#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gbr n SER -7 N 0.00 -4.09 0.07 1.61 2.88 -1.26 -5.03 113.62 107.80 1gbr n SER -7 Ca 0.00 1.39 0.00 0.00 -1.33 0.00 0.00 58.87 58.93 1gbr n SER -7 Cb 0.00 -5.29 0.00 0.00 -0.75 0.00 0.00 64.21 58.17 1gbr n SER -7 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1gbr n ARG -6 N 1.21 0.00 -2.76 -1.46 1.74 -1.26 -5.11 116.66 109.01 1gbr n ARG -6 Ca -0.22 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.82 1gbr n ARG -6 Cb 0.34 -0.03 0.01 0.00 -1.02 0.00 0.00 32.46 31.75 1gbr n ARG -6 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1gbr n ARG -5 N -2.99 -2.79 -3.89 5.56 3.00 -1.26 -5.05 116.66 109.24 1gbr n ARG -5 Ca 0.00 2.36 -0.04 0.00 -0.00 0.00 0.00 57.85 60.17 1gbr n ARG -5 Cb 0.00 -5.47 0.02 0.00 0.00 0.00 0.00 32.46 27.02 1gbr n ARG -5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1gbr s ALA -4 N -2.17 -1.48 -0.05 5.13 0.00 -1.26 -5.10 121.76 116.83 1gbr s ALA -4 Ca 0.14 -0.44 -0.04 0.00 0.00 0.00 0.00 51.96 51.62 1gbr s ALA -4 Cb -0.04 0.77 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 1gbr s ALA -4 CO 0.76 -1.06 -0.08 0.45 0.00 0.00 0.00 175.76 175.83 1gbr n SER -3 N -1.32 0.64 -4.20 0.00 2.88 -1.26 -5.01 113.62 105.35 1gbr n SER -3 Ca -0.03 0.29 -0.23 0.00 -1.33 0.00 0.00 58.87 57.57 1gbr n SER -3 Cb 0.59 -0.61 -0.14 0.00 -0.75 0.00 0.00 64.21 63.30 1gbr n SER -3 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1gbr s VAL -2 N -1.51 1.42 0.00 2.46 -7.23 -1.26 -5.04 120.40 109.24 1gbr s VAL -2 Ca -0.07 -1.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.97 1gbr s VAL -2 Cb 0.01 -1.25 0.00 0.00 0.56 0.00 0.00 36.38 35.69 1gbr s VAL -2 CO 0.10 0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1gbr n GLY -1 N 1.83 -1.80 3.94 2.32 0.00 -1.26 -5.17 105.19 105.04 1gbr n GLY -1 Ca -0.18 0.69 -0.26 0.00 0.00 0.00 0.00 46.02 46.27 1gbr n GLY -1 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gbr s SER 0 N 0.00 4.52 0.47 1.61 1.04 -1.26 -5.10 113.70 114.98 1gbr s SER 0 Ca 0.00 0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.77 1gbr s SER 0 Cb 0.00 -0.86 0.01 0.00 0.10 0.00 0.00 66.02 65.28 1gbr s SER 0 CO 0.00 -1.79 0.11 0.23 0.98 0.00 0.00 173.24 172.78 1gbr n MET 1 N -3.03 0.84 -4.62 4.02 2.81 -1.20 -4.97 117.12 110.98 1gbr n MET 1 Ca 0.10 -3.28 -0.28 0.00 -1.81 0.00 0.00 57.70 52.42 1gbr n MET 1 Cb 0.60 0.72 -0.09 0.00 -0.71 0.00 0.00 33.22 33.75 1gbr n MET 1 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1gbr s GLU 2 N -3.78 2.00 -0.28 0.03 2.12 -1.03 -0.56 118.70 117.20 1gbr s GLU 2 Ca 0.09 -2.22 -0.06 0.00 0.36 0.00 0.00 54.97 53.15 1gbr s GLU 2 Cb -0.01 -1.19 0.15 0.00 0.26 0.00 0.00 34.13 33.34 1gbr s GLU 2 CO 0.06 -0.31 0.57 0.00 -0.54 0.00 0.00 175.26 175.04 1gbr s ALA 3 N -3.01 -1.91 0.06 6.30 0.00 -0.81 -1.30 121.76 121.09 1gbr s ALA 3 Ca 0.21 1.92 -0.30 0.00 0.00 0.00 0.00 51.96 53.78 1gbr s ALA 3 Cb 0.04 -1.85 -0.09 0.00 0.00 0.00 0.00 23.12 21.22 1gbr s ALA 3 CO 0.11 -1.08 1.93 -1.50 0.00 0.00 0.00 175.76 175.21 1gbr s ILE 4 N 2.81 2.91 -0.69 0.00 2.07 0.18 -1.78 121.20 126.69 1gbr s ILE 4 Ca 0.06 0.04 -0.27 0.00 -1.41 0.00 0.00 60.65 59.08 1gbr s ILE 4 Cb -0.13 -3.03 0.00 0.00 0.13 0.00 0.00 42.46 39.43 1gbr s ILE 4 CO -0.19 -0.00 1.60 0.00 -1.91 0.00 0.00 174.94 174.44 1gbr s ALA 5 N 4.01 2.42 0.53 1.50 0.00 -1.24 -1.13 121.76 127.86 1gbr s ALA 5 Ca 0.86 -1.05 0.20 0.00 0.00 0.00 0.00 51.96 51.98 1gbr s ALA 5 Cb -0.43 -4.30 1.36 0.00 0.00 0.00 0.00 23.12 19.75 1gbr s ALA 5 CO 0.40 -3.65 2.10 0.87 0.00 0.00 0.00 175.76 175.48 1gbr h LYS 6 N 12.51 0.00 0.00 0.00 1.57 -1.04 -1.99 116.57 127.62 1gbr h LYS 6 Ca -0.24 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.41 1gbr h LYS 6 Cb 1.10 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.38 1gbr h LYS 6 CO 1.25 0.00 -0.09 0.66 -0.57 0.00 0.00 179.45 180.70 1gbr n TYR 7 N -4.41 -0.70 -2.84 -1.35 4.02 -1.22 -4.66 117.16 106.00 1gbr n TYR 7 Ca 0.01 -0.96 -0.25 0.00 -0.01 0.00 0.00 57.90 56.70 1gbr n TYR 7 Cb 0.27 0.19 0.01 0.00 -0.02 0.00 0.00 39.34 39.79 1gbr n TYR 7 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1gbr s ASP 8 N -1.86 5.99 -0.23 7.72 -4.77 -1.26 -3.14 116.67 119.12 1gbr s ASP 8 Ca 0.12 0.58 -0.33 0.00 -3.30 0.00 0.00 52.55 49.63 1gbr s ASP 8 Cb -0.00 -1.86 0.16 0.00 -1.09 0.00 0.00 42.92 40.12 1gbr s ASP 8 CO 0.09 -0.66 1.25 0.12 0.70 0.00 0.00 175.17 176.67 1gbr s PHE 9 N -2.65 -0.11 0.06 2.11 2.19 -0.77 -4.84 117.98 113.97 1gbr s PHE 9 Ca 0.48 0.13 0.07 0.00 0.33 0.00 0.00 56.93 57.93 1gbr s PHE 9 Cb -0.10 0.50 -0.03 0.00 -1.31 0.00 0.00 43.02 42.08 1gbr s PHE 9 CO 0.41 -0.14 -0.19 0.15 1.83 0.00 0.00 175.22 177.28 1gbr s LYS 10 N -1.80 1.17 0.18 10.12 1.02 -1.26 -1.69 119.74 127.48 1gbr s LYS 10 Ca 0.08 -0.96 -0.33 0.00 0.02 0.00 0.00 55.97 54.78 1gbr s LYS 10 Cb -0.01 -1.29 -0.14 0.00 -0.52 0.00 0.00 37.83 35.87 1gbr s LYS 10 CO -0.05 0.32 1.56 0.00 -0.92 0.00 0.00 175.35 176.27 1gbr n ALA 11 N 1.62 1.47 -0.03 5.17 0.00 -0.75 -4.79 120.51 123.19 1gbr n ALA 11 Ca -0.18 0.44 -0.08 0.00 0.00 0.00 0.00 53.44 53.61 1gbr n ALA 11 Cb 0.54 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 1gbr n ALA 11 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1gbr n THR 12 N 3.21 0.76 -0.85 0.00 -2.24 -1.26 -4.91 114.28 108.98 1gbr n THR 12 Ca 0.16 -0.01 -0.29 0.00 -2.27 0.00 0.00 64.05 61.64 1gbr n THR 12 Cb 0.30 -1.69 0.24 0.00 -2.10 0.00 0.00 70.33 67.07 1gbr n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gbr s ALA 13 N -2.22 0.16 -1.50 6.98 0.00 -1.26 -4.87 121.76 119.05 1gbr s ALA 13 Ca -0.13 -0.67 0.22 0.00 0.00 0.00 0.00 51.96 51.38 1gbr s ALA 13 Cb 0.04 -3.00 1.13 0.00 0.00 0.00 0.00 23.12 21.29 1gbr s ALA 13 CO 0.16 -3.72 1.70 -3.47 0.00 0.00 0.00 175.76 170.43 1gbr n ASP 14 N -4.88 0.00 -1.91 0.00 2.03 -1.26 -3.04 116.55 107.50 1gbr n ASP 14 Ca 0.09 -0.11 0.02 0.00 0.52 0.00 0.00 54.79 55.32 1gbr n ASP 14 Cb 0.58 -0.25 0.04 0.00 -0.72 0.00 0.00 41.12 40.77 1gbr n ASP 14 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1gbr n ASP 15 N -1.25 1.30 -4.93 1.67 8.00 -1.26 -5.10 116.55 114.98 1gbr n ASP 15 Ca 0.11 -2.12 -0.20 0.00 0.71 0.00 0.00 54.79 53.29 1gbr n ASP 15 Cb 0.16 -0.37 0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1gbr n ASP 15 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1gbr s GLU 16 N -1.45 2.38 0.06 -1.24 2.12 -1.17 -1.89 118.70 117.51 1gbr s GLU 16 Ca 0.32 -1.12 0.08 0.00 0.36 0.00 0.00 54.97 54.62 1gbr s GLU 16 Cb 0.37 -2.55 -0.03 0.00 0.26 0.00 0.00 34.13 32.18 1gbr s GLU 16 CO -0.12 -0.79 -0.20 -1.17 -0.54 0.00 0.00 175.26 172.44 1gbr s LEU 17 N -4.73 2.52 -0.26 2.70 0.20 -0.31 -4.49 118.68 114.31 1gbr s LEU 17 Ca 0.59 -0.50 -0.06 0.00 0.69 0.00 0.00 54.13 54.85 1gbr s LEU 17 Cb -0.08 -1.46 -0.00 0.00 -0.43 0.00 0.00 46.19 44.21 1gbr s LEU 17 CO 0.38 0.24 0.04 -0.44 -0.29 0.00 0.00 176.35 176.29 1gbr s SER 18 N -1.57 4.91 0.26 3.68 0.01 -1.26 -1.80 113.70 117.93 1gbr s SER 18 Ca 0.15 -0.51 0.02 0.00 1.31 0.00 0.00 55.95 56.91 1gbr s SER 18 Cb -0.10 -1.85 -0.04 0.00 0.21 0.00 0.00 66.02 64.24 1gbr s SER 18 CO 0.06 -0.11 0.16 0.72 0.41 0.00 0.00 173.24 174.47 1gbr s PHE 19 N 1.52 1.45 0.53 2.43 -0.12 -0.68 -4.85 117.98 118.26 1gbr s PHE 19 Ca 0.04 -1.40 0.01 0.00 -0.05 0.00 0.00 56.93 55.54 1gbr s PHE 19 Cb -0.16 -0.73 0.00 0.00 -0.63 0.00 0.00 43.02 41.50 1gbr s PHE 19 CO 0.01 -0.60 0.05 0.15 -0.05 0.00 0.00 175.22 174.79 1gbr s LYS 20 N -3.92 2.23 -0.42 1.99 -0.14 -1.26 -1.84 119.74 116.38 1gbr s LYS 20 Ca 0.38 -2.39 -0.28 0.00 -1.36 0.00 0.00 55.97 52.32 1gbr s LYS 20 Cb 0.06 -1.59 -0.01 0.00 -1.68 0.00 0.00 37.83 34.61 1gbr s LYS 20 CO 0.17 -0.43 1.66 0.50 -0.76 0.00 0.00 175.35 176.49 1gbr s ARG 21 N -3.95 3.28 0.00 1.68 3.52 -1.19 -1.98 118.95 120.32 1gbr s ARG 21 Ca 0.06 1.06 0.00 0.00 -0.13 0.00 0.00 55.73 56.72 1gbr s ARG 21 Cb 0.00 -4.17 0.00 0.00 -1.56 0.00 0.00 34.95 29.22 1gbr s ARG 21 CO 0.03 -1.93 0.00 0.41 -0.81 0.00 0.00 175.30 173.01 1gbr n GLY 22 N 5.36 0.96 3.33 8.12 0.00 -0.75 -4.89 105.19 117.32 1gbr n GLY 22 Ca 0.20 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.75 1gbr n GLY 22 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gbr s ASP 23 N -1.54 6.38 0.27 1.61 2.15 -0.84 -4.84 116.67 119.87 1gbr s ASP 23 Ca 0.00 -2.05 -0.29 0.00 0.43 0.00 0.00 52.55 50.64 1gbr s ASP 23 Cb 0.00 -2.22 -0.10 0.00 -0.30 0.00 0.00 42.92 40.30 1gbr s ASP 23 CO 0.00 -0.80 1.27 -0.63 -0.17 0.00 0.00 175.17 174.85 1gbr s ILE 24 N 1.27 3.03 0.34 4.11 1.01 -1.26 -3.66 121.20 126.03 1gbr s ILE 24 Ca 0.09 0.95 0.04 0.00 0.00 0.00 0.00 60.65 61.73 1gbr s ILE 24 Cb -0.23 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 1gbr s ILE 24 CO -0.01 0.20 0.51 -0.76 0.00 0.00 0.00 174.94 174.88 1gbr s LEU 25 N -1.10 3.98 -0.64 2.97 2.01 -0.74 -4.85 118.68 120.32 1gbr s LEU 25 Ca 0.51 0.09 -0.09 0.00 0.01 0.00 0.00 54.13 54.65 1gbr s LEU 25 Cb -0.37 -2.97 0.17 0.00 0.01 0.00 0.00 46.19 43.03 1gbr s LEU 25 CO 0.45 -0.40 0.51 -0.54 1.01 0.00 0.00 176.35 177.39 1gbr s LYS 26 N -4.25 2.87 -0.26 1.70 1.02 -0.26 -1.92 119.74 118.64 1gbr s LYS 26 Ca 0.43 -2.25 -0.32 0.00 0.02 0.00 0.00 55.97 53.85 1gbr s LYS 26 Cb -0.10 -4.03 -0.08 0.00 -0.52 0.00 0.00 37.83 33.10 1gbr s LYS 26 CO 0.33 -1.22 2.18 0.28 -0.92 0.00 0.00 175.35 176.00 1gbr n VAL 27 N 4.13 0.30 -0.02 3.17 0.31 0.28 -0.68 118.33 125.83 1gbr n VAL 27 Ca 0.04 -0.34 -0.11 0.00 -0.01 0.00 0.00 64.34 63.92 1gbr n VAL 27 Cb 0.42 -2.10 -0.14 0.00 -0.91 0.00 0.00 33.84 31.11 1gbr n VAL 27 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1gbr n LEU 28 N 10.42 1.27 0.00 7.52 4.77 -0.51 -3.26 117.00 137.21 1gbr n LEU 28 Ca 0.34 0.37 -0.06 0.00 -0.03 0.00 0.00 56.01 56.63 1gbr n LEU 28 Cb 0.34 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 1gbr n LEU 28 CO 0.71 0.50 0.57 -3.20 -1.33 0.00 0.00 177.39 174.64 1gbr n ASN 29 N -3.14 -1.92 -2.96 -1.43 2.85 -1.15 -4.99 115.26 102.53 1gbr n ASN 29 Ca -0.20 -2.24 -0.23 0.00 -0.11 0.00 0.00 54.58 51.80 1gbr n ASN 29 Cb 1.05 3.17 -0.03 0.00 1.24 0.00 0.00 39.78 45.21 1gbr n ASN 29 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1gbr n GLU 30 N -0.54 2.38 -2.48 1.20 4.71 -1.26 -1.55 120.64 123.09 1gbr n GLU 30 Ca -0.06 -4.23 -0.24 0.00 -0.01 0.00 0.00 57.16 52.62 1gbr n GLU 30 Cb 0.53 -2.00 0.13 0.00 -1.01 0.00 0.00 31.44 29.09 1gbr n GLU 30 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1gbr n GLU 31 N -0.09 -0.25 0.00 3.49 -0.58 -1.26 -4.92 120.64 117.02 1gbr n GLU 31 Ca 0.28 -2.63 0.00 0.00 -0.42 0.00 0.00 57.16 54.39 1gbr n GLU 31 Cb 0.54 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.66 1gbr n GLU 31 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1gbr n ASP 33 N -1.82 -3.92 -1.16 0.00 2.03 -1.26 -4.83 116.55 105.57 1gbr n ASP 33 Ca 0.00 0.10 0.05 0.00 0.52 0.00 0.00 54.79 55.46 1gbr n ASP 33 Cb 0.00 -0.76 0.22 0.00 -0.72 0.00 0.00 41.12 39.86 1gbr n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1gbr n GLN 34 N 1.24 2.91 -0.00 -0.67 6.02 -1.26 -3.91 117.38 121.71 1gbr n GLN 34 Ca -0.00 -1.76 0.00 0.00 -0.01 0.00 0.00 57.00 55.22 1gbr n GLN 34 Cb 0.63 -1.77 -0.01 0.00 1.02 0.00 0.00 30.24 30.12 1gbr n GLN 34 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1gbr n ASN 35 N 0.49 4.81 -4.60 1.08 4.13 -1.26 -5.00 115.26 114.90 1gbr n ASN 35 Ca 0.16 0.00 -0.34 0.00 1.68 0.00 0.00 54.58 56.07 1gbr n ASN 35 Cb 0.68 0.90 -0.11 0.00 -1.54 0.00 0.00 39.78 39.71 1gbr n ASN 35 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1gbr s TRP 36 N -2.05 3.08 0.07 3.10 0.52 -1.25 -1.61 118.94 120.80 1gbr s TRP 36 Ca -0.00 0.01 -0.05 0.00 0.02 0.00 0.00 56.10 56.07 1gbr s TRP 36 Cb 0.00 -1.84 -0.05 0.00 -1.15 0.00 0.00 33.47 30.44 1gbr s TRP 36 CO 0.03 0.27 0.31 0.71 0.02 0.00 0.00 176.95 178.30 1gbr s TYR 37 N -0.43 3.53 0.05 -1.98 2.02 -0.03 -4.69 117.35 115.83 1gbr s TYR 37 Ca 0.07 0.55 -0.24 0.00 -0.37 0.00 0.00 57.07 57.08 1gbr s TYR 37 Cb -0.12 -1.99 -0.06 0.00 -0.40 0.00 0.00 41.96 39.40 1gbr s TYR 37 CO 0.02 0.53 0.74 0.21 -1.57 0.00 0.00 175.55 175.49 1gbr s LYS 38 N -2.19 4.47 0.05 -0.62 2.20 -0.60 -0.65 119.74 122.40 1gbr s LYS 38 Ca 0.34 1.03 -0.03 0.00 -0.36 0.00 0.00 55.97 56.95 1gbr s LYS 38 Cb -0.13 -3.35 0.01 0.00 -1.51 0.00 0.00 37.83 32.85 1gbr s LYS 38 CO 0.21 0.32 0.13 0.00 -0.36 0.00 0.00 175.35 175.65 1gbr n ALA 39 N 2.70 -0.32 -3.61 3.13 0.00 -0.74 -1.43 120.51 120.24 1gbr n ALA 39 Ca -0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 53.44 53.11 1gbr n ALA 39 Cb 0.50 0.13 -0.08 0.00 0.00 0.00 0.00 19.45 20.01 1gbr n ALA 39 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1gbr s GLU 40 N -2.01 0.73 -0.71 0.00 2.12 0.15 -0.81 118.70 118.17 1gbr s GLU 40 Ca 0.03 1.02 -0.17 0.00 0.36 0.00 0.00 54.97 56.21 1gbr s GLU 40 Cb -0.01 0.27 0.15 0.00 0.26 0.00 0.00 34.13 34.81 1gbr s GLU 40 CO 0.01 -0.12 0.75 -0.51 -0.54 0.00 0.00 175.26 174.85 1gbr s LEU 41 N 0.86 5.95 -0.00 2.70 1.43 0.22 -1.10 118.68 128.73 1gbr s LEU 41 Ca -0.04 -2.00 0.00 0.00 -1.03 0.00 0.00 54.13 51.06 1gbr s LEU 41 Cb -0.05 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.90 1gbr s LEU 41 CO -0.07 -0.88 0.00 0.59 0.23 0.00 0.00 176.35 176.22 1gbr n ASN 42 N 5.38 -0.55 0.00 2.29 3.02 -1.26 -1.91 115.26 122.23 1gbr n ASN 42 Ca 0.02 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 1gbr n ASN 42 Cb 0.44 -0.78 0.00 0.00 -0.61 0.00 0.00 39.78 38.84 1gbr n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gbr n GLY 43 N -0.27 2.63 3.88 7.41 0.00 -1.26 -5.12 105.19 112.46 1gbr n GLY 43 Ca -0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 1gbr n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gbr s LYS 44 N 0.00 3.33 0.31 1.61 3.01 -0.80 -5.06 119.74 122.13 1gbr s LYS 44 Ca 0.00 0.61 -0.05 0.00 -1.01 0.00 0.00 55.97 55.52 1gbr s LYS 44 Cb 0.00 -2.07 0.00 0.00 -1.01 0.00 0.00 37.83 34.75 1gbr s LYS 44 CO 0.00 -0.72 0.47 -0.51 0.51 0.00 0.00 175.35 175.10 1gbr s ASP 45 N -4.24 0.59 0.00 2.83 1.11 -1.26 -0.61 116.67 115.09 1gbr s ASP 45 Ca 0.56 -1.34 0.00 0.00 0.18 0.00 0.00 52.55 51.95 1gbr s ASP 45 Cb -0.11 0.64 0.00 0.00 1.07 0.00 0.00 42.92 44.52 1gbr s ASP 45 CO 0.53 -1.25 0.00 0.61 1.18 0.00 0.00 175.17 176.23 1gbr n GLY 46 N -0.50 3.09 3.70 0.21 0.00 0.01 -4.18 105.19 107.52 1gbr n GLY 46 Ca -0.00 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 1gbr n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gbr s PHE 47 N -2.21 2.12 -0.15 1.61 0.08 -0.79 -1.79 117.98 116.85 1gbr s PHE 47 Ca 0.00 1.48 -0.14 0.00 0.12 0.00 0.00 56.93 58.39 1gbr s PHE 47 Cb 0.00 -3.17 0.04 0.00 -0.57 0.00 0.00 43.02 39.32 1gbr s PHE 47 CO 0.00 -2.46 0.41 0.96 -0.10 0.00 0.00 175.22 174.03 1gbr s ILE 48 N -2.80 0.00 -0.23 0.64 -4.36 0.18 -1.16 121.20 113.46 1gbr s ILE 48 Ca 0.64 -0.01 -0.29 0.00 -0.26 0.00 0.00 60.65 60.73 1gbr s ILE 48 Cb -0.20 -0.58 -0.03 0.00 1.25 0.00 0.00 42.46 42.91 1gbr s ILE 48 CO 0.58 -0.00 1.64 -2.16 0.24 0.00 0.00 174.94 175.23 1gbr s PRO 49 N 0.19 3.75 0.44 0.37 0.04 -1.26 -0.85 135.00 137.68 1gbr s PRO 49 Ca -0.00 1.65 0.25 0.00 0.04 0.00 0.00 61.00 62.94 1gbr s PRO 49 Cb -0.03 -4.05 1.36 0.00 0.04 0.00 0.00 34.50 31.82 1gbr s PRO 49 CO 0.01 -1.35 1.74 -0.22 0.04 0.00 0.00 177.00 177.22 1gbr h LYS 50 N 10.94 0.00 0.00 4.56 3.64 -1.64 -1.55 116.57 132.53 1gbr h LYS 50 Ca -0.34 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.99 1gbr h LYS 50 Cb 1.16 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1gbr h LYS 50 CO 1.00 0.00 -0.25 -0.91 -2.27 0.00 0.00 179.45 177.03 1gbr h ASN 51 N 0.00 0.00 -0.89 4.20 -0.26 -1.89 -0.46 115.58 116.28 1gbr h ASN 51 Ca 0.00 0.00 -0.40 0.00 -0.56 0.00 0.00 56.30 55.34 1gbr h ASN 51 Cb 0.27 0.00 -0.24 0.00 -1.06 0.00 0.00 38.32 37.29 1gbr h ASN 51 CO 0.00 0.25 0.51 -1.22 -1.06 0.00 0.00 177.43 175.91 1gbr n TYR 52 N -3.86 2.81 -3.91 1.19 4.02 -0.58 -4.89 117.16 111.95 1gbr n TYR 52 Ca -0.02 -1.59 -0.08 0.00 -0.01 0.00 0.00 57.90 56.21 1gbr n TYR 52 Cb 0.33 -0.85 -0.03 0.00 -0.02 0.00 0.00 39.34 38.78 1gbr n TYR 52 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1gbr s ILE 53 N -3.12 0.00 0.04 -0.72 1.01 -0.18 -0.42 121.20 117.80 1gbr s ILE 53 Ca 0.55 -1.14 -0.08 0.00 0.00 0.00 0.00 60.65 59.98 1gbr s ILE 53 Cb 0.46 -2.12 -0.00 0.00 0.01 0.00 0.00 42.46 40.80 1gbr s ILE 53 CO 0.12 0.00 0.15 -1.61 0.00 0.00 0.00 174.94 173.60 1gbr s GLU 54 N -3.86 0.63 -0.45 2.79 2.02 -0.29 -4.77 118.70 114.78 1gbr s GLU 54 Ca 0.15 -0.65 -0.19 0.00 0.02 0.00 0.00 54.97 54.30 1gbr s GLU 54 Cb -0.04 0.26 0.03 0.00 0.10 0.00 0.00 34.13 34.48 1gbr s GLU 54 CO 0.08 -0.17 0.57 1.41 0.02 0.00 0.00 175.26 177.17 1gbr s MET 55 N -2.47 3.18 -0.08 1.61 -2.45 -1.26 -0.65 119.30 117.18 1gbr s MET 55 Ca -0.06 -0.61 -0.04 0.00 -1.25 0.00 0.00 55.69 53.73 1gbr s MET 55 Cb -0.02 -3.99 -0.04 0.00 1.25 0.00 0.00 34.83 32.04 1gbr s MET 55 CO -0.04 -1.00 0.10 0.15 1.05 0.00 0.00 175.02 175.28 1gbr s LYS 56 N 2.55 3.25 0.57 4.11 1.02 -0.42 -4.93 119.74 125.88 1gbr s LYS 56 Ca 0.17 -0.28 -0.07 0.00 0.02 0.00 0.00 55.97 55.82 1gbr s LYS 56 Cb -0.16 -3.02 0.12 0.00 -0.52 0.00 0.00 37.83 34.26 1gbr s LYS 56 CO 0.16 0.73 0.77 -0.35 -0.92 0.00 0.00 175.35 175.74 1gbr n PRO 57 N 1.80 -0.47 0.00 -1.68 -0.04 -1.26 -2.47 135.00 130.88 1gbr n PRO 57 Ca -0.18 -1.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 1gbr n PRO 57 Cb 0.54 -0.71 0.00 0.00 -0.04 0.00 0.00 33.50 33.29 1gbr n PRO 57 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1gbr n HIS 58 N -2.86 0.00 -2.64 0.54 1.44 -1.26 -4.82 115.22 105.62 1gbr n HIS 58 Ca 0.11 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.48 1gbr n HIS 58 Cb 0.37 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.43 1gbr n HIS 58 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1gbr s PRO 59 N 0.00 4.01 -0.93 -1.40 0.04 -1.26 -4.99 135.00 130.47 1gbr s PRO 59 Ca 0.00 1.18 -0.18 0.00 0.04 0.00 0.00 61.00 62.04 1gbr s PRO 59 Cb 0.00 -2.14 0.14 0.00 0.04 0.00 0.00 34.50 32.54 1gbr s PRO 59 CO 0.00 -0.23 1.11 -2.00 0.04 0.00 0.00 177.00 175.92 1gbr s GLU 60 N -3.35 3.62 -0.58 4.56 -6.30 -1.26 -4.93 118.70 110.46 1gbr s GLU 60 Ca 0.63 -1.84 0.04 0.00 -2.50 0.00 0.00 54.97 51.31 1gbr s GLU 60 Cb -0.12 -4.89 0.15 0.00 0.00 0.00 0.00 34.13 29.27 1gbr s GLU 60 CO 0.19 -1.74 0.36 -0.06 0.02 0.00 0.00 175.26 174.02 1gbr s PHE 61 N 2.47 3.10 -0.26 5.30 0.40 -1.26 -5.02 117.98 122.71 1gbr s PHE 61 Ca 0.32 -3.12 -0.04 0.00 -0.60 0.00 0.00 56.93 53.49 1gbr s PHE 61 Cb -0.05 -2.58 0.09 0.00 0.51 0.00 0.00 43.02 40.99 1gbr s PHE 61 CO -0.09 -0.67 0.12 0.96 0.70 0.00 0.00 175.22 176.23 1gbr s ILE 62 N -0.68 0.00 -0.28 0.64 -5.25 -1.26 -4.99 121.20 109.39 1gbr s ILE 62 Ca 0.21 -0.66 0.09 0.00 -0.99 0.00 0.00 60.65 59.29 1gbr s ILE 62 Cb -0.16 -0.94 0.47 0.00 2.95 0.00 0.00 42.46 44.79 1gbr s ILE 62 CO -0.08 -0.61 1.37 0.52 -1.79 0.00 0.00 174.94 174.35 1gbr n VAL 63 N 5.22 2.48 -5.26 8.37 0.31 -1.26 -4.99 118.33 123.20 1gbr n VAL 63 Ca -0.06 -3.14 -0.31 0.00 -0.01 0.00 0.00 64.34 60.82 1gbr n VAL 63 Cb 0.44 -0.43 -0.16 0.00 -0.91 0.00 0.00 33.84 32.77 1gbr n VAL 63 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1gbr s THR 64 N -3.49 2.01 -2.90 2.52 -4.23 -1.26 -5.38 115.64 102.91 1gbr s THR 64 Ca 0.44 -1.06 0.23 0.00 -1.18 0.00 0.00 61.69 60.12 1gbr s THR 64 Cb 0.40 -1.69 0.18 0.00 1.34 0.00 0.00 72.50 72.73 1gbr s THR 64 CO -0.02 0.56 1.23 -0.67 -0.54 0.00 0.00 174.62 175.19