#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbg n LYS 5 N 0.00 0.27 0.00 1.97 2.85 -1.26 -2.18 118.16 119.80 3gbg n LYS 5 Ca 0.00 0.21 0.13 0.00 -1.05 0.00 0.00 58.31 57.61 3gbg n LYS 5 Cb 0.00 -1.81 0.37 0.00 -0.65 0.00 0.00 35.03 32.95 3gbg n LYS 5 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3gbg n SER 6 N -2.27 1.76 -3.79 -5.58 7.64 -1.26 -4.77 113.62 105.35 3gbg n SER 6 Ca 0.05 -1.49 -0.24 0.00 1.01 0.00 0.00 58.87 58.21 3gbg n SER 6 Cb 0.43 0.06 -0.17 0.00 -1.01 0.00 0.00 64.21 63.52 3gbg n SER 6 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3gbg s PHE 7 N -2.13 0.80 -0.25 1.43 0.08 -0.93 -1.67 117.98 115.31 3gbg s PHE 7 Ca 0.32 -0.28 -0.04 0.00 0.12 0.00 0.00 56.93 57.05 3gbg s PHE 7 Cb 0.20 -0.87 0.01 0.00 -0.57 0.00 0.00 43.02 41.79 3gbg s PHE 7 CO 0.38 -0.37 -0.02 -1.14 -0.10 0.00 0.00 175.22 173.97 3gbg s GLN 8 N 1.93 3.11 0.08 0.44 -0.44 0.11 -4.77 119.66 120.12 3gbg s GLN 8 Ca 0.05 -0.81 0.10 0.00 -2.50 0.00 0.00 55.36 52.20 3gbg s GLN 8 Cb -0.13 -3.08 -0.03 0.00 -1.64 0.00 0.00 33.01 28.13 3gbg s GLN 8 CO -0.06 -0.33 -0.26 0.95 0.50 0.00 0.00 175.29 176.09 3gbg s THR 9 N 1.43 2.14 0.03 -0.34 -4.23 -1.26 0.12 115.64 113.53 3gbg s THR 9 Ca 0.03 -1.53 -0.00 0.00 -1.18 0.00 0.00 61.69 59.01 3gbg s THR 9 Cb -0.16 -1.86 -0.03 0.00 1.34 0.00 0.00 72.50 71.79 3gbg s THR 9 CO -0.02 0.23 -0.03 0.20 -0.54 0.00 0.00 174.62 174.45 3gbg s ASN 10 N -1.58 0.37 -0.10 3.99 -0.87 -0.08 -4.99 114.94 111.69 3gbg s ASN 10 Ca 0.12 -0.67 0.02 0.00 -1.57 0.00 0.00 52.86 50.76 3gbg s ASN 10 Cb -0.10 0.13 0.01 0.00 -0.02 0.00 0.00 41.25 41.27 3gbg s ASN 10 CO 0.04 -0.39 -0.15 -0.69 -2.57 0.00 0.00 177.10 173.34 3gbg s VAL 11 N -2.26 1.44 -0.07 1.60 1.01 -1.26 -0.11 120.40 120.75 3gbg s VAL 11 Ca -0.08 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.31 3gbg s VAL 11 Cb -0.04 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 3gbg s VAL 11 CO -0.04 0.43 -0.18 -0.31 0.00 0.00 0.00 175.10 175.00 3gbg s TYR 12 N 0.87 2.62 0.20 5.22 1.51 0.43 -4.75 117.35 123.44 3gbg s TYR 12 Ca -0.09 -0.48 -0.30 0.00 -1.01 0.00 0.00 57.07 55.19 3gbg s TYR 12 Cb -0.15 -1.66 -0.08 0.00 -0.11 0.00 0.00 41.96 39.95 3gbg s TYR 12 CO 0.01 -0.06 0.94 0.50 -1.11 0.00 0.00 175.55 175.83 3gbg s ARG 13 N -0.28 4.81 -0.25 -0.62 6.06 -1.26 -0.25 118.95 127.16 3gbg s ARG 13 Ca 0.01 1.47 0.01 0.00 -2.50 0.00 0.00 55.73 54.72 3gbg s ARG 13 Cb -0.13 -3.31 0.07 0.00 0.06 0.00 0.00 34.95 31.64 3gbg s ARG 13 CO 0.03 0.44 -0.03 1.41 -2.50 0.00 0.00 175.30 174.65 3gbg s MET 14 N -0.85 1.45 0.72 5.12 1.75 0.21 -4.93 119.30 122.76 3gbg s MET 14 Ca 0.42 -1.01 -0.15 0.00 -1.25 0.00 0.00 55.69 53.70 3gbg s MET 14 Cb -0.25 -2.54 0.03 0.00 2.84 0.00 0.00 34.83 34.91 3gbg s MET 14 CO 0.31 -0.66 1.20 -1.12 -0.65 0.00 0.00 175.02 174.10 3gbg s SER 15 N 1.42 4.33 0.02 1.11 0.01 -1.26 -1.15 113.70 118.18 3gbg s SER 15 Ca -0.03 2.33 -0.36 0.00 1.31 0.00 0.00 55.95 59.20 3gbg s SER 15 Cb -0.19 -2.59 -0.15 0.00 0.21 0.00 0.00 66.02 63.30 3gbg s SER 15 CO -0.08 -2.17 1.51 2.29 0.41 0.00 0.00 173.24 175.20 3gbg n LYS 16 N -2.62 1.45 -1.45 12.44 2.85 -1.26 -1.71 118.16 127.86 3gbg n LYS 16 Ca 0.13 0.53 -0.16 0.00 -1.05 0.00 0.00 58.31 57.76 3gbg n LYS 16 Cb 0.50 -2.22 -0.07 0.00 -0.65 0.00 0.00 35.03 32.59 3gbg n LYS 16 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3gbg n PHE 17 N 3.56 -0.10 -2.13 5.58 3.72 -1.19 -4.97 117.46 121.92 3gbg n PHE 17 Ca 0.20 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.32 3gbg n PHE 17 Cb 0.21 -3.01 0.04 0.00 -0.94 0.00 0.00 39.48 35.78 3gbg n PHE 17 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3gbg s ASP 18 N -2.45 5.45 -0.03 4.37 3.68 -0.70 -4.62 116.67 122.37 3gbg s ASP 18 Ca 0.00 0.90 0.02 0.00 2.13 0.00 0.00 52.55 55.60 3gbg s ASP 18 Cb 0.00 -1.76 0.01 0.00 -1.45 0.00 0.00 42.92 39.71 3gbg s ASP 18 CO 0.00 -1.25 -0.08 -0.89 0.13 0.00 0.00 175.17 173.08 3gbg s THR 19 N -3.20 0.72 -0.14 1.71 2.01 -1.26 -0.85 115.64 114.63 3gbg s THR 19 Ca 0.56 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 62.21 3gbg s THR 19 Cb -0.11 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 3gbg s THR 19 CO 0.48 0.24 0.03 -0.31 -0.69 0.00 0.00 174.62 174.37 3gbg s TYR 20 N 0.35 3.22 -0.10 4.92 4.12 0.11 -4.95 117.35 125.01 3gbg s TYR 20 Ca -0.05 0.10 0.02 0.00 0.02 0.00 0.00 57.07 57.16 3gbg s TYR 20 Cb -0.10 -1.94 0.01 0.00 -1.52 0.00 0.00 41.96 38.42 3gbg s TYR 20 CO 0.01 0.30 -0.16 0.42 0.02 0.00 0.00 175.55 176.13 3gbg s ILE 21 N -0.24 1.53 -0.09 2.71 1.01 -1.26 -0.95 121.20 123.92 3gbg s ILE 21 Ca 0.07 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 60.08 3gbg s ILE 21 Cb -0.12 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 3gbg s ILE 21 CO 0.02 0.45 -0.23 -0.36 0.00 0.00 0.00 174.94 174.81 3gbg s PHE 22 N 0.76 2.54 -0.08 3.97 0.08 0.16 -3.69 117.98 121.73 3gbg s PHE 22 Ca -0.11 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.05 3gbg s PHE 22 Cb -0.16 -1.68 0.02 0.00 -0.57 0.00 0.00 43.02 40.63 3gbg s PHE 22 CO 0.02 -0.32 -0.05 1.21 -0.10 0.00 0.00 175.22 175.97 3gbg s ASN 23 N 0.15 1.64 -1.35 1.36 2.47 -0.55 -1.95 114.94 116.70 3gbg s ASN 23 Ca -0.13 -0.20 -0.06 0.00 0.42 0.00 0.00 52.86 52.90 3gbg s ASN 23 Cb -0.16 -0.63 0.02 0.00 -1.45 0.00 0.00 41.25 39.03 3gbg s ASN 23 CO 0.07 -0.10 0.99 0.59 -3.72 0.00 0.00 177.10 174.93 3gbg n ASN 24 N 4.58 -3.81 -4.56 -4.21 3.02 -0.72 -4.23 115.26 105.33 3gbg n ASN 24 Ca -0.16 -0.68 -0.43 0.00 -0.03 0.00 0.00 54.58 53.29 3gbg n ASN 24 Cb 0.50 -4.58 -0.05 0.00 -0.61 0.00 0.00 39.78 35.05 3gbg n ASN 24 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3gbg s LEU 25 N -6.93 4.11 -0.05 3.41 2.96 -0.50 -4.69 118.68 116.98 3gbg s LEU 25 Ca 0.33 0.08 -0.30 0.00 -0.22 0.00 0.00 54.13 54.02 3gbg s LEU 25 Cb -0.16 -3.10 -0.02 0.00 0.50 0.00 0.00 46.19 43.41 3gbg s LEU 25 CO 0.77 -0.97 0.98 -0.47 -1.32 0.00 0.00 176.35 175.35 3gbg s TYR 26 N 3.52 3.59 -0.58 5.38 5.04 -1.26 -0.54 117.35 132.51 3gbg s TYR 26 Ca 0.34 1.64 -0.20 0.00 -2.44 0.00 0.00 57.07 56.40 3gbg s TYR 26 Cb -0.11 -3.14 0.08 0.00 0.35 0.00 0.00 41.96 39.14 3gbg s TYR 26 CO 0.24 -0.10 0.76 0.42 -1.34 0.00 0.00 175.55 175.54 3gbg s ILE 27 N 1.43 4.68 0.34 3.14 -1.09 -0.46 -4.75 121.20 124.49 3gbg s ILE 27 Ca 0.50 -0.56 0.03 0.00 -2.23 0.00 0.00 60.65 58.39 3gbg s ILE 27 Cb -0.20 -4.48 0.23 0.00 -1.58 0.00 0.00 42.46 36.43 3gbg s ILE 27 CO 0.23 -1.10 1.97 -1.13 -1.23 0.00 0.00 174.94 173.68 3gbg h ASN 28 N 9.23 0.66 -5.05 3.58 -0.73 -1.92 0.29 115.58 121.64 3gbg h ASN 28 Ca -0.28 -0.05 -0.08 0.00 1.87 0.00 0.00 56.30 57.76 3gbg h ASN 28 Cb 1.08 -0.17 -0.16 0.00 0.27 0.00 0.00 38.32 39.34 3gbg h ASN 28 CO 1.08 0.55 -0.16 -1.81 -0.37 0.00 0.00 177.43 176.71 3gbg s ASP 29 N -6.56 -0.21 0.15 1.15 1.01 -1.26 -4.69 116.67 106.26 3gbg s ASP 29 Ca -0.09 -0.12 -0.33 0.00 0.71 0.00 0.00 52.55 52.72 3gbg s ASP 29 Cb 0.17 0.40 -0.16 0.00 1.01 0.00 0.00 42.92 44.34 3gbg s ASP 29 CO 0.77 -0.67 1.09 -1.22 0.21 0.00 0.00 175.17 175.35 3gbg n TYR 30 N 0.45 1.04 -4.14 4.23 4.02 -1.26 -4.65 117.16 116.85 3gbg n TYR 30 Ca -0.18 0.76 -0.10 0.00 -0.01 0.00 0.00 57.90 58.37 3gbg n TYR 30 Cb 0.60 -2.22 -0.10 0.00 -0.02 0.00 0.00 39.34 37.60 3gbg n TYR 30 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3gbg s LYS 31 N -0.39 0.74 -0.11 -0.72 1.02 -1.00 -1.56 119.74 117.72 3gbg s LYS 31 Ca 0.75 -1.23 -0.10 0.00 0.02 0.00 0.00 55.97 55.40 3gbg s LYS 31 Cb -0.91 -0.11 0.03 0.00 -0.52 0.00 0.00 37.83 36.32 3gbg s LYS 31 CO 0.53 -0.03 0.29 0.00 -0.92 0.00 0.00 175.35 175.22 3gbg s MET 32 N -3.57 0.34 0.13 1.68 0.23 -0.67 -0.44 119.30 116.99 3gbg s MET 32 Ca 0.08 0.41 -0.04 0.00 -1.03 0.00 0.00 55.69 55.10 3gbg s MET 32 Cb 0.04 0.16 -0.03 0.00 -1.53 0.00 0.00 34.83 33.47 3gbg s MET 32 CO -0.05 -0.04 0.13 -0.59 -2.03 0.00 0.00 175.02 172.43 3gbg s PHE 33 N 0.18 0.61 -0.01 3.16 -0.71 -0.39 -0.69 117.98 120.13 3gbg s PHE 33 Ca -0.00 -1.01 -0.29 0.00 -1.04 0.00 0.00 56.93 54.59 3gbg s PHE 33 Cb -0.02 -0.30 0.10 0.00 -1.21 0.00 0.00 43.02 41.59 3gbg s PHE 33 CO 0.00 -0.57 0.90 1.67 -1.34 0.00 0.00 175.22 175.88 3gbg s TRP 34 N -3.99 -0.34 0.19 3.49 -2.14 -0.99 -1.25 118.94 113.90 3gbg s TRP 34 Ca 0.18 0.22 -0.12 0.00 2.66 0.00 0.00 56.10 59.04 3gbg s TRP 34 Cb 0.06 0.54 -0.07 0.00 -3.10 0.00 0.00 33.47 30.90 3gbg s TRP 34 CO -0.01 -0.53 0.54 0.96 -2.66 0.00 0.00 176.95 175.25 3gbg s ILE 35 N -3.06 4.91 -0.35 0.66 -4.36 -1.26 -1.37 121.20 116.36 3gbg s ILE 35 Ca 0.05 0.61 0.21 0.00 -0.26 0.00 0.00 60.65 61.26 3gbg s ILE 35 Cb -0.01 -3.67 0.24 0.00 1.25 0.00 0.00 42.46 40.27 3gbg s ILE 35 CO -0.09 0.08 1.51 -2.24 0.24 0.00 0.00 174.94 174.44 3gbg h ASP 36 N 3.02 0.00 -5.37 4.36 2.03 -1.24 -3.36 116.42 115.85 3gbg h ASP 36 Ca -0.48 0.00 0.17 0.00 -0.73 0.00 0.00 57.03 55.99 3gbg h ASP 36 Cb 1.18 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.63 3gbg h ASP 36 CO 0.68 0.13 0.54 -0.94 -1.03 0.00 0.00 179.24 178.61 3gbg s SER 37 N -6.19 -0.07 0.40 4.15 1.04 -1.26 -4.80 113.70 106.96 3gbg s SER 37 Ca 0.05 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.92 3gbg s SER 37 Cb 0.06 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.68 3gbg s SER 37 CO 0.70 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.56 3gbg n GLY 38 N -0.59 -0.44 3.04 7.32 0.00 -1.26 -4.75 105.19 108.52 3gbg n GLY 38 Ca -0.05 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 3gbg n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gbg s ILE 39 N 0.00 0.46 0.05 -0.61 -1.09 -1.26 -4.08 121.20 114.67 3gbg s ILE 39 Ca 0.00 -1.01 -0.02 0.00 -2.23 0.00 0.00 60.65 57.39 3gbg s ILE 39 Cb 0.00 -0.53 -0.03 0.00 -1.58 0.00 0.00 42.46 40.32 3gbg s ILE 39 CO 0.00 -0.38 0.01 0.00 -1.23 0.00 0.00 174.94 173.34 3gbg s ALA 40 N -1.34 0.32 -0.21 9.38 0.00 -0.75 -0.84 121.76 128.32 3gbg s ALA 40 Ca -0.11 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.82 3gbg s ALA 40 Cb -0.10 0.29 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 3gbg s ALA 40 CO 0.00 -0.36 -0.09 0.21 0.00 0.00 0.00 175.76 175.52 3gbg s LYS 41 N -3.56 3.27 -0.22 0.00 2.20 0.11 -0.40 119.74 121.14 3gbg s LYS 41 Ca 0.03 -0.68 -0.08 0.00 -0.36 0.00 0.00 55.97 54.88 3gbg s LYS 41 Cb 0.05 -2.88 -0.04 0.00 -1.51 0.00 0.00 37.83 33.46 3gbg s LYS 41 CO -0.09 -0.19 0.08 -1.17 -0.36 0.00 0.00 175.35 173.62 3gbg s LEU 42 N 1.40 3.66 -0.26 5.43 0.20 -0.18 -0.62 118.68 128.31 3gbg s LEU 42 Ca 0.05 -0.06 -0.04 0.00 0.69 0.00 0.00 54.13 54.77 3gbg s LEU 42 Cb -0.14 -1.96 0.01 0.00 -0.43 0.00 0.00 46.19 43.67 3gbg s LEU 42 CO -0.06 0.06 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.42 3gbg s ILE 43 N 1.06 3.41 -0.51 6.68 1.01 -0.14 -1.53 121.20 131.18 3gbg s ILE 43 Ca 0.04 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 59.77 3gbg s ILE 43 Cb -0.14 -2.69 0.06 0.00 0.01 0.00 0.00 42.46 39.71 3gbg s ILE 43 CO 0.03 0.23 0.60 -0.62 0.00 0.00 0.00 174.94 175.18 3gbg s ASP 44 N 1.43 6.21 0.40 3.58 -1.08 0.19 -1.52 116.67 125.88 3gbg s ASP 44 Ca 0.03 -1.02 0.29 0.00 -0.52 0.00 0.00 52.55 51.32 3gbg s ASP 44 Cb -0.16 -2.28 1.13 0.00 -1.46 0.00 0.00 42.92 40.15 3gbg s ASP 44 CO -0.02 -0.88 1.84 0.11 0.52 0.00 0.00 175.17 176.75 3gbg h LYS 45 N 8.98 0.00 0.03 4.34 6.56 -1.06 0.19 116.57 135.61 3gbg h LYS 45 Ca -0.28 0.00 -0.23 0.00 -1.06 0.00 0.00 60.65 59.08 3gbg h LYS 45 Cb 1.10 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.78 3gbg h LYS 45 CO 0.97 0.00 -0.91 -0.91 -2.06 0.00 0.00 179.45 176.53 3gbg h ASN 46 N 0.00 0.75 -0.03 0.86 -0.26 -1.91 -3.30 115.58 111.69 3gbg h ASN 46 Ca 0.00 -0.77 0.00 0.00 -0.56 0.00 0.00 56.30 54.97 3gbg h ASN 46 Cb 0.48 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.51 3gbg h ASN 46 CO 0.00 1.43 0.00 0.00 -1.06 0.00 0.00 177.43 177.80 3gbg n LEU 48 N 1.17 -3.65 -4.01 0.00 4.77 0.58 -5.01 117.00 110.86 3gbg n LEU 48 Ca 0.12 -0.76 -0.08 0.00 -0.03 0.00 0.00 56.01 55.25 3gbg n LEU 48 Cb 0.52 -2.84 -0.10 0.00 -2.33 0.00 0.00 43.42 38.66 3gbg n LEU 48 CO 0.13 0.37 -0.33 0.68 -1.33 0.00 0.00 177.39 176.90 3gbg s VAL 49 N -3.53 0.15 0.06 4.08 -7.23 -0.75 -4.99 120.40 108.18 3gbg s VAL 49 Ca 0.09 -1.22 0.02 0.00 -1.81 0.00 0.00 61.98 59.06 3gbg s VAL 49 Cb -0.02 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 36.13 3gbg s VAL 49 CO 0.78 -0.67 -0.07 -0.94 -0.31 0.00 0.00 175.10 173.89 3gbg s SER 50 N -2.02 0.91 -0.05 4.85 1.04 -1.26 0.53 113.70 117.70 3gbg s SER 50 Ca -0.07 -0.72 -0.29 0.00 0.48 0.00 0.00 55.95 55.35 3gbg s SER 50 Cb -0.03 0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.26 3gbg s SER 50 CO -0.04 -0.31 0.90 -0.72 0.98 0.00 0.00 173.24 174.04 3gbg s TYR 51 N -2.24 -0.38 0.21 5.02 -0.85 -0.58 -5.00 117.35 113.52 3gbg s TYR 51 Ca -0.02 0.39 -0.15 0.00 -0.52 0.00 0.00 57.07 56.77 3gbg s TYR 51 Cb -0.04 0.51 -0.08 0.00 0.38 0.00 0.00 41.96 42.73 3gbg s TYR 51 CO -0.02 -0.50 0.63 -1.21 -1.52 0.00 0.00 175.55 172.93 3gbg s GLU 52 N -2.44 4.03 0.10 -3.49 2.02 -1.26 -1.01 118.70 116.66 3gbg s GLU 52 Ca 0.02 0.59 0.07 0.00 0.02 0.00 0.00 54.97 55.67 3gbg s GLU 52 Cb -0.01 -2.80 -0.03 0.00 0.10 0.00 0.00 34.13 31.39 3gbg s GLU 52 CO -0.05 0.38 -0.16 0.96 0.02 0.00 0.00 175.26 176.41 3gbg s ILE 53 N -1.61 1.42 0.34 -1.63 -4.36 0.46 -4.95 121.20 110.88 3gbg s ILE 53 Ca 0.43 -1.56 0.01 0.00 -0.26 0.00 0.00 60.65 59.27 3gbg s ILE 53 Cb -0.14 -1.43 -0.00 0.00 1.25 0.00 0.00 42.46 42.14 3gbg s ILE 53 CO 0.20 -0.24 0.03 -0.46 0.24 0.00 0.00 174.94 174.70 3gbg n ASN 54 N 0.90 2.44 0.00 4.36 0.23 -1.26 -1.82 115.26 120.12 3gbg n ASN 54 Ca -0.18 -2.55 0.03 0.00 -0.53 0.00 0.00 54.58 51.35 3gbg n ASN 54 Cb 0.55 0.39 0.18 0.00 -2.08 0.00 0.00 39.78 38.82 3gbg n ASN 54 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3gbg n SER 55 N -1.35 0.00 -0.00 0.53 3.41 -1.26 -1.42 113.62 113.54 3gbg n SER 55 Ca -0.12 -0.14 0.04 0.00 -0.26 0.00 0.00 58.87 58.40 3gbg n SER 55 Cb 0.44 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.30 3gbg n SER 55 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3gbg n SER 56 N -1.04 0.61 -4.71 4.04 7.64 -1.26 -4.83 113.62 114.07 3gbg n SER 56 Ca 0.04 -0.65 -0.42 0.00 1.01 0.00 0.00 58.87 58.86 3gbg n SER 56 Cb 0.02 1.03 -0.03 0.00 -1.01 0.00 0.00 64.21 64.23 3gbg n SER 56 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3gbg s SER 57 N -1.91 7.27 -0.15 6.43 0.01 -0.50 -1.55 113.70 123.29 3gbg s SER 57 Ca 0.03 1.73 0.01 0.00 1.31 0.00 0.00 55.95 59.02 3gbg s SER 57 Cb 0.06 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.73 3gbg s SER 57 CO 0.36 -0.35 -0.16 -0.51 0.41 0.00 0.00 173.24 172.98 3gbg s ILE 58 N 1.24 2.56 -0.18 1.44 1.10 0.10 -4.52 121.20 122.95 3gbg s ILE 58 Ca 0.53 -0.81 -0.08 0.00 -0.51 0.00 0.00 60.65 59.78 3gbg s ILE 58 Cb -0.23 -2.07 -0.04 0.00 0.15 0.00 0.00 42.46 40.27 3gbg s ILE 58 CO 0.26 0.52 0.10 -0.63 -2.11 0.00 0.00 174.94 173.08 3gbg s ILE 59 N 0.85 5.10 -0.10 2.00 1.09 -0.38 -0.26 121.20 129.49 3gbg s ILE 59 Ca -0.05 0.07 0.01 0.00 -1.10 0.00 0.00 60.65 59.58 3gbg s ILE 59 Cb -0.15 -3.30 -0.02 0.00 -1.06 0.00 0.00 42.46 37.93 3gbg s ILE 59 CO -0.01 0.47 -0.12 -0.76 -0.10 0.00 0.00 174.94 174.43 3gbg s LEU 60 N 0.17 2.83 -0.19 2.97 1.43 0.18 -1.27 118.68 124.81 3gbg s LEU 60 Ca 0.07 -0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 52.90 3gbg s LEU 60 Cb -0.12 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 3gbg s LEU 60 CO -0.00 0.24 -0.07 -0.76 0.23 0.00 0.00 176.35 175.98 3gbg s LEU 61 N -0.06 2.88 0.12 1.79 1.43 0.42 -1.26 118.68 123.99 3gbg s LEU 61 Ca -0.02 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 3gbg s LEU 61 Cb -0.14 -1.71 -0.06 0.00 0.03 0.00 0.00 46.19 44.32 3gbg s LEU 61 CO 0.04 0.06 1.06 -0.75 0.23 0.00 0.00 176.35 176.99 3gbg s LYS 62 N 1.01 4.59 0.43 1.70 2.20 -0.65 -2.37 119.74 126.65 3gbg s LYS 62 Ca -0.00 1.62 -0.25 0.00 -0.36 0.00 0.00 55.97 56.97 3gbg s LYS 62 Cb -0.15 -3.34 -0.10 0.00 -1.51 0.00 0.00 37.83 32.74 3gbg s LYS 62 CO -0.00 0.04 1.29 1.17 -0.36 0.00 0.00 175.35 177.49 3gbg n LYS 63 N 2.93 1.97 -0.94 4.03 4.81 -1.26 -1.89 118.16 127.82 3gbg n LYS 63 Ca 0.04 0.70 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 3gbg n LYS 63 Cb 0.48 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.11 3gbg n LYS 63 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3gbg n ASN 64 N 0.14 -2.49 -4.89 3.14 5.03 0.10 -4.98 115.26 111.31 3gbg n ASN 64 Ca 0.06 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.22 3gbg n ASN 64 Cb 0.40 -1.24 -0.02 0.00 -1.02 0.00 0.00 39.78 37.90 3gbg n ASN 64 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3gbg s SER 65 N -2.25 6.40 -0.30 6.41 1.04 -0.79 -4.83 113.70 119.38 3gbg s SER 65 Ca 0.00 1.09 -0.01 0.00 0.48 0.00 0.00 55.95 57.50 3gbg s SER 65 Cb 0.00 -2.31 0.05 0.00 0.10 0.00 0.00 66.02 63.86 3gbg s SER 65 CO 0.00 -0.51 -0.01 -0.63 0.98 0.00 0.00 173.24 173.06 3gbg s ILE 66 N -2.59 2.86 0.18 -1.02 -1.09 -1.26 -1.36 121.20 116.93 3gbg s ILE 66 Ca 0.50 -1.44 -0.10 0.00 -2.23 0.00 0.00 60.65 57.38 3gbg s ILE 66 Cb -0.10 -2.66 -0.07 0.00 -1.58 0.00 0.00 42.46 38.05 3gbg s ILE 66 CO 0.39 -0.11 0.52 -1.10 -1.23 0.00 0.00 174.94 173.41 3gbg s GLN 67 N 1.23 3.83 -0.34 2.79 -1.52 0.30 -4.81 119.66 121.14 3gbg s GLN 67 Ca -0.06 0.29 0.00 0.00 -1.95 0.00 0.00 55.36 53.64 3gbg s GLN 67 Cb -0.20 -2.78 0.14 0.00 -0.22 0.00 0.00 33.01 29.95 3gbg s GLN 67 CO -0.02 0.40 0.26 1.03 -0.25 0.00 0.00 175.29 176.71 3gbg s ARG 68 N -2.48 0.47 0.25 2.91 0.52 -1.26 -1.42 118.95 117.95 3gbg s ARG 68 Ca 0.43 -0.84 -0.20 0.00 -0.52 0.00 0.00 55.73 54.61 3gbg s ARG 68 Cb -0.13 -0.98 0.02 0.00 0.52 0.00 0.00 34.95 34.38 3gbg s ARG 68 CO 0.21 -1.14 0.65 -0.59 0.02 0.00 0.00 175.30 174.44 3gbg s PHE 69 N 1.59 -0.14 0.09 -0.53 -0.71 -0.82 -0.49 117.98 116.97 3gbg s PHE 69 Ca 0.15 -0.27 0.03 0.00 -1.04 0.00 0.00 56.93 55.80 3gbg s PHE 69 Cb -0.18 0.58 -0.03 0.00 -1.21 0.00 0.00 43.02 42.17 3gbg s PHE 69 CO -0.13 -1.12 -0.10 -1.54 -1.34 0.00 0.00 175.22 170.99 3gbg s SER 70 N -2.91 1.37 -0.11 1.98 1.04 -0.58 -0.67 113.70 113.83 3gbg s SER 70 Ca 0.11 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.76 3gbg s SER 70 Cb -0.04 0.01 0.02 0.00 0.10 0.00 0.00 66.02 66.12 3gbg s SER 70 CO 0.04 -0.26 -0.10 -0.22 0.98 0.00 0.00 173.24 173.68 3gbg s LEU 71 N -2.35 1.37 -0.13 2.42 2.96 -0.12 -0.97 118.68 121.86 3gbg s LEU 71 Ca 0.04 -0.34 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 3gbg s LEU 71 Cb -0.03 -0.92 0.00 0.00 0.50 0.00 0.00 46.19 45.74 3gbg s LEU 71 CO -0.00 -0.08 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.85 3gbg s THR 72 N 1.50 2.24 0.25 3.68 2.01 0.21 -0.71 115.64 124.81 3gbg s THR 72 Ca 0.02 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.79 3gbg s THR 72 Cb -0.13 -1.89 -0.09 0.00 0.01 0.00 0.00 72.50 70.39 3gbg s THR 72 CO -0.07 0.55 1.27 -0.55 -0.69 0.00 0.00 174.62 175.13 3gbg s SER 73 N 0.61 6.93 -0.19 3.53 0.15 -0.03 0.09 113.70 124.79 3gbg s SER 73 Ca -0.11 2.45 0.13 0.00 0.70 0.00 0.00 55.95 59.12 3gbg s SER 73 Cb -0.16 -2.62 0.39 0.00 -1.71 0.00 0.00 66.02 61.91 3gbg s SER 73 CO 0.03 -0.46 1.20 0.18 1.20 0.00 0.00 173.24 175.39 3gbg n LEU 74 N 1.88 2.59 -4.34 3.45 4.77 -0.02 -3.63 117.00 121.70 3gbg n LEU 74 Ca 0.03 -3.67 -0.29 0.00 -0.03 0.00 0.00 56.01 52.04 3gbg n LEU 74 Cb 0.43 -0.50 -0.14 0.00 -2.33 0.00 0.00 43.42 40.88 3gbg n LEU 74 CO 0.57 1.22 -0.56 -0.44 -1.33 0.00 0.00 177.39 176.86 3gbg s SER 75 N -3.13 3.10 0.00 -1.43 0.01 -1.24 -4.66 113.70 106.36 3gbg s SER 75 Ca 0.36 -0.61 0.08 0.00 1.31 0.00 0.00 55.95 57.10 3gbg s SER 75 Cb 0.35 -0.27 0.31 0.00 0.21 0.00 0.00 66.02 66.63 3gbg s SER 75 CO -0.05 0.23 1.23 -0.67 0.41 0.00 0.00 173.24 174.40 3gbg n ASP 76 N 1.64 0.94 -4.35 2.44 2.03 -1.26 -3.18 116.55 114.81 3gbg n ASP 76 Ca -0.17 -1.91 -0.18 0.00 0.52 0.00 0.00 54.79 53.04 3gbg n ASP 76 Cb 0.52 -0.11 -0.10 0.00 -0.72 0.00 0.00 41.12 40.71 3gbg n ASP 76 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3gbg s GLU 77 N -1.79 1.37 0.58 -0.67 8.01 -1.26 -4.87 118.70 120.07 3gbg s GLU 77 Ca 0.16 -1.68 -0.19 0.00 0.01 0.00 0.00 54.97 53.27 3gbg s GLU 77 Cb 0.08 -0.84 -0.04 0.00 -4.31 0.00 0.00 34.13 29.02 3gbg s GLU 77 CO 0.11 -0.01 1.22 -0.80 0.01 0.00 0.00 175.26 175.80 3gbg s ASN 78 N -3.34 5.29 0.00 -0.19 -0.87 -1.26 -4.23 114.94 110.35 3gbg s ASN 78 Ca 0.27 2.42 0.05 0.00 -1.57 0.00 0.00 52.86 54.03 3gbg s ASN 78 Cb 0.04 -2.60 -0.02 0.00 -0.02 0.00 0.00 41.25 38.65 3gbg s ASN 78 CO 0.09 -1.53 -0.17 -0.63 -2.57 0.00 0.00 177.10 172.29 3gbg s ILE 79 N -1.56 1.32 -0.21 0.60 1.01 -0.30 -4.96 121.20 117.10 3gbg s ILE 79 Ca 0.76 -0.82 -0.06 0.00 0.00 0.00 0.00 60.65 60.53 3gbg s ILE 79 Cb -0.31 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 3gbg s ILE 79 CO 0.34 0.29 0.04 0.20 0.00 0.00 0.00 174.94 175.81 3gbg s ASN 80 N -0.62 5.13 -0.27 3.58 0.01 -1.26 0.64 114.94 122.15 3gbg s ASN 80 Ca 0.06 -0.12 -0.10 0.00 -0.71 0.00 0.00 52.86 51.99 3gbg s ASN 80 Cb -0.07 -1.89 -0.04 0.00 0.41 0.00 0.00 41.25 39.66 3gbg s ASN 80 CO 0.00 0.07 0.15 -0.69 -1.51 0.00 0.00 177.10 175.12 3gbg s VAL 81 N 0.99 4.96 -0.14 1.60 1.01 0.65 -0.69 120.40 128.78 3gbg s VAL 81 Ca 0.03 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 3gbg s VAL 81 Cb -0.14 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 3gbg s VAL 81 CO 0.02 0.28 0.27 -0.44 0.00 0.00 0.00 175.10 175.24 3gbg s SER 82 N 1.68 6.45 -0.14 3.32 0.01 -0.47 -0.43 113.70 124.12 3gbg s SER 82 Ca 0.07 0.53 0.01 0.00 1.31 0.00 0.00 55.95 57.86 3gbg s SER 82 Cb -0.16 -2.17 0.02 0.00 0.21 0.00 0.00 66.02 63.93 3gbg s SER 82 CO 0.08 0.17 -0.14 -0.69 0.41 0.00 0.00 173.24 173.07 3gbg s VAL 83 N 0.12 1.54 -0.19 3.43 1.01 0.84 -2.34 120.40 124.81 3gbg s VAL 83 Ca 0.16 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.46 3gbg s VAL 83 Cb -0.13 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 3gbg s VAL 83 CO 0.04 0.45 0.02 -0.63 0.00 0.00 0.00 175.10 174.98 3gbg s ILE 84 N 1.39 4.17 -0.19 2.22 1.01 0.14 -0.90 121.20 129.03 3gbg s ILE 84 Ca 0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.39 3gbg s ILE 84 Cb -0.13 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 3gbg s ILE 84 CO -0.09 0.44 -0.03 -0.89 0.00 0.00 0.00 174.94 174.37 3gbg s THR 85 N 0.80 3.67 -0.13 2.92 2.01 0.32 -1.68 115.64 123.56 3gbg s THR 85 Ca 0.01 -0.41 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 3gbg s THR 85 Cb -0.14 -2.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 3gbg s THR 85 CO 0.02 0.45 0.24 -0.63 -0.69 0.00 0.00 174.62 174.00 3gbg s ILE 86 N 0.96 5.34 0.58 1.82 1.01 -0.60 0.05 121.20 130.36 3gbg s ILE 86 Ca 0.00 0.43 -0.16 0.00 0.00 0.00 0.00 60.65 60.92 3gbg s ILE 86 Cb -0.15 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 3gbg s ILE 86 CO 0.01 0.50 1.06 -0.94 0.00 0.00 0.00 174.94 175.57 3gbg s SER 87 N -0.25 5.80 0.30 3.58 1.04 -0.67 -4.21 113.70 119.29 3gbg s SER 87 Ca 0.16 1.86 0.01 0.00 0.48 0.00 0.00 55.95 58.45 3gbg s SER 87 Cb -0.13 -2.54 0.47 0.00 0.10 0.00 0.00 66.02 63.92 3gbg s SER 87 CO 0.04 -1.15 1.83 0.44 0.98 0.00 0.00 173.24 175.38 3gbg h ASP 88 N 0.58 0.66 -0.77 7.02 3.32 -1.98 -1.64 116.42 123.61 3gbg h ASP 88 Ca -0.47 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 56.49 3gbg h ASP 88 Cb 1.22 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.56 3gbg h ASP 88 CO 0.57 0.69 0.51 0.77 -1.72 0.00 0.00 179.24 180.06 3gbg h SER 89 N 0.67 0.79 0.26 6.45 4.64 -1.96 0.15 113.55 124.56 3gbg h SER 89 Ca 0.14 -0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 61.18 3gbg h SER 89 Cb 0.33 -0.18 0.02 0.00 -0.31 0.00 0.00 62.40 62.26 3gbg h SER 89 CO 0.01 0.54 -1.19 0.15 -0.87 0.00 0.00 176.83 175.46 3gbg h PHE 90 N 0.92 0.84 -0.76 4.77 3.04 -1.78 -3.01 116.94 120.96 3gbg h PHE 90 Ca 0.31 -0.53 -0.00 0.00 3.98 0.00 0.00 57.97 61.73 3gbg h PHE 90 Cb 0.09 -0.07 -0.04 0.00 2.56 0.00 0.00 35.95 38.50 3gbg h PHE 90 CO -0.00 1.38 0.46 0.82 -2.02 0.00 0.00 178.31 178.95 3gbg h ILE 91 N 0.23 1.22 0.00 1.41 1.08 -0.59 -1.34 117.51 119.52 3gbg h ILE 91 Ca -0.16 -0.48 -0.06 0.00 -0.39 0.00 0.00 64.86 63.77 3gbg h ILE 91 Cb 1.87 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 35.77 3gbg h ILE 91 CO 0.22 0.23 -0.27 0.08 -0.69 0.00 0.00 178.15 177.71 3gbg h ARG 92 N 1.04 0.00 -0.30 2.37 0.11 -1.06 -0.45 114.38 116.10 3gbg h ARG 92 Ca 0.27 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.25 3gbg h ARG 92 Cb -0.03 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.03 3gbg h ARG 92 CO -0.05 0.27 -0.25 0.77 0.10 0.00 0.00 179.97 180.81 3gbg h SER 93 N 0.00 0.60 -0.43 0.08 0.02 -1.14 -2.30 113.55 110.37 3gbg h SER 93 Ca -0.00 -0.21 -0.15 0.00 -0.84 0.00 0.00 61.79 60.59 3gbg h SER 93 Cb 0.65 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 3gbg h SER 93 CO 0.04 0.83 -0.30 -0.07 -1.14 0.00 0.00 176.83 176.18 3gbg h LEU 94 N 0.52 1.02 -1.71 5.07 3.38 -0.28 -2.49 115.31 120.80 3gbg h LEU 94 Ca 0.07 -0.43 0.08 0.00 0.09 0.00 0.00 57.88 57.69 3gbg h LEU 94 Cb 0.71 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3gbg h LEU 94 CO 0.05 1.23 0.34 0.11 0.09 0.00 0.00 178.44 180.26 3gbg h LYS 95 N 0.81 0.33 -0.06 1.13 1.57 -0.72 -2.26 116.57 117.37 3gbg h LYS 95 Ca 0.08 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3gbg h LYS 95 Cb 0.89 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 3gbg h LYS 95 CO 0.08 0.22 -0.02 0.77 -0.57 0.00 0.00 179.45 179.93 3gbg h SER 96 N 0.34 0.12 0.46 0.86 0.02 -0.98 -3.04 113.55 111.32 3gbg h SER 96 Ca 0.22 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3gbg h SER 96 Cb 0.45 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3gbg h SER 96 CO -0.05 0.49 0.00 -1.22 -1.14 0.00 0.00 176.83 174.91 3gbg n TYR 97 N -4.81 0.40 -3.48 3.45 4.02 -0.89 -4.33 117.16 111.52 3gbg n TYR 97 Ca -0.07 0.17 -0.43 0.00 -0.01 0.00 0.00 57.90 57.56 3gbg n TYR 97 Cb 0.24 -0.78 -0.09 0.00 -0.02 0.00 0.00 39.34 38.69 3gbg n TYR 97 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3gbg s ILE 98 N -3.19 4.88 -0.00 -0.72 1.01 -0.97 -5.03 121.20 117.16 3gbg s ILE 98 Ca 0.04 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 59.65 3gbg s ILE 98 Cb 0.08 -3.88 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 3gbg s ILE 98 CO 0.27 -0.48 -0.08 -0.76 0.00 0.00 0.00 174.94 173.89 3gbg s LEU 99 N 1.58 3.11 -0.45 2.97 2.01 -1.26 -4.90 118.68 121.73 3gbg s LEU 99 Ca 0.04 -0.16 -0.05 0.00 0.01 0.00 0.00 54.13 53.97 3gbg s LEU 99 Cb -0.23 -1.77 0.01 0.00 0.01 0.00 0.00 46.19 44.21 3gbg s LEU 99 CO 0.06 0.29 0.50 0.61 1.01 0.00 0.00 176.35 178.82 3gbg n GLY 100 N 1.66 -1.08 0.81 -3.19 0.00 -1.26 -5.22 105.19 96.90 3gbg n GLY 100 Ca -0.16 0.59 0.09 0.00 0.00 0.00 0.00 46.02 46.54 3gbg n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gbg n ASN 111 N -1.03 2.76 -4.68 1.61 3.02 -1.26 -5.27 115.26 110.41 3gbg n ASN 111 Ca 0.04 -1.82 -0.42 0.00 -0.03 0.00 0.00 54.58 52.35 3gbg n ASN 111 Cb 0.43 -0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 3gbg n ASN 111 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3gbg s LYS 112 N -1.41 4.28 -0.01 3.52 2.47 -1.26 -4.91 119.74 122.42 3gbg s LYS 112 Ca 0.25 1.91 0.21 0.00 -1.56 0.00 0.00 55.97 56.79 3gbg s LYS 112 Cb 0.16 -3.62 -0.27 0.00 -1.46 0.00 0.00 37.83 32.64 3gbg s LYS 112 CO 0.24 -0.59 0.54 -0.25 0.16 0.00 0.00 175.35 175.44 3gbg n ASP 113 N 5.59 0.16 -4.05 1.43 10.43 -1.26 -4.82 116.55 124.03 3gbg n ASP 113 Ca 0.13 0.06 -0.32 0.00 2.57 0.00 0.00 54.79 57.24 3gbg n ASP 113 Cb 0.44 1.59 -0.15 0.00 1.84 0.00 0.00 41.12 44.84 3gbg n ASP 113 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 3gbg s LEU 114 N -4.79 3.38 -0.17 0.64 0.20 -1.26 -1.63 118.68 115.04 3gbg s LEU 114 Ca -0.07 -1.40 -0.04 0.00 0.69 0.00 0.00 54.13 53.31 3gbg s LEU 114 Cb 0.12 -1.50 -0.02 0.00 -0.43 0.00 0.00 46.19 44.36 3gbg s LEU 114 CO 0.88 -0.21 -0.03 -0.76 -0.29 0.00 0.00 176.35 175.94 3gbg s LEU 115 N 1.13 3.21 -0.16 -0.68 1.02 -0.39 -4.95 118.68 117.87 3gbg s LEU 115 Ca -0.08 -0.17 -0.05 0.00 0.02 0.00 0.00 54.13 53.85 3gbg s LEU 115 Cb -0.20 -1.79 -0.04 0.00 0.02 0.00 0.00 46.19 44.19 3gbg s LEU 115 CO -0.05 0.13 0.02 -0.22 0.02 0.00 0.00 176.35 176.24 3gbg s LEU 116 N 0.61 3.60 -0.09 1.79 2.96 -1.26 0.50 118.68 126.79 3gbg s LEU 116 Ca -0.02 0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 3gbg s LEU 116 Cb -0.14 -1.88 0.02 0.00 0.50 0.00 0.00 46.19 44.68 3gbg s LEU 116 CO 0.02 0.21 -0.08 0.86 -1.32 0.00 0.00 176.35 176.04 3gbg s TRP 117 N 0.14 1.39 -0.61 5.38 -0.11 0.65 -4.98 118.94 120.80 3gbg s TRP 117 Ca 0.02 -0.62 -0.23 0.00 1.22 0.00 0.00 56.10 56.49 3gbg s TRP 117 Cb -0.13 -1.13 0.06 0.00 -1.50 0.00 0.00 33.47 30.77 3gbg s TRP 117 CO 0.01 -0.42 0.95 -0.80 -4.62 0.00 0.00 176.95 172.07 3gbg s ASN 118 N 1.40 6.24 0.95 5.86 0.01 -1.26 0.02 114.94 128.16 3gbg s ASN 118 Ca -0.01 -0.71 -0.11 0.00 -0.71 0.00 0.00 52.86 51.32 3gbg s ASN 118 Cb -0.13 -2.42 0.16 0.00 0.41 0.00 0.00 41.25 39.26 3gbg s ASN 118 CO -0.05 -1.34 1.10 0.00 -1.51 0.00 0.00 177.10 175.30 3gbg n GLU 120 N -4.20 3.19 -3.79 0.00 0.00 -1.26 -4.93 120.64 109.66 3gbg n GLU 120 Ca 0.08 -3.97 -0.31 0.00 0.00 0.00 0.00 57.16 52.96 3gbg n GLU 120 Cb 0.54 -2.27 -0.06 0.00 0.00 0.00 0.00 31.44 29.65 3gbg n GLU 120 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 3gbg n HIS 121 N -0.64 -1.00 0.00 -1.84 1.44 -1.26 -4.54 115.22 107.38 3gbg n HIS 121 Ca 0.48 0.50 0.00 0.00 -2.01 0.00 0.00 57.72 56.70 3gbg n HIS 121 Cb 0.65 -1.44 0.00 0.00 0.12 0.00 0.00 29.99 29.33 3gbg n HIS 121 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 3gbg n ASN 122 N -1.77 0.24 0.03 4.39 2.85 -1.26 -4.55 115.26 115.19 3gbg n ASN 122 Ca 0.09 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.36 3gbg n ASN 122 Cb 0.37 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.29 3gbg n ASN 122 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3gbg h ASP 123 N 0.00 0.86 0.75 1.20 3.45 -1.97 -2.66 116.42 118.05 3gbg h ASP 123 Ca 0.00 -0.73 0.00 0.00 0.43 0.00 0.00 57.03 56.73 3gbg h ASP 123 Cb 0.46 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.97 3gbg h ASP 123 CO 0.00 1.47 0.00 0.00 -1.57 0.00 0.00 179.24 179.14 3gbg n ILE 124 N -3.93 0.82 0.10 0.35 0.13 -1.26 -1.12 119.36 114.46 3gbg n ILE 124 Ca -0.10 0.20 -0.20 0.00 -1.10 0.00 0.00 62.75 61.54 3gbg n ILE 124 Cb 0.83 -1.10 -0.15 0.00 -0.84 0.00 0.00 39.64 38.38 3gbg n ILE 124 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3gbg h ALA 125 N 2.32 0.06 -0.07 1.51 0.00 -1.75 -2.51 119.26 118.83 3gbg h ALA 125 Ca 0.00 -0.97 -0.14 0.00 0.00 0.00 0.00 54.91 53.80 3gbg h ALA 125 Cb 0.38 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.36 3gbg h ALA 125 CO 0.00 0.93 -0.50 0.28 0.00 0.00 0.00 179.25 179.96 3gbg h VAL 126 N 0.10 1.40 -0.66 0.00 2.07 -1.06 -2.95 116.25 115.15 3gbg h VAL 126 Ca -0.23 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.40 3gbg h VAL 126 Cb 2.07 2.34 -0.03 0.00 -1.52 0.00 0.00 31.29 34.14 3gbg h VAL 126 CO 0.21 0.56 0.38 -0.07 0.02 0.00 0.00 177.57 178.67 3gbg h LEU 127 N 0.00 0.80 -1.45 2.57 3.38 -1.23 -1.01 115.31 118.37 3gbg h LEU 127 Ca -0.04 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 3gbg h LEU 127 Cb 1.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3gbg h LEU 127 CO 0.10 0.62 -0.23 0.28 0.09 0.00 0.00 178.44 179.31 3gbg h SER 128 N 0.91 0.00 1.33 -0.43 0.02 -1.44 -2.26 113.55 111.68 3gbg h SER 128 Ca 0.24 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.05 3gbg h SER 128 Cb -0.01 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 3gbg h SER 128 CO -0.04 0.23 -0.68 -0.08 -1.14 0.00 0.00 176.83 175.12 3gbg h GLU 129 N 0.00 0.00 -0.17 3.45 4.57 -1.03 -2.12 114.58 119.28 3gbg h GLU 129 Ca -0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 3gbg h GLU 129 Cb 0.58 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 3gbg h GLU 129 CO 0.03 0.61 -0.14 0.28 -1.18 0.00 0.00 179.01 178.62 3gbg h VAL 130 N 0.00 1.33 0.00 0.32 2.07 -0.79 -0.81 116.25 118.37 3gbg h VAL 130 Ca -0.02 -1.26 -0.07 0.00 0.82 0.00 0.00 66.70 66.17 3gbg h VAL 130 Cb 1.49 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 33.03 3gbg h VAL 130 CO 0.08 0.38 -0.35 1.62 0.02 0.00 0.00 177.57 179.31 3gbg h VAL 131 N 0.06 0.90 0.00 2.57 3.04 -1.54 -2.19 116.25 119.09 3gbg h VAL 131 Ca 0.03 -1.41 0.00 0.00 -1.01 0.00 0.00 66.70 64.31 3gbg h VAL 131 Cb 0.65 1.85 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 3gbg h VAL 131 CO 0.04 0.35 0.00 -3.20 -1.01 0.00 0.00 177.57 173.74 3gbg n ASN 132 N -3.61 0.00 -1.53 3.17 5.15 -0.80 -4.86 115.26 112.79 3gbg n ASN 132 Ca -0.01 -1.67 -0.18 0.00 -0.60 0.00 0.00 54.58 52.13 3gbg n ASN 132 Cb 0.47 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.66 3gbg n ASN 132 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gbg n GLY 133 N 0.40 1.22 3.75 8.20 0.00 -0.82 -3.36 105.19 114.59 3gbg n GLY 133 Ca 0.02 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 3gbg n GLY 133 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gbg n PHE 134 N -2.87 -2.17 -0.92 1.61 3.72 -0.33 -4.90 117.46 111.60 3gbg n PHE 134 Ca -0.19 0.89 0.08 0.00 -0.05 0.00 0.00 57.45 58.19 3gbg n PHE 134 Cb 0.60 -4.36 0.25 0.00 -0.94 0.00 0.00 39.48 35.04 3gbg n PHE 134 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3gbg n ARG 135 N -4.49 2.91 0.00 -1.08 1.74 -1.21 -4.38 116.66 110.15 3gbg n ARG 135 Ca -0.15 -2.77 0.00 0.00 -0.77 0.00 0.00 57.85 54.16 3gbg n ARG 135 Cb 0.61 -1.79 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 3gbg n ARG 135 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3gbg n GLU 136 N -0.42 0.81 -3.79 5.56 2.13 -1.26 -5.06 120.64 118.61 3gbg n GLU 136 Ca 0.20 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.90 3gbg n GLU 136 Cb 0.85 -0.62 -0.13 0.00 0.27 0.00 0.00 31.44 31.81 3gbg n GLU 136 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3gbg s ILE 137 N -1.24 -0.01 -0.74 6.31 1.01 -1.26 -5.10 121.20 120.16 3gbg s ILE 137 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 60.65 60.74 3gbg s ILE 137 Cb 0.00 -0.24 0.23 0.00 0.01 0.00 0.00 42.46 42.45 3gbg s ILE 137 CO 0.00 0.02 0.75 -3.20 0.00 0.00 0.00 174.94 172.51 3gbg n ASN 138 N 3.38 3.86 -4.42 3.58 5.15 -1.26 -4.48 115.26 121.08 3gbg n ASN 138 Ca -0.17 -3.33 -0.35 0.00 -0.60 0.00 0.00 54.58 50.14 3gbg n ASN 138 Cb 0.57 -0.81 0.09 0.00 -0.53 0.00 0.00 39.78 39.10 3gbg n ASN 138 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3gbg n TYR 139 N 1.43 -1.31 -3.03 1.20 4.01 -1.26 -4.99 117.16 113.21 3gbg n TYR 139 Ca 0.25 0.28 -0.21 0.00 -0.16 0.00 0.00 57.90 58.06 3gbg n TYR 139 Cb 0.38 -1.83 0.01 0.00 -0.31 0.00 0.00 39.34 37.59 3gbg n TYR 139 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3gbg s SER 140 N -1.72 5.73 0.24 7.72 1.04 -1.26 -4.94 113.70 120.52 3gbg s SER 140 Ca 0.60 0.04 -0.07 0.00 0.48 0.00 0.00 55.95 57.01 3gbg s SER 140 Cb -0.27 -1.24 0.26 0.00 0.10 0.00 0.00 66.02 64.87 3gbg s SER 140 CO 0.64 -0.74 1.91 0.44 0.98 0.00 0.00 173.24 176.47 3gbg h ASP 141 N 0.47 1.05 0.34 7.02 3.45 -1.99 -1.09 116.42 125.66 3gbg h ASP 141 Ca -0.45 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 56.98 3gbg h ASP 141 Cb 1.27 -0.25 -0.00 0.00 -0.56 0.00 0.00 39.33 39.78 3gbg h ASP 141 CO 0.54 0.74 -0.20 -0.08 -1.57 0.00 0.00 179.24 178.67 3gbg h GLU 142 N 1.23 -0.49 -0.22 3.56 4.57 -1.99 -0.57 114.58 120.67 3gbg h GLU 142 Ca 0.36 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.57 3gbg h GLU 142 Cb -0.08 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 3gbg h GLU 142 CO -0.10 -0.33 0.14 0.35 -1.18 0.00 0.00 179.01 177.90 3gbg h PHE 143 N -0.51 0.28 -0.52 0.92 3.04 -1.89 -1.24 116.94 117.03 3gbg h PHE 143 Ca -0.04 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.91 3gbg h PHE 143 Cb 0.42 -0.09 -0.03 0.00 2.56 0.00 0.00 35.95 38.81 3gbg h PHE 143 CO -0.08 0.20 0.28 -0.07 -2.02 0.00 0.00 178.31 176.62 3gbg h LEU 144 N 0.28 0.63 -0.22 0.59 3.38 -1.14 0.22 115.31 119.05 3gbg h LEU 144 Ca 0.08 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 3gbg h LEU 144 Cb -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3gbg h LEU 144 CO -0.02 0.51 -0.51 0.11 0.09 0.00 0.00 178.44 178.62 3gbg h LYS 145 N 0.72 0.75 -0.09 1.13 1.57 -0.73 -1.86 116.57 118.06 3gbg h LYS 145 Ca 0.18 -0.50 -0.18 0.00 -1.87 0.00 0.00 60.65 58.28 3gbg h LYS 145 Cb 0.02 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 3gbg h LYS 145 CO -0.03 1.13 -0.72 -0.24 -0.57 0.00 0.00 179.45 179.01 3gbg h VAL 146 N 0.47 1.37 0.36 0.50 3.04 -0.94 -2.04 116.25 119.01 3gbg h VAL 146 Ca -0.00 -2.11 -0.02 0.00 -1.01 0.00 0.00 66.70 63.56 3gbg h VAL 146 Cb 1.13 2.09 0.00 0.00 -2.01 0.00 0.00 31.29 32.50 3gbg h VAL 146 CO 0.11 0.64 -0.17 0.15 -1.01 0.00 0.00 177.57 177.29 3gbg h PHE 147 N 0.30 -0.45 -0.64 3.17 3.57 -0.56 0.25 116.94 122.59 3gbg h PHE 147 Ca -0.03 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.53 3gbg h PHE 147 Cb 1.30 0.15 -0.06 0.00 2.79 0.00 0.00 35.95 40.13 3gbg h PHE 147 CO 0.05 -0.28 0.33 0.74 -2.23 0.00 0.00 178.31 176.91 3gbg h PHE 148 N -0.52 0.59 -0.80 0.41 0.04 -1.45 0.30 116.94 115.51 3gbg h PHE 148 Ca -0.05 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.77 3gbg h PHE 148 Cb 0.37 -0.17 -0.04 0.00 2.20 0.00 0.00 35.95 38.31 3gbg h PHE 148 CO 0.13 0.26 0.52 0.66 -0.60 0.00 0.00 178.31 179.28 3gbg h SER 149 N 0.60 0.88 1.05 2.17 4.64 -1.41 0.14 113.55 121.63 3gbg h SER 149 Ca 0.29 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 3gbg h SER 149 Cb 0.23 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3gbg h SER 149 CO -0.21 0.62 -0.09 1.23 -0.87 0.00 0.00 176.83 177.51 3gbg h GLY 150 N 1.04 0.00 0.21 -0.77 0.00 0.39 -1.71 103.07 102.23 3gbg h GLY 150 Ca 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.64 3gbg h GLY 150 CO -0.09 0.00 -0.00 -2.75 0.00 0.00 0.00 176.54 173.70 3gbg h PHE 151 N 0.00 -0.01 -0.37 5.60 3.57 0.14 -3.06 116.94 122.81 3gbg h PHE 151 Ca -0.00 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 3gbg h PHE 151 Cb 0.64 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 3gbg h PHE 151 CO 0.00 0.75 -0.18 0.74 -2.23 0.00 0.00 178.31 177.39 3gbg h PHE 152 N -0.80 0.78 -0.63 0.41 0.04 -1.12 -2.11 116.94 113.51 3gbg h PHE 152 Ca -0.00 -0.16 0.07 0.00 2.80 0.00 0.00 57.97 60.68 3gbg h PHE 152 Cb 0.77 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.69 3gbg h PHE 152 CO 0.20 0.83 0.42 1.03 -0.60 0.00 0.00 178.31 180.18 3gbg h SER 153 N 0.62 0.52 0.04 2.17 0.87 -1.39 0.58 113.55 116.95 3gbg h SER 153 Ca 0.10 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3gbg h SER 153 Cb 0.65 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3gbg h SER 153 CO 0.05 0.33 -0.02 0.11 -0.53 0.00 0.00 176.83 176.77 3gbg h LYS 154 N 0.59 -0.05 -0.17 2.24 1.57 -1.36 -3.31 116.57 116.09 3gbg h LYS 154 Ca 0.27 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.09 3gbg h LYS 154 Cb 0.33 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3gbg h LYS 154 CO -0.08 0.57 0.12 -0.24 -0.57 0.00 0.00 179.45 179.24 3gbg h VAL 155 N -0.94 0.95 -0.17 0.50 3.04 -1.20 0.05 116.25 118.47 3gbg h VAL 155 Ca -0.00 -0.02 -0.01 0.00 -1.01 0.00 0.00 66.70 65.65 3gbg h VAL 155 Cb 0.63 0.88 -0.01 0.00 -2.01 0.00 0.00 31.29 30.79 3gbg h VAL 155 CO 0.01 0.01 0.06 -0.33 -1.01 0.00 0.00 177.57 176.31 3gbg h GLU 156 N 0.06 0.24 0.02 4.17 5.08 -0.98 -1.54 114.58 121.62 3gbg h GLU 156 Ca 0.08 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.17 3gbg h GLU 156 Cb 0.23 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.44 3gbg h GLU 156 CO -0.01 0.21 -1.01 0.87 -1.00 0.00 0.00 179.01 178.07 3gbg h LYS 157 N 0.24 0.49 0.00 2.33 1.57 -1.08 -3.07 116.57 117.05 3gbg h LYS 157 Ca 0.06 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3gbg h LYS 157 Cb 0.07 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3gbg h LYS 157 CO -0.01 1.19 0.00 1.17 -0.57 0.00 0.00 179.45 181.23 3gbg n LYS 158 N -3.76 0.57 -3.84 3.15 4.81 -0.60 -4.80 118.16 113.69 3gbg n LYS 158 Ca -0.08 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.21 3gbg n LYS 158 Cb 0.87 -1.27 -0.04 0.00 0.02 0.00 0.00 35.03 34.61 3gbg n LYS 158 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3gbg n TYR 159 N -0.77 -1.13 0.06 5.64 4.01 -1.06 -5.06 117.16 118.85 3gbg n TYR 159 Ca 0.07 -2.26 -0.06 0.00 -0.16 0.00 0.00 57.90 55.49 3gbg n TYR 159 Cb 0.03 0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.44 3gbg n TYR 159 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 3gbg h ASN 160 N 1.80 -0.58 -3.23 7.72 -0.26 -1.87 -3.47 115.58 115.69 3gbg h ASN 160 Ca -0.23 0.06 -0.18 0.00 -0.56 0.00 0.00 56.30 55.39 3gbg h ASN 160 Cb 1.08 0.21 -0.04 0.00 -1.06 0.00 0.00 38.32 38.50 3gbg h ASN 160 CO 0.32 -0.22 -0.15 -1.54 -1.06 0.00 0.00 177.43 174.78 3gbg n SER 161 N -3.56 0.91 -4.70 5.81 3.41 -1.26 -4.81 113.62 109.42 3gbg n SER 161 Ca -0.04 -1.71 -0.43 0.00 -0.26 0.00 0.00 58.87 56.44 3gbg n SER 161 Cb 0.16 0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 3gbg n SER 161 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3gbg n ILE 162 N -0.29 1.42 0.06 -1.33 -5.35 -1.26 -4.77 119.36 107.84 3gbg n ILE 162 Ca -0.01 -0.35 -0.13 0.00 -0.27 0.00 0.00 62.75 61.98 3gbg n ILE 162 Cb 0.20 -1.65 -0.13 0.00 -1.74 0.00 0.00 39.64 36.32 3gbg n ILE 162 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 3gbg h PHE 163 N 3.64 0.28 -3.69 4.28 -0.00 -1.92 -3.46 116.94 116.08 3gbg h PHE 163 Ca -0.46 -0.20 -0.47 0.00 -0.00 0.00 0.00 57.97 56.84 3gbg h PHE 163 Cb 1.27 -0.01 0.06 0.00 -0.00 0.00 0.00 35.95 37.27 3gbg h PHE 163 CO 0.54 1.20 0.20 0.96 -0.00 0.00 0.00 178.31 181.21 3gbg s ILE 164 N -2.65 3.11 -0.04 1.41 -0.00 -1.26 -4.81 121.20 116.96 3gbg s ILE 164 Ca -0.04 -0.10 -0.04 0.00 -0.00 0.00 0.00 60.65 60.47 3gbg s ILE 164 Cb 0.08 -3.27 0.01 0.00 -0.00 0.00 0.00 42.46 39.28 3gbg s ILE 164 CO 0.85 -0.28 0.11 -0.89 -0.00 0.00 0.00 174.94 174.72 3gbg s THR 165 N -3.09 0.01 0.03 8.37 2.01 -1.26 -5.06 115.64 116.65 3gbg s THR 165 Ca 0.56 -0.09 -0.32 0.00 0.31 0.00 0.00 61.69 62.16 3gbg s THR 165 Cb -0.11 -0.19 -0.11 0.00 0.01 0.00 0.00 72.50 72.10 3gbg s THR 165 CO 0.45 -0.05 1.86 -0.90 -0.69 0.00 0.00 174.62 175.30 3gbg n ASP 166 N 2.85 3.76 -0.38 3.53 5.75 -1.26 -4.68 116.55 126.11 3gbg n ASP 166 Ca -0.14 0.97 0.29 0.00 -0.01 0.00 0.00 54.79 55.91 3gbg n ASP 166 Cb 0.59 -1.46 0.56 0.00 -1.03 0.00 0.00 41.12 39.78 3gbg n ASP 166 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3gbg h ASP 167 N 9.05 0.38 -0.26 -1.12 3.32 -2.04 -2.11 116.42 123.64 3gbg h ASP 167 Ca -0.48 0.15 -0.19 0.00 0.02 0.00 0.00 57.03 56.53 3gbg h ASP 167 Cb 1.25 0.11 -0.07 0.00 0.22 0.00 0.00 39.33 40.84 3gbg h ASP 167 CO 0.94 -0.12 0.12 0.00 -1.72 0.00 0.00 179.24 178.46 3gbg n LEU 168 N -4.82 5.82 -4.77 1.55 -0.00 -1.26 -4.77 117.00 108.75 3gbg n LEU 168 Ca 0.33 -2.99 -0.36 0.00 -0.00 0.00 0.00 56.01 52.99 3gbg n LEU 168 Cb 1.16 -1.16 0.01 0.00 -0.00 0.00 0.00 43.42 43.43 3gbg n LEU 168 CO 0.17 1.26 0.82 -0.62 -0.00 0.00 0.00 177.39 179.02 3gbg s ASP 169 N 1.23 5.61 0.21 1.45 2.15 -0.79 -4.88 116.67 121.65 3gbg s ASP 169 Ca 0.26 2.30 -0.08 0.00 0.43 0.00 0.00 52.55 55.46 3gbg s ASP 169 Cb 0.17 -2.59 0.17 0.00 -0.30 0.00 0.00 42.92 40.36 3gbg s ASP 169 CO -0.02 -1.30 1.81 0.00 -0.17 0.00 0.00 175.17 175.49 3gbg h ALA 170 N 1.27 1.04 -0.42 3.66 0.00 -1.92 -1.95 119.26 120.95 3gbg h ALA 170 Ca -0.50 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.18 3gbg h ALA 170 Cb 1.27 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3gbg h ALA 170 CO 0.57 0.60 -0.07 1.98 0.00 0.00 0.00 179.25 182.33 3gbg h MET 171 N 1.14 0.71 -0.54 0.00 -1.53 -1.96 -1.67 114.93 111.08 3gbg h MET 171 Ca 0.28 -0.21 -0.08 0.00 -3.44 0.00 0.00 59.70 56.25 3gbg h MET 171 Cb 0.11 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.06 3gbg h MET 171 CO -0.04 0.77 0.02 1.49 0.14 0.00 0.00 176.91 179.30 3gbg h GLU 172 N 0.66 0.91 -0.44 0.39 4.57 -1.79 -0.28 114.58 118.61 3gbg h GLU 172 Ca 0.12 -0.26 -0.10 0.00 -1.18 0.00 0.00 59.36 57.95 3gbg h GLU 172 Cb 0.51 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 3gbg h GLU 172 CO 0.03 0.89 -0.11 0.87 -1.18 0.00 0.00 179.01 179.51 3gbg h LYS 173 N 0.85 0.85 -0.18 1.92 1.57 -1.00 -1.11 116.57 119.46 3gbg h LYS 173 Ca 0.16 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 3gbg h LYS 173 Cb 0.47 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 3gbg h LYS 173 CO 0.02 0.96 0.01 0.82 -0.57 0.00 0.00 179.45 180.70 3gbg h ILE 174 N 0.68 1.24 -0.09 1.86 2.04 -1.09 -2.11 117.51 120.05 3gbg h ILE 174 Ca 0.11 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 3gbg h ILE 174 Cb 0.65 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 3gbg h ILE 174 CO 0.04 0.25 0.05 0.28 0.00 0.00 0.00 178.15 178.77 3gbg h SER 175 N 0.08 0.11 -0.72 1.72 0.02 -1.02 -1.92 113.55 111.82 3gbg h SER 175 Ca 0.05 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3gbg h SER 175 Cb 0.36 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 3gbg h SER 175 CO 0.01 0.15 0.48 0.00 -1.14 0.00 0.00 176.83 176.32 3gbg h LEU 177 N 0.98 -0.82 -0.38 0.00 6.46 -1.05 -0.95 115.31 119.55 3gbg h LEU 177 Ca 0.26 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 58.10 3gbg h LEU 177 Cb -0.11 0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.00 3gbg h LEU 177 CO -0.06 -0.55 0.14 0.58 -0.62 0.00 0.00 178.44 177.93 3gbg h VAL 178 N -0.90 0.90 0.00 1.05 2.07 -1.00 -2.11 116.25 116.27 3gbg h VAL 178 Ca -0.08 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3gbg h VAL 178 Cb 0.71 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3gbg h VAL 178 CO 0.12 0.06 -0.11 0.11 0.02 0.00 0.00 177.57 177.76 3gbg h LYS 179 N 0.31 0.00 0.00 1.57 1.57 -0.90 -1.63 116.57 117.49 3gbg h LYS 179 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3gbg h LYS 179 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3gbg h LYS 179 CO -0.17 0.11 0.00 -1.13 -0.57 0.00 0.00 179.45 177.70 3gbg n SER 180 N -3.81 0.65 -2.81 0.86 3.41 -0.37 -4.06 113.62 107.49 3gbg n SER 180 Ca -0.02 0.61 -0.10 0.00 -0.26 0.00 0.00 58.87 59.09 3gbg n SER 180 Cb 0.21 -0.76 0.04 0.00 -0.26 0.00 0.00 64.21 63.44 3gbg n SER 180 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gbg n ASP 181 N -2.16 -2.32 0.24 4.04 -0.08 -0.79 -5.02 116.55 110.46 3gbg n ASP 181 Ca 0.04 -3.30 0.17 0.00 -1.51 0.00 0.00 54.79 50.18 3gbg n ASP 181 Cb 0.32 1.48 0.86 0.00 2.34 0.00 0.00 41.12 46.13 3gbg n ASP 181 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 3gbg h ILE 182 N 2.82 0.48 -0.01 5.18 6.09 -1.47 -2.22 117.51 128.38 3gbg h ILE 182 Ca -0.11 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.38 3gbg h ILE 182 Cb 1.02 0.89 0.00 0.00 0.47 0.00 0.00 36.82 39.20 3gbg h ILE 182 CO 0.31 0.00 -0.40 0.35 -3.07 0.00 0.00 178.15 175.34 3gbg n THR 183 N -3.80 0.00 -1.84 2.19 -2.24 -1.26 -4.27 114.28 103.07 3gbg n THR 183 Ca -0.00 -0.12 -0.39 0.00 -2.27 0.00 0.00 64.05 61.27 3gbg n THR 183 Cb 0.24 0.57 0.02 0.00 -2.10 0.00 0.00 70.33 69.07 3gbg n THR 183 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3gbg s ARG 184 N -2.63 3.50 -1.49 -0.78 3.52 -0.84 -4.84 118.95 115.40 3gbg s ARG 184 Ca 0.20 2.29 -0.13 0.00 -0.13 0.00 0.00 55.73 57.96 3gbg s ARG 184 Cb 0.18 -2.50 0.01 0.00 -1.56 0.00 0.00 34.95 31.09 3gbg s ARG 184 CO 0.59 -0.92 2.40 -1.71 -0.81 0.00 0.00 175.30 174.84 3gbg n ASN 185 N -0.51 4.97 -4.58 -2.12 5.15 -1.26 -4.95 115.26 111.98 3gbg n ASN 185 Ca 0.07 -2.78 -0.51 0.00 -0.60 0.00 0.00 54.58 50.77 3gbg n ASN 185 Cb 0.43 -1.63 -0.05 0.00 -0.53 0.00 0.00 39.78 38.00 3gbg n ASN 185 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 3gbg n TRP 186 N 5.54 1.31 -4.18 1.20 7.02 -1.26 -5.02 117.44 122.06 3gbg n TRP 186 Ca 0.58 0.69 -0.11 0.00 -1.02 0.00 0.00 57.50 57.64 3gbg n TRP 186 Cb 0.35 -2.28 -0.10 0.00 -2.42 0.00 0.00 31.31 26.86 3gbg n TRP 186 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3gbg s ARG 187 N -0.03 0.87 0.31 -0.99 3.00 -1.26 -5.03 118.95 115.83 3gbg s ARG 187 Ca 0.78 -1.37 0.04 0.00 0.00 0.00 0.00 55.73 55.19 3gbg s ARG 187 Cb -0.92 -0.18 0.65 0.00 0.00 0.00 0.00 34.95 34.50 3gbg s ARG 187 CO 0.50 -0.05 1.87 -1.49 0.00 0.00 0.00 175.30 176.13 3gbg h TRP 188 N 2.92 1.00 -0.86 -0.53 4.06 -1.99 -0.70 115.95 119.85 3gbg h TRP 188 Ca -0.35 0.03 0.07 0.00 2.06 0.00 0.00 58.89 60.69 3gbg h TRP 188 Cb 1.17 -0.32 -0.06 0.00 -1.00 0.00 0.00 29.16 28.96 3gbg h TRP 188 CO 0.57 0.42 0.56 0.00 -3.56 0.00 0.00 178.44 176.43 3gbg h ALA 189 N 1.56 1.59 -0.48 1.49 0.00 -1.99 -0.69 119.26 120.73 3gbg h ALA 189 Ca 0.45 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.25 3gbg h ALA 189 Cb 0.50 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3gbg h ALA 189 CO -0.21 0.28 -0.08 -0.44 0.00 0.00 0.00 179.25 178.79 3gbg h ASP 190 N 0.93 0.90 -0.19 0.00 5.19 -1.54 -1.11 116.42 120.60 3gbg h ASP 190 Ca 0.37 -0.35 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 3gbg h ASP 190 Cb 0.25 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 3gbg h ASP 190 CO -0.14 1.03 0.04 0.40 -3.12 0.00 0.00 179.24 177.45 3gbg h ILE 191 N 0.75 1.21 -0.73 0.35 1.08 -1.00 -0.56 117.51 118.61 3gbg h ILE 191 Ca 0.13 -0.69 -0.05 0.00 -0.39 0.00 0.00 64.86 63.86 3gbg h ILE 191 Cb 0.62 1.30 -0.03 0.00 -3.07 0.00 0.00 36.82 35.64 3gbg h ILE 191 CO 0.04 0.21 0.27 0.00 -0.69 0.00 0.00 178.15 177.99 3gbg h GLY 193 N 1.06 0.71 1.14 0.00 0.00 -1.12 0.15 103.07 105.01 3gbg h GLY 193 Ca 0.24 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 46.88 3gbg h GLY 193 CO -0.02 0.52 -0.20 0.83 0.00 0.00 0.00 176.54 177.67 3gbg h GLU 194 N 0.45 0.99 -0.01 4.80 4.39 -0.99 -3.07 114.58 121.13 3gbg h GLU 194 Ca 0.09 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.38 3gbg h GLU 194 Cb 0.55 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 3gbg h GLU 194 CO 0.03 1.09 -0.08 1.28 -1.16 0.00 0.00 179.01 180.17 3gbg n LEU 195 N -4.11 1.35 -3.89 1.33 4.77 -0.35 -4.94 117.00 111.16 3gbg n LEU 195 Ca 0.00 -0.42 -0.28 0.00 -0.03 0.00 0.00 56.01 55.28 3gbg n LEU 195 Cb 0.45 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 3gbg n LEU 195 CO 0.46 0.23 0.04 0.54 -1.33 0.00 0.00 177.39 177.34 3gbg n ARG 196 N -0.09 -5.13 -3.88 3.23 5.12 0.48 -4.97 116.66 111.43 3gbg n ARG 196 Ca 0.17 0.58 -0.12 0.00 -1.93 0.00 0.00 57.85 56.55 3gbg n ARG 196 Cb 0.35 -5.34 -0.13 0.00 -1.16 0.00 0.00 32.46 26.18 3gbg n ARG 196 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3gbg s THR 197 N -3.42 0.02 0.65 0.55 2.01 -0.86 -5.05 115.64 109.53 3gbg s THR 197 Ca 0.49 -0.18 -0.12 0.00 0.31 0.00 0.00 61.69 62.18 3gbg s THR 197 Cb -0.25 -0.12 -0.02 0.00 0.01 0.00 0.00 72.50 72.13 3gbg s THR 197 CO 0.84 -0.10 1.05 0.54 -0.69 0.00 0.00 174.62 176.25 3gbg s ASN 198 N -0.29 5.68 0.40 3.53 4.22 -1.26 -4.38 114.94 122.83 3gbg s ASN 198 Ca -0.03 1.64 0.13 0.00 -2.14 0.00 0.00 52.86 52.45 3gbg s ASN 198 Cb -0.02 -2.50 0.83 0.00 1.28 0.00 0.00 41.25 40.83 3gbg s ASN 198 CO -0.00 -1.24 1.90 -0.09 -2.04 0.00 0.00 177.10 175.63 3gbg h ARG 199 N -0.27 0.04 0.00 3.55 2.43 -1.96 -2.35 114.38 115.82 3gbg h ARG 199 Ca -0.45 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.68 3gbg h ARG 199 Cb 1.21 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.75 3gbg h ARG 199 CO 0.58 0.31 -0.13 0.52 -1.51 0.00 0.00 179.97 179.74 3gbg h MET 200 N 0.04 0.00 0.13 0.20 2.86 -2.00 0.22 114.93 116.38 3gbg h MET 200 Ca 0.01 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.31 3gbg h MET 200 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 3gbg h MET 200 CO 0.04 0.13 -1.77 0.82 1.06 0.00 0.00 176.91 177.18 3gbg h ILE 201 N 0.00 0.87 0.00 -1.22 2.04 -1.84 -3.39 117.51 113.97 3gbg h ILE 201 Ca -0.00 -2.55 -0.19 0.00 1.00 0.00 0.00 64.86 63.12 3gbg h ILE 201 Cb 0.23 2.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 3gbg h ILE 201 CO 0.02 0.82 -0.89 -0.07 0.00 0.00 0.00 178.15 178.03 3gbg h LEU 202 N 0.07 0.00 -2.00 1.44 3.38 -1.18 -3.34 115.31 113.68 3gbg h LEU 202 Ca -0.34 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.70 3gbg h LEU 202 Cb 2.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.79 3gbg h LEU 202 CO 0.13 0.89 0.38 0.07 0.09 0.00 0.00 178.44 180.00 3gbg h LYS 203 N 0.00 0.00 -0.30 1.13 2.10 -0.75 -1.25 116.57 117.50 3gbg h LYS 203 Ca -0.01 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.62 3gbg h LYS 203 Cb 1.64 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.95 3gbg h LYS 203 CO 0.12 0.00 0.10 1.57 -2.00 0.00 0.00 179.45 179.23 3gbg h LYS 204 N 0.00 0.43 -0.95 0.07 2.10 -1.82 -1.55 116.57 114.85 3gbg h LYS 204 Ca 0.11 -0.05 0.02 0.00 -2.00 0.00 0.00 60.65 58.73 3gbg h LYS 204 Cb 0.88 -0.08 -0.05 0.00 -0.90 0.00 0.00 32.23 32.08 3gbg h LYS 204 CO -0.00 0.38 0.63 0.93 -2.00 0.00 0.00 179.45 179.39 3gbg h GLU 205 N 0.43 1.22 0.23 0.07 4.39 -1.51 -0.88 114.58 118.54 3gbg h GLU 205 Ca 0.10 -0.07 -0.30 0.00 0.34 0.00 0.00 59.36 59.43 3gbg h GLU 205 Cb 0.13 -0.28 0.04 0.00 -0.10 0.00 0.00 28.75 28.54 3gbg h GLU 205 CO -0.01 0.81 -1.33 -0.07 -1.16 0.00 0.00 179.01 177.25 3gbg h LEU 206 N 1.26 0.77 0.05 1.33 4.07 -1.62 -3.26 115.31 117.91 3gbg h LEU 206 Ca 0.36 -0.93 0.00 0.00 0.08 0.00 0.00 57.88 57.40 3gbg h LEU 206 Cb -0.09 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.39 3gbg h LEU 206 CO -0.09 1.64 -0.05 -0.33 -1.08 0.00 0.00 178.44 178.53 3gbg h GLU 207 N 0.04 -0.11 -0.01 1.13 5.08 -1.13 -0.67 114.58 118.90 3gbg h GLU 207 Ca -0.23 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 3gbg h GLU 207 Cb 2.06 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 31.33 3gbg h GLU 207 CO 0.25 -0.08 0.02 0.66 -1.00 0.00 0.00 179.01 178.87 3gbg h SER 208 N -0.12 0.00 -0.41 1.42 4.64 -1.30 0.18 113.55 117.96 3gbg h SER 208 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3gbg h SER 208 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3gbg h SER 208 CO -0.02 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.48 3gbg n ARG 209 N -3.36 2.49 -3.74 4.77 1.74 -0.65 -4.98 116.66 112.92 3gbg n ARG 209 Ca -0.03 -2.29 -0.27 0.00 -0.77 0.00 0.00 57.85 54.49 3gbg n ARG 209 Cb 0.10 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.09 3gbg n ARG 209 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gbg n GLY 210 N 1.45 -0.52 3.07 -0.13 0.00 0.64 -4.88 105.19 104.82 3gbg n GLY 210 Ca 0.19 0.22 -0.15 0.00 0.00 0.00 0.00 46.02 46.28 3gbg n GLY 210 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gbg s VAL 211 N -3.30 0.70 0.58 1.61 -7.23 -0.74 -5.03 120.40 106.98 3gbg s VAL 211 Ca 0.62 -0.96 -0.03 0.00 -1.81 0.00 0.00 61.98 59.81 3gbg s VAL 211 Cb -0.30 -0.70 0.03 0.00 0.56 0.00 0.00 36.38 35.97 3gbg s VAL 211 CO 0.77 -0.21 0.84 -0.54 -0.31 0.00 0.00 175.10 175.65 3gbg s LYS 212 N -1.29 2.65 0.17 4.82 1.02 -1.26 -4.37 119.74 121.48 3gbg s LYS 212 Ca -0.05 -0.40 -0.16 0.00 0.02 0.00 0.00 55.97 55.38 3gbg s LYS 212 Cb -0.08 -2.37 0.11 0.00 -0.52 0.00 0.00 37.83 34.97 3gbg s LYS 212 CO 0.01 -0.75 1.67 0.35 -0.92 0.00 0.00 175.35 175.70 3gbg h PHE 213 N -0.09 -0.19 -0.40 3.18 3.57 -2.00 -1.65 116.94 119.36 3gbg h PHE 213 Ca -0.44 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.17 3gbg h PHE 213 Cb 1.28 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 40.10 3gbg h PHE 213 CO 0.40 -0.17 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.21 3gbg h ARG 214 N 0.02 0.09 -0.61 1.11 2.43 -1.96 -1.80 114.38 113.65 3gbg h ARG 214 Ca 0.20 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 3gbg h ARG 214 Cb 0.31 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 3gbg h ARG 214 CO -0.42 0.06 0.32 0.93 -1.51 0.00 0.00 179.97 179.35 3gbg h GLU 215 N 0.09 0.85 -0.10 0.20 3.07 -1.79 -1.01 114.58 115.89 3gbg h GLU 215 Ca 0.20 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.95 3gbg h GLU 215 Cb 0.29 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.03 3gbg h GLU 215 CO -0.35 0.64 -0.00 1.25 -1.40 0.00 0.00 179.01 179.15 3gbg h LEU 216 N 0.86 0.17 -0.27 1.33 5.85 -0.55 -0.50 115.31 122.18 3gbg h LEU 216 Ca 0.22 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3gbg h LEU 216 Cb 0.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3gbg h LEU 216 CO -0.03 0.45 0.12 0.40 -0.34 0.00 0.00 178.44 179.04 3gbg h ILE 217 N -0.12 1.16 -0.75 4.05 1.08 -1.17 -2.00 117.51 119.76 3gbg h ILE 217 Ca 0.03 -0.47 0.05 0.00 -0.39 0.00 0.00 64.86 64.08 3gbg h ILE 217 Cb 0.37 0.97 -0.05 0.00 -3.07 0.00 0.00 36.82 35.03 3gbg h ILE 217 CO 0.01 0.16 0.45 0.78 -0.69 0.00 0.00 178.15 178.86 3gbg h ASN 218 N 0.30 0.70 -0.72 1.72 2.35 -1.17 -0.97 115.58 117.79 3gbg h ASN 218 Ca 0.09 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3gbg h ASN 218 Cb 0.15 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.35 3gbg h ASN 218 CO -0.01 0.46 0.45 0.77 -1.65 0.00 0.00 177.43 177.45 3gbg h SER 219 N 0.83 0.86 -0.65 5.81 4.64 -0.77 -0.36 113.55 123.91 3gbg h SER 219 Ca 0.32 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.51 3gbg h SER 219 Cb 0.14 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 3gbg h SER 219 CO -0.16 0.65 0.09 0.40 -0.87 0.00 0.00 176.83 176.94 3gbg h ILE 220 N 0.98 1.26 -0.52 0.95 2.04 -0.84 -2.40 117.51 118.98 3gbg h ILE 220 Ca 0.26 -1.06 -0.08 0.00 1.00 0.00 0.00 64.86 64.98 3gbg h ILE 220 Cb -0.06 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 3gbg h ILE 220 CO -0.05 0.39 0.00 0.03 0.00 0.00 0.00 178.15 178.52 3gbg h ARG 221 N 1.01 0.89 -0.25 2.37 3.08 -0.71 -1.35 114.38 119.42 3gbg h ARG 221 Ca 0.20 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3gbg h ARG 221 Cb 0.46 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 3gbg h ARG 221 CO 0.02 0.88 0.05 0.82 -1.07 0.00 0.00 179.97 180.67 3gbg h ILE 222 N 0.82 1.22 -0.06 2.04 1.08 -0.88 -0.16 117.51 121.56 3gbg h ILE 222 Ca 0.16 -0.72 -0.04 0.00 -0.39 0.00 0.00 64.86 63.87 3gbg h ILE 222 Cb 0.49 1.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.44 3gbg h ILE 222 CO 0.02 0.23 -0.12 0.28 -0.69 0.00 0.00 178.15 177.87 3gbg h SER 223 N 0.23 0.09 -0.58 1.72 0.02 -1.29 -0.87 113.55 112.87 3gbg h SER 223 Ca 0.08 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 3gbg h SER 223 Cb 0.29 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 3gbg h SER 223 CO 0.00 0.23 -0.03 0.22 -1.14 0.00 0.00 176.83 176.11 3gbg h TYR 224 N 0.09 1.15 -0.19 3.45 5.03 -0.78 -1.62 116.97 124.10 3gbg h TYR 224 Ca 0.02 -0.21 -0.08 0.00 2.58 0.00 0.00 58.73 61.04 3gbg h TYR 224 Cb 0.28 -0.29 -0.01 0.00 1.55 0.00 0.00 36.73 38.26 3gbg h TYR 224 CO 0.00 1.03 -0.21 0.66 -1.32 0.00 0.00 178.16 178.32 3gbg h SER 225 N 0.94 0.34 -0.22 -2.11 4.64 0.27 -1.72 113.55 115.68 3gbg h SER 225 Ca 0.16 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 3gbg h SER 225 Cb 0.59 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3gbg h SER 225 CO 0.04 0.56 -0.02 0.40 -0.87 0.00 0.00 176.83 176.94 3gbg h ILE 226 N 0.31 1.26 -0.96 0.95 2.04 -0.89 -1.52 117.51 118.72 3gbg h ILE 226 Ca 0.05 -0.93 0.09 0.00 1.00 0.00 0.00 64.86 65.07 3gbg h ILE 226 Cb 0.55 1.44 -0.07 0.00 -0.74 0.00 0.00 36.82 38.01 3gbg h ILE 226 CO 0.04 0.29 0.62 0.28 0.00 0.00 0.00 178.15 179.37 3gbg h SER 227 N 0.15 0.92 -0.43 1.72 0.02 -0.98 -1.21 113.55 113.74 3gbg h SER 227 Ca 0.06 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 3gbg h SER 227 Cb 0.43 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 3gbg h SER 227 CO 0.01 0.55 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.15 3gbg h LEU 228 N 1.02 0.76 -1.80 5.07 4.07 -1.08 -2.66 115.31 120.69 3gbg h LEU 228 Ca 0.44 -0.32 -0.03 0.00 0.08 0.00 0.00 57.88 58.04 3gbg h LEU 228 Cb 0.33 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.86 3gbg h LEU 228 CO -0.19 0.90 -0.15 0.24 -1.08 0.00 0.00 178.44 178.16 3gbg h MET 229 N 0.61 0.00 0.00 1.13 2.86 -0.40 -2.24 114.93 116.89 3gbg h MET 229 Ca 0.12 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.69 3gbg h MET 229 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 3gbg h MET 229 CO 0.03 0.15 -0.32 0.87 1.06 0.00 0.00 176.91 178.70 3gbg h LYS 230 N 0.00 0.00 0.00 1.72 1.57 -0.91 -3.15 116.57 115.79 3gbg h LYS 230 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gbg h LYS 230 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3gbg h LYS 230 CO 0.02 0.32 0.00 1.79 -0.57 0.00 0.00 179.45 181.01 3gbg h THR 231 N 0.00 0.00 0.00 -0.16 1.35 -1.20 -3.46 112.91 109.44 3gbg h THR 231 Ca -0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3gbg h THR 231 Cb 1.02 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 3gbg h THR 231 CO 0.04 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 3gbg n GLY 232 N 0.72 1.82 3.67 5.82 0.00 -1.19 -5.11 105.19 110.92 3gbg n GLY 232 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 3gbg n GLY 232 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gbg s GLU 233 N 0.00 4.20 -0.01 1.61 2.02 -1.20 -4.94 118.70 120.39 3gbg s GLU 233 Ca 0.00 0.30 0.07 0.00 0.02 0.00 0.00 54.97 55.36 3gbg s GLU 233 Cb 0.00 -3.53 -0.10 0.00 0.10 0.00 0.00 34.13 30.60 3gbg s GLU 233 CO 0.00 -0.05 0.18 1.97 0.02 0.00 0.00 175.26 177.38 3gbg n PHE 234 N 4.48 0.00 -2.06 1.61 -1.74 -1.26 -4.39 117.46 114.11 3gbg n PHE 234 Ca -0.07 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.52 3gbg n PHE 234 Cb 0.51 -0.12 -0.04 0.00 1.52 0.00 0.00 39.48 41.34 3gbg n PHE 234 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 3gbg s LYS 235 N -2.30 2.60 0.25 3.97 2.47 -1.26 -4.82 119.74 120.65 3gbg s LYS 235 Ca -0.01 -0.04 -0.03 0.00 -1.56 0.00 0.00 55.97 54.33 3gbg s LYS 235 Cb 0.05 -4.86 0.51 0.00 -1.46 0.00 0.00 37.83 32.06 3gbg s LYS 235 CO 0.29 -3.16 1.72 0.82 0.16 0.00 0.00 175.35 175.18 3gbg h ILE 236 N 7.14 0.62 -0.65 5.43 1.08 -1.99 -0.90 117.51 128.24 3gbg h ILE 236 Ca -0.01 -0.15 0.04 0.00 -0.39 0.00 0.00 64.86 64.35 3gbg h ILE 236 Cb 1.05 0.14 -0.05 0.00 -3.07 0.00 0.00 36.82 34.90 3gbg h ILE 236 CO 1.22 0.08 0.38 0.11 -0.69 0.00 0.00 178.15 179.25 3gbg h LYS 237 N 0.44 0.71 -0.44 2.37 1.79 -1.99 -1.69 116.57 117.75 3gbg h LYS 237 Ca 0.44 -0.04 -0.14 0.00 -2.18 0.00 0.00 60.65 58.73 3gbg h LYS 237 Cb 0.70 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 3gbg h LYS 237 CO -0.43 0.47 -0.26 0.37 -1.08 0.00 0.00 179.45 178.52 3gbg h GLN 238 N 0.73 0.95 -0.74 3.15 4.15 -1.66 -3.10 115.11 118.60 3gbg h GLN 238 Ca 0.28 -0.43 0.01 0.00 0.77 0.00 0.00 58.65 59.27 3gbg h GLN 238 Cb 0.10 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.74 3gbg h GLN 238 CO -0.14 1.10 0.49 0.82 -1.93 0.00 0.00 178.83 179.17 3gbg h ILE 239 N 0.79 1.18 0.05 2.39 2.04 -0.69 0.04 117.51 123.30 3gbg h ILE 239 Ca 0.09 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.63 3gbg h ILE 239 Cb 0.84 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3gbg h ILE 239 CO 0.07 0.18 -0.13 0.00 0.00 0.00 0.00 178.15 178.27 3gbg h ALA 240 N 1.54 -0.19 -0.04 1.87 0.00 -1.24 -1.21 119.26 119.99 3gbg h ALA 240 Ca 0.28 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 3gbg h ALA 240 Cb -0.08 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3gbg h ALA 240 CO -0.06 -0.63 -0.81 1.88 0.00 0.00 0.00 179.25 179.62 3gbg h TYR 241 N -0.24 0.52 0.00 0.00 -1.99 -1.54 -2.43 116.97 111.28 3gbg h TYR 241 Ca 0.03 -0.25 -0.02 0.00 2.00 0.00 0.00 58.73 60.49 3gbg h TYR 241 Cb 0.27 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 38.93 3gbg h TYR 241 CO -0.16 1.03 -0.10 0.37 -0.00 0.00 0.00 178.16 179.29 3gbg h GLN 242 N 0.23 0.00 -0.24 4.88 5.75 -0.87 -1.81 115.11 123.05 3gbg h GLN 242 Ca -0.05 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3gbg h GLN 242 Cb 1.41 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.96 3gbg h GLN 242 CO 0.14 0.10 0.00 0.43 -2.65 0.00 0.00 178.83 176.85 3gbg n SER 243 N -3.88 1.90 0.00 -0.69 7.64 -0.47 -4.85 113.62 113.28 3gbg n SER 243 Ca -0.02 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 58.05 3gbg n SER 243 Cb 0.20 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 3gbg n SER 243 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gbg n GLY 244 N 1.15 0.72 3.79 0.23 0.00 -0.68 -4.73 105.19 105.67 3gbg n GLY 244 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 3gbg n GLY 244 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gbg s PHE 245 N -2.53 3.63 0.00 1.61 0.08 -0.93 -4.81 117.98 115.04 3gbg s PHE 245 Ca 0.00 1.73 0.27 0.00 0.12 0.00 0.00 56.93 59.06 3gbg s PHE 245 Cb 0.00 -2.89 0.95 0.00 -0.57 0.00 0.00 43.02 40.50 3gbg s PHE 245 CO 0.00 0.17 1.83 0.00 -0.10 0.00 0.00 175.22 177.12 3gbg h ALA 246 N 2.99 0.99 -2.86 5.36 0.00 -1.95 -3.39 119.26 120.40 3gbg h ALA 246 Ca -0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 3gbg h ALA 246 Cb 1.19 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 3gbg h ALA 246 CO 0.64 0.14 0.01 -1.54 0.00 0.00 0.00 179.25 178.50 3gbg s SER 247 N -6.01 -0.23 0.15 0.00 1.04 -1.26 -5.05 113.70 102.34 3gbg s SER 247 Ca 0.02 -0.55 -0.05 0.00 0.48 0.00 0.00 55.95 55.85 3gbg s SER 247 Cb 0.09 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.78 3gbg s SER 247 CO 0.61 -1.07 1.40 0.58 0.98 0.00 0.00 173.24 175.74 3gbg h VAL 248 N 2.21 1.35 -0.39 5.02 2.07 -1.92 -2.78 116.25 121.81 3gbg h VAL 248 Ca -0.28 -2.09 -0.04 0.00 0.82 0.00 0.00 66.70 65.11 3gbg h VAL 248 Cb 1.26 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 33.08 3gbg h VAL 248 CO 0.37 0.64 0.08 0.28 0.02 0.00 0.00 177.57 178.96 3gbg h SER 249 N 0.36 0.61 -0.55 0.57 0.02 -1.99 -0.63 113.55 111.93 3gbg h SER 249 Ca -0.04 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.57 3gbg h SER 249 Cb 1.33 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 3gbg h SER 249 CO 0.14 0.70 -0.05 0.22 -1.14 0.00 0.00 176.83 176.70 3gbg h TYR 250 N 0.49 1.13 0.04 3.45 3.20 -1.97 -0.17 116.97 123.14 3gbg h TYR 250 Ca 0.12 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.79 3gbg h TYR 250 Cb 0.34 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3gbg h TYR 250 CO 0.02 1.02 -0.06 0.35 -1.64 0.00 0.00 178.16 177.84 3gbg h PHE 251 N 0.93 -0.16 -0.92 -3.82 3.57 -1.30 -0.53 116.94 114.71 3gbg h PHE 251 Ca 0.16 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3gbg h PHE 251 Cb 0.60 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 3gbg h PHE 251 CO 0.04 -0.10 0.53 0.77 -2.23 0.00 0.00 178.31 177.32 3gbg h SER 252 N -0.13 1.12 -0.19 0.41 0.02 -0.89 0.19 113.55 114.09 3gbg h SER 252 Ca 0.01 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 3gbg h SER 252 Cb 0.14 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3gbg h SER 252 CO -0.04 0.88 0.06 0.74 -1.14 0.00 0.00 176.83 177.33 3gbg h THR 253 N 1.28 1.19 -0.54 -2.27 2.02 -0.75 -0.41 112.91 113.43 3gbg h THR 253 Ca 0.33 -0.60 -0.10 0.00 0.77 0.00 0.00 66.41 66.81 3gbg h THR 253 Cb -0.02 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 3gbg h THR 253 CO -0.06 0.19 -0.03 0.58 0.37 0.00 0.00 175.52 176.57 3gbg h VAL 254 N 0.13 1.27 -0.09 3.16 2.07 -0.84 -1.40 116.25 120.55 3gbg h VAL 254 Ca 0.06 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 3gbg h VAL 254 Cb 0.24 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 3gbg h VAL 254 CO -0.00 0.41 0.05 0.15 0.02 0.00 0.00 177.57 178.21 3gbg h PHE 255 N 0.86 0.11 -0.77 1.57 3.04 -0.48 -0.86 116.94 120.41 3gbg h PHE 255 Ca 0.15 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.09 3gbg h PHE 255 Cb 0.58 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 39.02 3gbg h PHE 255 CO 0.04 0.10 0.45 -0.22 -2.02 0.00 0.00 178.31 176.67 3gbg h LYS 256 N 0.09 1.05 -0.05 1.11 1.63 -0.98 0.25 116.57 119.67 3gbg h LYS 256 Ca 0.03 -0.10 -0.09 0.00 -0.85 0.00 0.00 60.65 59.65 3gbg h LYS 256 Cb 0.02 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.42 3gbg h LYS 256 CO -0.01 0.74 -0.37 1.03 -3.45 0.00 0.00 179.45 177.39 3gbg h SER 257 N 1.07 0.11 0.08 4.20 0.87 -0.90 0.20 113.55 119.17 3gbg h SER 257 Ca 0.28 -0.04 -0.24 0.00 -1.23 0.00 0.00 61.79 60.56 3gbg h SER 257 Cb -0.03 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3gbg h SER 257 CO -0.05 0.47 -1.25 0.74 -0.53 0.00 0.00 176.83 176.22 3gbg h THR 258 N 0.09 1.08 -0.00 2.23 2.02 -0.33 -3.38 112.91 114.61 3gbg h THR 258 Ca 0.01 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.84 3gbg h THR 258 Cb 0.71 2.69 0.00 0.00 -1.74 0.00 0.00 68.15 69.80 3gbg h THR 258 CO 0.05 0.62 -0.81 0.23 0.37 0.00 0.00 175.52 175.99 3gbg n MET 259 N -4.08 0.59 -1.22 6.66 2.81 0.81 -1.49 117.12 121.20 3gbg n MET 259 Ca -0.25 -0.30 -0.08 0.00 -1.81 0.00 0.00 57.70 55.27 3gbg n MET 259 Cb 0.82 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.84 3gbg n MET 259 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3gbg n ASN 260 N -1.04 -5.11 -4.06 7.83 5.15 0.69 -4.57 115.26 114.16 3gbg n ASN 260 Ca 0.05 0.19 -0.08 0.00 -0.60 0.00 0.00 54.58 54.14 3gbg n ASN 260 Cb 0.36 -3.27 -0.09 0.00 -0.53 0.00 0.00 39.78 36.25 3gbg n ASN 260 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3gbg s VAL 261 N -1.88 0.15 0.51 3.44 -7.23 -1.25 -4.96 120.40 109.18 3gbg s VAL 261 Ca 0.00 -1.71 -0.17 0.00 -1.81 0.00 0.00 61.98 58.29 3gbg s VAL 261 Cb 0.00 -1.71 -0.08 0.00 0.56 0.00 0.00 36.38 35.15 3gbg s VAL 261 CO 0.00 -0.69 0.99 0.00 -0.31 0.00 0.00 175.10 175.09 3gbg s ALA 262 N -3.96 3.04 0.17 1.32 0.00 -1.26 -3.55 121.76 117.51 3gbg s ALA 262 Ca 0.14 0.22 -0.17 0.00 0.00 0.00 0.00 51.96 52.15 3gbg s ALA 262 Cb 0.07 -3.13 0.10 0.00 0.00 0.00 0.00 23.12 20.16 3gbg s ALA 262 CO -0.05 -0.25 1.67 -1.35 0.00 0.00 0.00 175.76 175.78 3gbg h PRO 263 N 0.96 0.01 -0.45 0.00 0.11 -1.92 -0.76 132.00 129.94 3gbg h PRO 263 Ca -0.47 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3gbg h PRO 263 Cb 1.19 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 3gbg h PRO 263 CO 0.61 0.00 0.25 0.66 -0.21 0.00 0.00 178.00 179.32 3gbg h SER 264 N 0.01 0.54 -0.35 -2.05 4.64 -1.97 -1.07 113.55 113.30 3gbg h SER 264 Ca 0.20 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.44 3gbg h SER 264 Cb 0.30 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 3gbg h SER 264 CO -0.42 0.43 0.05 -0.33 -0.87 0.00 0.00 176.83 175.70 3gbg h GLU 265 N 0.62 0.58 -0.43 4.77 5.08 -1.56 -1.86 114.58 121.78 3gbg h GLU 265 Ca 0.16 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3gbg h GLU 265 Cb 0.01 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3gbg h GLU 265 CO -0.03 0.66 0.14 -0.92 -1.00 0.00 0.00 179.01 177.86 3gbg h TYR 266 N 0.42 0.69 -0.79 4.33 5.03 -0.61 -2.43 116.97 123.61 3gbg h TYR 266 Ca 0.11 -0.07 0.12 0.00 2.58 0.00 0.00 58.73 61.47 3gbg h TYR 266 Cb 0.36 -0.20 -0.08 0.00 1.55 0.00 0.00 36.73 38.36 3gbg h TYR 266 CO 0.02 0.63 0.40 1.25 -1.32 0.00 0.00 178.16 179.14 3gbg h LEU 267 N 0.55 0.50 -1.29 2.82 5.85 -1.08 0.90 115.31 123.56 3gbg h LEU 267 Ca 0.14 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 3gbg h LEU 267 Cb 0.26 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 3gbg h LEU 267 CO -0.00 0.24 0.26 0.15 -0.34 0.00 0.00 178.44 178.75 3gbg h PHE 268 N 0.62 0.73 0.00 1.25 3.04 -0.99 -0.70 116.94 120.88 3gbg h PHE 268 Ca 0.41 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.34 3gbg h PHE 268 Cb 0.52 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.79 3gbg h PHE 268 CO -0.10 0.54 0.00 0.52 -2.02 0.00 0.00 178.31 177.25 3gbg h MET 269 N 0.75 0.00 0.00 1.11 0.00 -0.36 -2.03 114.93 114.40 3gbg h MET 269 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.89 3gbg h MET 269 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.67 3gbg h MET 269 CO -0.03 0.00 0.00 1.28 0.00 0.00 0.00 176.91 178.16 3gbg n LEU 270 N -2.60 0.00 -0.08 1.22 4.77 -0.27 -3.65 117.00 116.38 3gbg n LEU 270 Ca 0.01 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 3gbg n LEU 270 Cb 0.23 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.25 3gbg n LEU 270 CO 0.22 0.00 -0.27 0.74 -1.33 0.00 0.00 177.39 176.74 3gbg h THR 271 N 0.00 0.64 0.00 -5.08 2.02 -1.50 -3.51 112.91 105.48 3gbg h THR 271 Ca 0.00 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 65.49 3gbg h THR 271 Cb 0.00 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 3gbg h THR 271 CO 0.00 0.22 0.00 0.61 0.37 0.00 0.00 175.52 176.72 3gbg n GLY 272 N 1.56 -1.68 0.55 2.16 0.00 -1.24 -5.12 105.19 101.42 3gbg n GLY 272 Ca -0.17 -1.21 0.07 0.00 0.00 0.00 0.00 46.02 44.70 3gbg n GLY 272 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87