 0.61 0.33 0.56 -0.85 -1.26 -1.52 117.35 119.27 3cgb s TYR 354 Ca 0.74 -1.01 0.04 0.00 -0.52 0.00 0.00 57.07 56.32 3cgb s TYR 354 Cb -0.34 -0.42 -0.06 0.00 0.38 0.00 0.00 41.96 41.52 3cgb s TYR 354 CO 0.30 -0.32 0.05 0.15 -1.52 0.00 0.00 175.55 174.21 3cgb s LYS 355 N -3.82 1.67 0.15 -3.49 1.02 0.23 -4.69 119.74 110.81 3cgb s LYS 355 Ca 0.08 -1.92 0.06 0.00 0.02 0.00 0.00 55.97 54.20 3cgb s LYS 355 Cb 0.07 -0.94 -0.04 0.00 -0.52 0.00 0.00 37.83 36.39 3cgb s LYS 355 CO -0.08 -0.16 -0.13 0.95 -0.92 0.00 0.00 175.35 175.00 3cgb s THR 356 N -3.24 1.35 -0.03 2.17 -4.23 -1.26 -1.59 115.64 108.81 3cgb s THR 356 Ca 0.36 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 58.94 3cgb s THR 356 Cb 0.09 -1.74 0.02 0.00 1.34 0.00 0.00 72.50 72.20 3cgb s THR 356 CO 0.15 -0.57 -0.05 -0.69 -0.54 0.00 0.00 174.62 172.92 3cgb s VAL 357 N -2.74 0.55 -0.04 2.29 1.01 -0.48 -4.98 120.40 116.01 3cgb s VAL 357 Ca 0.14 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.00 3cgb s VAL 357 Cb -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 3cgb s VAL 357 CO 0.03 0.21 -0.19 -0.75 0.00 0.00 0.00 175.10 174.39 3cgb s LYS 358 N 0.65 1.94 -0.07 2.72 2.20 -1.26 -0.87 119.74 125.05 3cgb s LYS 358 Ca -0.09 -0.69 0.02 0.00 -0.36 0.00 0.00 55.97 54.85 3cgb s LYS 358 Cb -0.12 -1.70 0.02 0.00 -1.51 0.00 0.00 37.83 34.52 3cgb s LYS 358 CO 0.00 0.30 -0.10 0.08 -0.36 0.00 0.00 175.35 175.27 3cgb s VAL 359 N -0.08 1.00 -0.32 4.02 1.01 -0.26 -5.01 120.40 120.76 3cgb s VAL 359 Ca -0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 3cgb s VAL 359 Cb -0.12 -0.94 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 3cgb s VAL 359 CO 0.02 0.33 0.28 -1.81 0.00 0.00 0.00 175.10 173.92 3cgb s ASP 360 N 0.82 6.11 0.00 3.32 -0.00 -1.26 -1.84 116.67 123.82 3cgb s ASP 360 Ca -0.12 -0.21 0.00 0.00 -0.00 0.00 0.00 52.55 52.22 3cgb s ASP 360 Cb -0.15 -2.16 0.00 0.00 -0.00 0.00 0.00 42.92 40.61 3cgb s ASP 360 CO 0.02 -0.22 0.00 -0.24 -0.00 0.00 0.00 175.17 174.72 3cgb n SER 361 N 5.21 0.04 -4.21 0.27 2.88 0.21 -4.97 113.62 113.04 3cgb n SER 361 Ca -0.11 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.30 3cgb n SER 361 Cb 0.50 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.86 3cgb n SER 361 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3cgb s THR 362 N -0.90 0.97 -1.81 2.46 -4.23 -1.26 -1.06 115.64 109.81 3cgb s THR 362 Ca 0.00 -1.99 0.27 0.00 -1.18 0.00 0.00 61.69 58.79 3cgb s THR 362 Cb 0.00 -1.75 0.68 0.00 1.34 0.00 0.00 72.50 72.76 3cgb s THR 362 CO 0.00 -0.79 1.96 -0.46 -0.54 0.00 0.00 174.62 174.79 3cgb n ASN 363 N -0.09 0.00 -4.70 3.99 6.94 -0.61 -4.70 115.26 116.10 3cgb n ASN 363 Ca -0.11 -0.60 -0.57 0.00 -0.02 0.00 0.00 54.58 53.28 3cgb n ASN 363 Cb 0.60 -0.10 -0.07 0.00 -2.36 0.00 0.00 39.78 37.86 3cgb n ASN 363 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3cgb n ALA 365 N -1.10 -0.28 0.28 -2.53 0.00 -0.92 -3.88 120.51 112.09 3cgb n ALA 365 Ca 0.18 0.40 0.13 0.00 0.00 0.00 0.00 53.44 54.16 3cgb n ALA 365 Cb 0.13 -2.21 0.83 0.00 0.00 0.00 0.00 19.45 18.21 3cgb n ALA 365 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3cgb h GLY 366 N 6.89 0.00 1.73 0.00 0.00 -1.95 -1.78 103.07 107.96 3cgb h GLY 366 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3cgb h GLY 366 CO 0.94 0.00 -0.19 1.58 0.00 0.00 0.00 176.54 178.87 3cgb n TYR 367 N -3.91 0.73 -2.72 5.60 0.18 -1.26 -4.85 117.16 110.93 3cgb n TYR 367 Ca -0.03 0.21 -0.41 0.00 1.88 0.00 0.00 57.90 59.56 3cgb n TYR 367 Cb 0.12 -0.81 -0.05 0.00 -0.38 0.00 0.00 39.34 38.22 3cgb n TYR 367 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 3cgb s TYR 368 N -3.11 3.86 0.33 -3.48 5.04 -0.67 -5.00 117.35 114.32 3cgb s TYR 368 Ca 0.10 1.83 -0.29 0.00 -2.44 0.00 0.00 57.07 56.27 3cgb s TYR 368 Cb 0.13 -3.04 -0.11 0.00 0.35 0.00 0.00 41.96 39.28 3cgb s TYR 368 CO 0.63 0.24 1.54 -0.35 -1.34 0.00 0.00 175.55 176.27 3cgb n PRO 369 N 2.30 2.66 -2.03 4.97 -0.04 -1.26 -2.35 135.00 139.24 3cgb n PRO 369 Ca 0.01 0.94 -0.20 0.00 -0.04 0.00 0.00 63.50 64.21 3cgb n PRO 369 Cb 0.48 -2.69 -0.04 0.00 -0.04 0.00 0.00 33.50 31.20 3cgb n PRO 369 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3cgb n ASN 370 N 1.43 -5.63 -4.71 3.54 3.02 -1.26 -4.99 115.26 106.66 3cgb n ASN 370 Ca 0.06 0.21 -0.43 0.00 -0.03 0.00 0.00 54.58 54.39 3cgb n ASN 370 Cb 0.37 -4.76 -0.01 0.00 -0.61 0.00 0.00 39.78 34.77 3cgb n ASN 370 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cgb n ALA 371 N -0.50 1.60 -2.49 5.41 0.00 -0.99 -5.01 120.51 118.53 3cgb n ALA 371 Ca -0.22 0.37 -0.24 0.00 0.00 0.00 0.00 53.44 53.34 3cgb n ALA 371 Cb 0.67 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.69 3cgb n ALA 371 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3cgb s LYS 372 N -1.49 1.23 0.70 0.00 -0.14 -1.26 -4.97 119.74 113.81 3cgb s LYS 372 Ca 0.58 -1.28 -0.16 0.00 -1.36 0.00 0.00 55.97 53.75 3cgb s LYS 372 Cb -0.56 -1.47 0.02 0.00 -1.68 0.00 0.00 37.83 34.15 3cgb s LYS 372 CO 0.59 0.33 1.19 -2.14 -0.76 0.00 0.00 175.35 174.56 3cgb s PRO 373 N -2.25 2.36 -0.07 -1.68 0.02 -1.26 -1.57 135.00 130.56 3cgb s PRO 373 Ca 0.11 1.72 -0.03 0.00 0.02 0.00 0.00 61.00 62.82 3cgb s PRO 373 Cb -0.09 -1.86 0.04 0.00 0.02 0.00 0.00 34.50 32.61 3cgb s PRO 373 CO 0.06 -1.66 0.13 -1.17 -0.33 0.00 0.00 177.00 174.03 3cgb s LEU 374 N -4.94 0.26 -0.17 -5.54 2.96 -0.22 -4.12 118.68 106.90 3cgb s LEU 374 Ca 0.74 0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 54.89 3cgb s LEU 374 Cb -0.28 0.23 -0.02 0.00 0.50 0.00 0.00 46.19 46.61 3cgb s LEU 374 CO 0.43 -0.21 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.89 3cgb s TYR 375 N 1.87 2.98 -0.02 5.38 1.51 -0.09 -0.62 117.35 128.37 3cgb s TYR 375 Ca -0.01 -0.47 -0.01 0.00 -1.01 0.00 0.00 57.07 55.57 3cgb s TYR 375 Cb -0.12 -1.99 0.02 0.00 -0.11 0.00 0.00 41.96 39.76 3cgb s TYR 375 CO -0.05 -0.18 0.05 -1.17 -1.11 0.00 0.00 175.55 173.09 3cgb s LEU 376 N 0.65 1.37 -0.02 -1.29 0.20 -0.77 -0.83 118.68 118.00 3cgb s LEU 376 Ca -0.03 0.09 0.03 0.00 0.69 0.00 0.00 54.13 54.91 3cgb s LEU 376 Cb -0.15 0.08 -0.00 0.00 -0.43 0.00 0.00 46.19 45.69 3cgb s LEU 376 CO 0.02 -0.08 -0.09 -0.75 -0.29 0.00 0.00 176.35 175.16 3cgb s LYS 377 N 0.62 0.84 0.05 1.98 2.20 -0.20 -1.10 119.74 124.13 3cgb s LYS 377 Ca -0.05 -0.31 0.07 0.00 -0.36 0.00 0.00 55.97 55.32 3cgb s LYS 377 Cb -0.07 -0.80 -0.03 0.00 -1.51 0.00 0.00 37.83 35.42 3cgb s LYS 377 CO -0.02 0.15 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.41 3cgb s LEU 378 N 0.02 2.18 0.01 5.43 1.43 -0.05 -1.26 118.68 126.43 3cgb s LEU 378 Ca -0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 3cgb s LEU 378 Cb -0.06 -0.93 -0.03 0.00 0.03 0.00 0.00 46.19 45.20 3cgb s LEU 378 CO 0.00 0.14 -0.07 -0.76 0.23 0.00 0.00 176.35 175.89 3cgb s LEU 379 N -1.26 3.16 0.02 1.79 1.02 -0.36 -1.38 118.68 121.68 3cgb s LEU 379 Ca 0.07 -0.15 -0.12 0.00 0.02 0.00 0.00 54.13 53.94 3cgb s LEU 379 Cb -0.09 -1.81 0.01 0.00 0.02 0.00 0.00 46.19 44.32 3cgb s LEU 379 CO 0.02 0.28 0.26 -0.72 0.02 0.00 0.00 176.35 176.21 3cgb s TYR 380 N -1.00 -0.06 0.18 0.29 -0.85 -0.62 -0.14 117.35 115.15 3cgb s TYR 380 Ca 0.17 -0.03 -0.31 0.00 -0.52 0.00 0.00 57.07 56.38 3cgb s TYR 380 Cb -0.11 0.05 -0.10 0.00 0.38 0.00 0.00 41.96 42.18 3cgb s TYR 380 CO 0.08 -0.43 1.53 1.03 -1.52 0.00 0.00 175.55 176.24 3cgb s ARG 381 N -2.12 4.23 0.28 -3.49 0.52 0.07 -0.60 118.95 117.84 3cgb s ARG 381 Ca -0.08 2.34 0.00 0.00 -0.52 0.00 0.00 55.73 57.47 3cgb s ARG 381 Cb -0.03 -3.15 0.51 0.00 0.52 0.00 0.00 34.95 32.80 3cgb s ARG 381 CO -0.01 -0.56 1.86 0.77 0.02 0.00 0.00 175.30 177.38 3cgb h SER 382 N 6.42 0.96 0.00 0.23 0.02 -1.55 -1.09 113.55 118.54 3cgb h SER 382 Ca -0.43 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3cgb h SER 382 Cb 1.21 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.58 3cgb h SER 382 CO 0.88 0.55 -0.15 -2.24 -1.14 0.00 0.00 176.83 174.74 3cgb h ASP 383 N 1.06 0.00 0.66 3.07 3.04 -1.92 -3.40 116.42 118.92 3cgb h ASP 383 Ca 0.47 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.26 3cgb h ASP 383 Cb 0.37 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.66 3cgb h ASP 383 CO -0.22 0.46 -0.53 0.35 -2.04 0.00 0.00 179.24 177.25 3cgb n THR 384 N -4.12 0.13 -0.97 1.15 -2.24 -1.25 -4.94 114.28 102.04 3cgb n THR 384 Ca -0.02 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3cgb n THR 384 Cb 0.08 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 3cgb n THR 384 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3cgb n LYS 385 N -1.73 -1.03 -1.66 -0.78 4.76 -0.41 -4.91 118.16 112.39 3cgb n LYS 385 Ca 0.05 0.26 -0.46 0.00 -2.87 0.00 0.00 58.31 55.29 3cgb n LYS 385 Cb 0.38 -4.09 -0.04 0.00 -1.84 0.00 0.00 35.03 29.44 3cgb n LYS 385 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 3cgb n GLN 386 N -0.85 2.02 -1.94 1.97 7.27 -1.26 -1.11 117.38 123.48 3cgb n GLN 386 Ca 0.00 0.72 -0.42 0.00 0.07 0.00 0.00 57.00 57.38 3cgb n GLN 386 Cb 0.26 -2.43 -0.03 0.00 2.41 0.00 0.00 30.24 30.45 3cgb n GLN 386 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 3cgb s LEU 387 N 0.52 4.37 -0.12 1.69 2.96 -1.26 -0.75 118.68 126.09 3cgb s LEU 387 Ca 0.74 2.67 0.09 0.00 -0.22 0.00 0.00 54.13 57.42 3cgb s LEU 387 Cb -0.69 -3.61 -0.14 0.00 0.50 0.00 0.00 46.19 42.26 3cgb s LEU 387 CO 0.44 -0.80 0.02 0.18 -1.32 0.00 0.00 176.35 174.87 3cgb n LEU 388 N 3.24 0.37 0.00 -0.68 4.77 0.80 -4.81 117.00 120.69 3cgb n LEU 388 Ca 0.11 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3cgb n LEU 388 Cb 0.39 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3cgb n LEU 388 CO 0.61 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 3cgb n GLY 389 N 2.34 -0.15 3.36 -0.72 0.00 -1.12 -0.98 105.19 107.92 3cgb n GLY 389 Ca -0.20 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 3cgb n GLY 389 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cgb s GLY 390 N 0.00 -0.37 -0.02 -0.02 0.00 -0.68 -1.22 107.32 105.01 3cgb s GLY 390 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 44.72 45.08 3cgb s GLY 390 CO 0.00 0.07 -0.03 1.20 0.00 0.00 0.00 173.10 174.33 3cgb s GLN 391 N -2.94 0.51 -0.03 2.90 -0.21 -0.39 -1.43 119.66 118.07 3cgb s GLN 391 Ca -0.02 -0.08 0.02 0.00 0.02 0.00 0.00 55.36 55.29 3cgb s GLN 391 Cb -0.00 -0.55 0.01 0.00 1.00 0.00 0.00 33.01 33.47 3cgb s GLN 391 CO -0.06 -0.02 -0.08 0.08 -2.12 0.00 0.00 175.29 173.10 3cgb s VAL 392 N 0.52 0.72 -0.02 1.09 1.01 0.07 -1.04 120.40 122.75 3cgb s VAL 392 Ca -0.06 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3cgb s VAL 392 Cb -0.09 -0.67 0.02 0.00 0.00 0.00 0.00 36.38 35.64 3cgb s VAL 392 CO -0.00 0.24 -0.02 -0.63 0.00 0.00 0.00 175.10 174.69 3cgb s ILE 393 N 0.44 0.25 -2.27 2.22 1.01 -0.01 -1.12 121.20 121.72 3cgb s ILE 393 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.56 3cgb s ILE 393 Cb -0.11 -0.29 0.00 0.00 0.01 0.00 0.00 42.46 42.08 3cgb s ILE 393 CO 0.01 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.68 3cgb n GLY 394 N 3.70 -1.34 0.09 6.18 0.00 -1.09 -0.91 105.19 111.81 3cgb n GLY 394 Ca -0.22 -1.00 -0.06 0.00 0.00 0.00 0.00 46.02 44.74 3cgb n GLY 394 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cgb n GLU 395 N -0.02 0.64 -3.86 1.61 1.02 -1.26 -0.19 120.64 118.58 3cgb n GLU 395 Ca 0.00 0.21 -0.11 0.00 -0.02 0.00 0.00 57.16 57.24 3cgb n GLU 395 Cb 0.00 -1.74 -0.09 0.00 -0.02 0.00 0.00 31.44 29.59 3cgb n GLU 395 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3cgb s GLU 396 N -2.68 0.59 -0.41 3.49 0.41 -1.26 -4.67 118.70 114.17 3cgb s GLU 396 Ca -0.05 -0.51 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 3cgb s GLU 396 Cb 0.08 0.24 0.00 0.00 -1.78 0.00 0.00 34.13 32.67 3cgb s GLU 396 CO 0.82 -0.16 0.00 0.41 -0.49 0.00 0.00 175.26 175.85 3cgb n GLY 397 N 1.07 0.59 0.15 -1.39 0.00 -1.26 -4.79 105.19 99.55 3cgb n GLY 397 Ca -0.21 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 3cgb n GLY 397 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3cgb h VAL 398 N 0.00 1.38 -0.82 1.61 2.07 -1.90 -3.10 116.25 115.49 3cgb h VAL 398 Ca -0.08 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 65.72 3cgb h VAL 398 Cb 0.59 2.18 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 3cgb h VAL 398 CO 0.12 0.50 0.45 -2.24 0.02 0.00 0.00 177.57 176.42 3cgb h ASP 399 N 0.01 1.01 -0.25 0.57 2.03 -1.95 -1.65 116.42 116.19 3cgb h ASP 399 Ca -0.02 -0.08 0.04 0.00 -0.73 0.00 0.00 57.03 56.24 3cgb h ASP 399 Cb 1.01 -0.26 -0.04 0.00 -0.83 0.00 0.00 39.33 39.21 3cgb h ASP 399 CO 0.08 0.81 0.02 0.50 -1.03 0.00 0.00 179.24 179.62 3cgb h LYS 400 N 1.14 0.10 -0.43 4.15 3.64 -1.98 -1.29 116.57 121.90 3cgb h LYS 400 Ca 0.29 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.56 3cgb h LYS 400 Cb 0.02 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 3cgb h LYS 400 CO -0.05 0.07 -0.15 0.00 -2.27 0.00 0.00 179.45 177.05 3cgb h ARG 401 N 0.10 0.86 -0.18 1.90 -0.00 -1.37 -1.92 114.38 113.78 3cgb h ARG 401 Ca 0.12 -0.35 -0.11 0.00 -0.50 0.00 0.00 59.98 59.13 3cgb h ARG 401 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 29.97 30.06 3cgb h ARG 401 CO -0.18 0.99 -0.38 0.97 0.00 0.00 0.00 179.97 181.37 3cgb h ILE 402 N 0.69 1.30 -0.55 2.04 6.09 -1.26 -0.71 117.51 125.11 3cgb h ILE 402 Ca 0.10 -1.50 -0.10 0.00 -1.37 0.00 0.00 64.86 62.00 3cgb h ILE 402 Cb 0.70 1.58 -0.02 0.00 0.47 0.00 0.00 36.82 39.55 3cgb h ILE 402 CO 0.05 0.46 -0.04 0.44 -3.07 0.00 0.00 178.15 175.99 3cgb h ASP 403 N 0.33 0.98 -0.73 2.19 5.19 -1.08 0.17 116.42 123.47 3cgb h ASP 403 Ca 0.03 -0.33 -0.01 0.00 -0.62 0.00 0.00 57.03 56.10 3cgb h ASP 403 Cb 0.82 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 40.03 3cgb h ASP 403 CO 0.07 1.08 0.40 0.58 -3.12 0.00 0.00 179.24 178.25 3cgb h VAL 404 N 0.87 1.22 -0.44 -1.35 2.07 -1.12 -2.78 116.25 114.73 3cgb h VAL 404 Ca 0.15 -0.55 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 3cgb h VAL 404 Cb 0.60 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3cgb h VAL 404 CO 0.04 0.24 -0.10 0.40 0.02 0.00 0.00 177.57 178.17 3cgb h ILE 405 N 1.01 1.26 0.00 4.57 2.04 -0.86 -1.77 117.51 123.75 3cgb h ILE 405 Ca 0.26 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.96 3cgb h ILE 405 Cb 0.03 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3cgb h ILE 405 CO -0.04 0.40 0.00 0.00 0.00 0.00 0.00 178.15 178.50 3cgb n ALA 406 N -2.49 1.33 0.00 1.87 0.00 0.58 -1.17 120.51 120.64 3cgb n ALA 406 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3cgb n ALA 406 Cb 0.36 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.81 3cgb n ALA 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cgb n ALA 408 N 0.72 0.00 -0.24 0.00 0.00 -0.67 -1.00 120.51 119.32 3cgb n ALA 408 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3cgb n ALA 408 Cb 0.02 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.52 3cgb n ALA 408 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3cgb h LEU 409 N 0.00 0.93 -0.98 0.00 3.38 -1.42 -2.38 115.31 114.84 3cgb h LEU 409 Ca 0.00 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.85 3cgb h LEU 409 Cb 0.00 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3cgb h LEU 409 CO 0.00 0.85 0.64 0.15 0.09 0.00 0.00 178.44 180.17 3cgb h PHE 410 N 0.96 1.19 -0.32 1.13 3.57 -1.32 -1.88 116.94 120.27 3cgb h PHE 410 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3cgb h PHE 410 Cb 0.20 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 38.55 3cgb h PHE 410 CO 0.01 0.66 0.00 0.09 -2.23 0.00 0.00 178.31 176.85 3cgb n ASN 411 N -4.48 1.69 -2.19 0.41 3.02 -1.09 -5.15 115.26 107.47 3cgb n ASN 411 Ca 0.14 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 3cgb n ASN 411 Cb 0.12 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 3cgb n ASN 411 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3cgb n LYS 412 N 0.42 -3.05 -4.63 3.52 4.01 -0.71 -5.06 118.16 112.66 3cgb n LYS 412 Ca 0.11 2.21 -0.30 0.00 -0.51 0.00 0.00 58.31 59.81 3cgb n LYS 412 Cb 0.27 -2.95 -0.13 0.00 -0.51 0.00 0.00 35.03 31.71 3cgb n LYS 412 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3cgb s SER 414 N -0.35 3.52 0.25 4.39 0.15 -1.26 -4.83 113.70 115.57 3cgb s SER 414 Ca 0.00 -0.56 -0.04 0.00 0.70 0.00 0.00 55.95 56.05 3cgb s SER 414 Cb 0.00 -0.42 0.40 0.00 -1.71 0.00 0.00 66.02 64.29 3cgb s SER 414 CO 0.00 0.23 1.83 -0.29 1.20 0.00 0.00 173.24 176.21 3cgb h ILE 415 N 3.96 0.97 0.00 6.45 2.10 -1.41 -1.99 117.51 127.59 3cgb h ILE 415 Ca -0.48 -0.32 -0.03 0.00 1.08 0.00 0.00 64.86 65.12 3cgb h ILE 415 Cb 1.16 -0.03 -0.00 0.00 -1.09 0.00 0.00 36.82 36.85 3cgb h ILE 415 CO 0.44 0.17 -0.13 0.45 -1.08 0.00 0.00 178.15 178.00 3cgb h HIS 416 N 0.92 0.00 0.00 2.19 3.86 -1.83 -2.41 115.15 117.87 3cgb h HIS 416 Ca 0.41 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.60 3cgb h HIS 416 Cb 0.30 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 3cgb h HIS 416 CO -0.04 0.13 -0.08 -0.44 0.86 0.00 0.00 177.93 178.37 3cgb h ASP 417 N 0.00 0.00 0.04 2.45 3.32 -1.76 -2.35 116.42 118.11 3cgb h ASP 417 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3cgb h ASP 417 Cb 0.54 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.09 3cgb h ASP 417 CO 0.02 0.08 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.51 3cgb h LEU 418 N 0.00 0.00 -2.33 1.55 3.38 -1.51 -1.10 115.31 115.30 3cgb h LEU 418 Ca -0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 3cgb h LEU 418 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3cgb h LEU 418 CO 0.01 0.03 0.15 -0.33 0.09 0.00 0.00 178.44 178.39 3cgb h GLU 419 N 0.00 0.00 -0.01 1.13 5.08 -1.60 -3.03 114.58 116.15 3cgb h GLU 419 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3cgb h GLU 419 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3cgb h GLU 419 CO 0.00 0.00 -0.55 -0.25 -1.00 0.00 0.00 179.01 177.22 3cgb n ASP 420 N -3.70 1.24 -4.73 1.42 8.00 -0.42 -4.95 116.55 113.41 3cgb n ASP 420 Ca 0.00 -0.99 -0.41 0.00 0.71 0.00 0.00 54.79 54.10 3cgb n ASP 420 Cb 0.26 0.47 -0.04 0.00 -0.02 0.00 0.00 41.12 41.78 3cgb n ASP 420 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3cgb s VAL 421 N -2.70 4.41 -1.28 2.53 1.01 -1.15 -4.95 120.40 118.27 3cgb s VAL 421 Ca 0.16 2.02 -0.13 0.00 0.00 0.00 0.00 61.98 64.03 3cgb s VAL 421 Cb 0.18 -4.29 0.14 0.00 0.00 0.00 0.00 36.38 32.40 3cgb s VAL 421 CO 0.65 0.32 1.73 -0.67 0.00 0.00 0.00 175.10 177.14 3cgb n ASP 422 N 2.70 4.96 -4.85 3.32 4.64 -1.26 -4.96 116.55 121.10 3cgb n ASP 422 Ca 0.02 -3.00 -0.31 0.00 -1.38 0.00 0.00 54.79 50.12 3cgb n ASP 422 Cb 0.49 -1.58 0.02 0.00 -1.04 0.00 0.00 41.12 39.01 3cgb n ASP 422 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 3cgb s LEU 423 N 1.49 3.24 0.36 -2.67 1.43 -1.26 -5.02 118.68 116.24 3cgb s LEU 423 Ca 0.44 1.52 -0.25 0.00 -1.03 0.00 0.00 54.13 54.81 3cgb s LEU 423 Cb 0.05 -4.48 -0.09 0.00 0.03 0.00 0.00 46.19 41.69 3cgb s LEU 423 CO 0.00 -1.06 1.02 -0.94 0.23 0.00 0.00 176.35 175.60 3cgb s SER 424 N -3.89 7.02 -0.07 2.29 1.04 -1.26 -5.06 113.70 113.76 3cgb s SER 424 Ca 0.57 1.99 -0.03 0.00 0.48 0.00 0.00 55.95 58.96 3cgb s SER 424 Cb -0.12 -2.59 0.04 0.00 0.10 0.00 0.00 66.02 63.45 3cgb s SER 424 CO 0.52 -0.30 0.16 -0.47 0.98 0.00 0.00 173.24 174.13 3cgb s TYR 425 N -1.59 -0.19 0.06 5.02 6.14 -1.26 -4.82 117.35 120.70 3cgb s TYR 425 Ca 0.54 0.55 -0.05 0.00 0.64 0.00 0.00 57.07 58.75 3cgb s TYR 425 Cb -0.22 -0.11 -0.02 0.00 0.42 0.00 0.00 41.96 42.04 3cgb s TYR 425 CO 0.28 -0.20 0.08 0.00 0.64 0.00 0.00 175.55 176.35 3cgb s ALA 426 N 1.44 0.08 0.34 3.97 0.00 -1.26 -5.03 121.76 121.30 3cgb s ALA 426 Ca -0.06 -0.79 0.11 0.00 0.00 0.00 0.00 51.96 51.21 3cgb s ALA 426 Cb -0.12 0.32 0.88 0.00 0.00 0.00 0.00 23.12 24.21 3cgb s ALA 426 CO -0.06 -0.39 1.79 -1.35 0.00 0.00 0.00 175.76 175.75 3cgb h PRO 427 N 3.25 0.60 0.00 0.00 0.11 -1.99 -1.20 132.00 132.77 3cgb h PRO 427 Ca -0.33 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3cgb h PRO 427 Cb 1.17 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3cgb h PRO 427 CO 0.57 0.40 0.00 -2.30 -0.21 0.00 0.00 178.00 176.46 3cgb n PRO 428 N -4.69 0.32 0.00 1.05 -0.02 -1.26 -4.04 135.00 126.35 3cgb n PRO 428 Ca 0.23 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 3cgb n PRO 428 Cb 0.66 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.64 3cgb n PRO 428 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3cgb n TYR 429 N -1.21 0.00 -3.88 6.00 4.02 -0.49 -5.05 117.16 116.55 3cgb n TYR 429 Ca 0.09 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.94 3cgb n TYR 429 Cb 0.11 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.46 3cgb n TYR 429 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3cgb n ASN 430 N -1.58 -1.86 -4.93 7.72 2.85 -1.01 -4.95 115.26 111.50 3cgb n ASN 430 Ca 0.00 -2.05 -0.20 0.00 -0.11 0.00 0.00 54.58 52.22 3cgb n ASN 430 Cb 0.27 3.04 -0.02 0.00 1.24 0.00 0.00 39.78 44.31 3cgb n ASN 430 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 3cgb s SER 431 N -3.39 5.72 0.47 1.20 0.01 -1.26 -2.17 113.70 114.29 3cgb s SER 431 Ca 0.22 -0.28 0.18 0.00 1.31 0.00 0.00 55.95 57.37 3cgb s SER 431 Cb -0.03 -1.20 1.18 0.00 0.21 0.00 0.00 66.02 66.17 3cgb s SER 431 CO 0.07 -0.34 2.00 -0.37 0.41 0.00 0.00 173.24 175.00 3cgb h VAL 432 N 1.09 0.85 -3.43 3.43 -1.51 -1.96 -3.28 116.25 111.45 3cgb h VAL 432 Ca -0.46 -0.08 -0.65 0.00 -1.23 0.00 0.00 66.70 64.28 3cgb h VAL 432 Cb 1.25 0.60 -0.24 0.00 -2.13 0.00 0.00 31.29 30.77 3cgb h VAL 432 CO 0.56 0.04 -0.68 0.26 -1.23 0.00 0.00 177.57 176.52 3cgb s TRP 433 N -5.23 3.01 0.57 5.19 0.52 -1.26 -4.99 118.94 116.75 3cgb s TRP 433 Ca -0.07 -0.59 -0.20 0.00 0.02 0.00 0.00 56.10 55.27 3cgb s TRP 433 Cb 0.19 -2.08 -0.04 0.00 -1.15 0.00 0.00 33.47 30.39 3cgb s TRP 433 CO 0.74 -0.32 1.26 0.34 0.02 0.00 0.00 176.95 178.99 3cgb s ASP 434 N 1.11 5.23 0.35 2.95 -1.08 -1.24 -4.76 116.67 119.24 3cgb s ASP 434 Ca 0.02 2.54 0.15 0.00 -0.52 0.00 0.00 52.55 54.74 3cgb s ASP 434 Cb -0.14 -2.61 1.06 0.00 -1.46 0.00 0.00 42.92 39.76 3cgb s ASP 434 CO 0.01 -1.57 1.70 -0.65 0.52 0.00 0.00 175.17 175.17 3cgb h PRO 435 N 1.15 0.38 -0.75 4.34 0.11 -1.91 -0.50 132.00 134.84 3cgb h PRO 435 Ca -0.51 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.59 3cgb h PRO 435 Cb 1.30 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 3cgb h PRO 435 CO 0.56 0.25 0.49 0.82 -0.21 0.00 0.00 178.00 179.92 3cgb h ILE 436 N 0.40 1.18 -0.18 4.15 2.04 -1.98 -0.52 117.51 122.60 3cgb h ILE 436 Ca 0.69 -0.34 -0.19 0.00 1.00 0.00 0.00 64.86 66.02 3cgb h ILE 436 Cb 1.59 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.76 3cgb h ILE 436 CO -0.50 0.18 -0.64 1.56 0.00 0.00 0.00 178.15 178.76 3cgb h GLN 437 N 1.00 0.65 -0.78 2.37 4.20 -1.45 0.19 115.11 121.29 3cgb h GLN 437 Ca 0.28 -0.46 -0.05 0.00 0.06 0.00 0.00 58.65 58.48 3cgb h GLN 437 Cb -0.10 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 3cgb h GLN 437 CO -0.07 1.08 0.30 1.96 -0.67 0.00 0.00 178.83 181.43 3cgb h GLN 438 N 0.48 1.18 -0.34 1.46 1.08 -1.07 -0.89 115.11 117.01 3cgb h GLN 438 Ca -0.01 -0.22 -0.05 0.00 -1.45 0.00 0.00 58.65 56.92 3cgb h GLN 438 Cb 1.22 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.45 3cgb h GLN 438 CO 0.12 0.96 0.03 0.00 -0.95 0.00 0.00 178.83 179.00 3cgb h ALA 439 N 1.16 0.46 -1.00 3.87 0.00 -0.91 -2.87 119.26 119.97 3cgb h ALA 439 Ca 0.26 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.08 3cgb h ALA 439 Cb 0.23 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 17.81 3cgb h ALA 439 CO -0.02 0.19 0.63 0.00 0.00 0.00 0.00 179.25 180.04 3cgb h ALA 440 N 0.88 1.58 0.00 0.00 0.00 -0.33 -1.84 119.26 119.55 3cgb h ALA 440 Ca 0.10 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3cgb h ALA 440 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3cgb h ALA 440 CO 0.01 0.15 -0.25 0.00 0.00 0.00 0.00 179.25 179.15 3cgb h ARG 441 N 0.92 0.00 0.00 0.00 3.08 -0.95 -2.69 114.38 114.74 3cgb h ARG 441 Ca 0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.56 3cgb h ARG 441 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3cgb h ARG 441 CO -0.28 0.25 -0.18 0.54 -1.07 0.00 0.00 179.97 179.23 3cgb n ARG 442 N -3.72 0.20 -1.98 0.04 5.12 -0.70 -4.86 116.66 110.76 3cgb n ARG 442 Ca -0.01 0.13 -0.35 0.00 -1.93 0.00 0.00 57.85 55.69 3cgb n ARG 442 Cb 0.36 -1.70 0.03 0.00 -1.16 0.00 0.00 32.46 30.00 3cgb n ARG 442 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3cgb s ALA 443 N -3.09 2.53 -2.00 7.54 0.00 -1.02 -5.04 121.76 120.68 3cgb s ALA 443 Ca 0.10 0.83 0.26 0.00 0.00 0.00 0.00 51.96 53.15 3cgb s ALA 443 Cb 0.14 -3.39 1.56 0.00 0.00 0.00 0.00 23.12 21.43 3cgb s ALA 443 CO 0.62 -1.13 1.91 0.39 0.00 0.00 0.00 175.76 177.55