#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjx s LEU 2 N 0.00 2.70 0.05 0.00 1.02 -1.09 -4.04 118.68 117.31 1gjx s LEU 2 Ca 0.00 0.51 0.03 0.00 0.02 0.00 0.00 54.13 54.69 1gjx s LEU 2 Cb 0.00 -3.02 -0.03 0.00 0.02 0.00 0.00 46.19 43.17 1gjx s LEU 2 CO 0.00 -1.86 -0.09 -0.69 0.02 0.00 0.00 176.35 173.73 1gjx s VAL 3 N -3.44 0.67 -0.31 -1.59 1.01 0.30 -4.91 120.40 112.13 1gjx s VAL 3 Ca 0.63 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 61.49 1gjx s VAL 3 Cb -0.10 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.63 1gjx s VAL 3 CO 0.47 -0.36 -0.00 -1.61 0.00 0.00 0.00 175.10 173.60 1gjx s GLU 4 N -1.66 1.82 0.80 2.72 2.02 -1.26 0.44 118.70 123.57 1gjx s GLU 4 Ca -0.08 -1.66 -0.11 0.00 0.02 0.00 0.00 54.97 53.14 1gjx s GLU 4 Cb -0.10 -3.11 0.07 0.00 0.10 0.00 0.00 34.13 31.09 1gjx s GLU 4 CO 0.01 -0.80 1.09 -1.17 0.02 0.00 0.00 175.26 174.41 1gjx s LEU 5 N 1.00 2.86 0.12 1.80 2.96 0.43 -4.95 118.68 122.90 1gjx s LEU 5 Ca 0.03 1.75 -0.15 0.00 -0.22 0.00 0.00 54.13 55.54 1gjx s LEU 5 Cb -0.20 -4.39 0.03 0.00 0.50 0.00 0.00 46.19 42.14 1gjx s LEU 5 CO -0.06 -2.17 0.38 -0.54 -1.32 0.00 0.00 176.35 172.63 1gjx s LYS 6 N -4.91 1.03 0.29 1.98 3.01 -1.26 -1.99 119.74 117.89 1gjx s LYS 6 Ca 0.62 -0.72 -0.28 0.00 -1.01 0.00 0.00 55.97 54.58 1gjx s LYS 6 Cb -0.17 0.45 -0.14 0.00 -1.01 0.00 0.00 37.83 36.96 1gjx s LYS 6 CO 0.56 -0.39 1.01 0.28 0.51 0.00 0.00 175.35 177.32 1gjx n VAL 7 N -0.16 2.00 -0.56 3.17 0.31 -1.26 -4.78 118.33 117.05 1gjx n VAL 7 Ca -0.16 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 1gjx n VAL 7 Cb 0.63 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 1gjx n VAL 7 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1gjx n PRO 8 N 0.71 -0.32 -2.94 5.55 -0.04 -1.26 -4.00 135.00 132.69 1gjx n PRO 8 Ca 0.10 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.12 1gjx n PRO 8 Cb 0.32 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.76 1gjx n PRO 8 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1gjx s ASP 9 N -1.31 6.77 -0.85 3.54 1.01 -1.26 -4.54 116.67 120.03 1gjx s ASP 9 Ca 0.00 -2.37 -0.02 0.00 0.71 0.00 0.00 52.55 50.88 1gjx s ASP 9 Cb 0.00 -2.39 0.35 0.00 1.01 0.00 0.00 42.92 41.89 1gjx s ASP 9 CO 0.00 -0.95 1.96 2.30 0.21 0.00 0.00 175.17 178.69 1gjx n ILE 10 N 5.17 3.83 0.00 0.77 -6.64 -1.26 -4.61 119.36 116.62 1gjx n ILE 10 Ca 0.28 -4.53 0.00 0.00 -1.77 0.00 0.00 62.75 56.72 1gjx n ILE 10 Cb 0.47 -1.28 0.00 0.00 -1.44 0.00 0.00 39.64 37.39 1gjx n ILE 10 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1gjx n GLY 11 N -0.48 2.36 0.00 3.28 0.00 -1.26 -4.68 105.19 104.41 1gjx n GLY 11 Ca 0.52 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1gjx n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjx n GLY 12 N 0.00 0.00 3.29 -0.02 0.00 -1.26 -5.18 105.19 102.02 1gjx n GLY 12 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1gjx n GLY 12 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1gjx s HIS 13 N 0.00 0.18 -0.84 1.61 0.00 -1.26 -5.11 115.29 109.87 1gjx s HIS 13 Ca 0.00 -0.57 -0.09 0.00 -3.00 0.00 0.00 55.06 51.40 1gjx s HIS 13 Cb 0.00 0.01 0.22 0.00 -4.00 0.00 0.00 32.58 28.81 1gjx s HIS 13 CO 0.00 -0.66 0.76 -1.21 -1.00 0.00 0.00 174.74 172.63 1gjx s GLU 14 N -3.90 3.44 0.00 -0.38 2.02 -1.26 -4.20 118.70 114.42 1gjx s GLU 14 Ca 0.10 -2.72 0.00 0.00 0.02 0.00 0.00 54.97 52.37 1gjx s GLU 14 Cb 0.03 -4.24 0.00 0.00 0.10 0.00 0.00 34.13 30.03 1gjx s GLU 14 CO -0.06 -1.25 0.00 0.27 0.02 0.00 0.00 175.26 174.23 1gjx n ASN 15 N 3.43 0.00 -3.83 -0.19 0.23 -0.75 -4.86 115.26 109.29 1gjx n ASN 15 Ca 0.15 0.00 -0.15 0.00 -0.53 0.00 0.00 54.58 54.05 1gjx n ASN 15 Cb 0.42 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 37.97 1gjx n ASN 15 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1gjx s VAL 16 N 0.00 0.08 0.20 3.53 -7.23 0.42 -4.84 120.40 112.56 1gjx s VAL 16 Ca 0.00 0.07 -0.30 0.00 -1.81 0.00 0.00 61.98 59.94 1gjx s VAL 16 Cb 0.00 -0.15 -0.08 0.00 0.56 0.00 0.00 36.38 36.71 1gjx s VAL 16 CO 0.00 0.09 1.07 -0.62 -0.31 0.00 0.00 175.10 175.33 1gjx s ASP 17 N 0.65 7.32 0.76 4.85 -1.08 -1.22 0.17 116.67 128.13 1gjx s ASP 17 Ca -0.06 2.09 -0.11 0.00 -0.52 0.00 0.00 52.55 53.95 1gjx s ASP 17 Cb -0.09 -2.61 0.05 0.00 -1.46 0.00 0.00 42.92 38.82 1gjx s ASP 17 CO -0.01 -0.15 1.08 -0.63 0.52 0.00 0.00 175.17 175.97 1gjx s ILE 18 N -0.52 3.45 0.00 4.11 1.01 -0.60 -3.33 121.20 125.32 1gjx s ILE 18 Ca 0.47 0.47 0.00 0.00 0.00 0.00 0.00 60.65 61.59 1gjx s ILE 18 Cb -0.29 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.10 1gjx s ILE 18 CO 0.35 -0.62 0.00 2.30 0.00 0.00 0.00 174.94 176.98 1gjx n ILE 19 N -3.42 0.00 -4.07 2.92 -5.35 -1.26 -3.52 119.36 104.65 1gjx n ILE 19 Ca 0.08 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.49 1gjx n ILE 19 Cb 0.54 0.23 -0.10 0.00 -1.74 0.00 0.00 39.64 38.56 1gjx n ILE 19 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1gjx s ALA 20 N -1.32 0.44 -0.10 -1.28 0.00 -1.26 -4.85 121.76 113.40 1gjx s ALA 20 Ca 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 51.96 50.80 1gjx s ALA 20 Cb 0.00 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.42 1gjx s ALA 20 CO 0.00 -0.34 0.23 0.08 0.00 0.00 0.00 175.76 175.73 1gjx s VAL 21 N -3.56 -0.14 -0.46 0.00 1.01 -1.26 -4.21 120.40 111.79 1gjx s VAL 21 Ca 0.04 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.27 1gjx s VAL 21 Cb 0.05 -0.37 0.20 0.00 0.00 0.00 0.00 36.38 36.27 1gjx s VAL 21 CO -0.09 0.08 0.58 -0.62 0.00 0.00 0.00 175.10 175.06 1gjx n GLU 22 N 4.55 0.47 -3.61 2.72 -0.58 0.11 -4.95 120.64 119.34 1gjx n GLU 22 Ca -0.20 -2.57 -0.14 0.00 -0.42 0.00 0.00 57.16 53.83 1gjx n GLU 22 Cb 0.52 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.82 1gjx n GLU 22 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1gjx s VAL 23 N 0.26 0.00 -0.01 2.62 -7.23 -1.26 -4.65 120.40 110.12 1gjx s VAL 23 Ca 0.32 0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.51 1gjx s VAL 23 Cb 0.07 -1.00 0.03 0.00 0.56 0.00 0.00 36.38 36.04 1gjx s VAL 23 CO -0.14 0.00 0.95 0.59 -0.31 0.00 0.00 175.10 176.18 1gjx n ASN 24 N 2.37 0.28 0.00 4.85 4.13 -1.26 -5.06 115.26 120.56 1gjx n ASN 24 Ca -0.15 -1.97 0.00 0.00 1.68 0.00 0.00 54.58 54.14 1gjx n ASN 24 Cb 0.55 -0.19 0.00 0.00 -1.54 0.00 0.00 39.78 38.60 1gjx n ASN 24 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1gjx n VAL 25 N -0.16 0.00 -0.93 2.41 0.31 -1.26 -4.32 118.33 114.38 1gjx n VAL 25 Ca 0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.09 1gjx n VAL 25 Cb 0.66 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.55 1gjx n VAL 25 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gjx n GLY 26 N 0.00 3.42 3.40 2.92 0.00 -1.24 -2.46 105.19 111.22 1gjx n GLY 26 Ca 0.00 -1.07 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 1gjx n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gjx s ASP 27 N 2.87 2.31 -0.17 1.61 2.15 -1.26 -5.01 116.67 119.16 1gjx s ASP 27 Ca 0.51 -1.26 -0.20 0.00 0.43 0.00 0.00 52.55 52.03 1gjx s ASP 27 Cb 0.14 -0.08 -0.03 0.00 -0.30 0.00 0.00 42.92 42.65 1gjx s ASP 27 CO -0.04 -0.49 0.56 -0.89 -0.17 0.00 0.00 175.17 174.14 1gjx s THR 28 N -3.25 5.09 0.03 1.71 2.01 -1.26 -3.36 115.64 116.61 1gjx s THR 28 Ca 0.31 1.07 0.09 0.00 0.31 0.00 0.00 61.69 63.47 1gjx s THR 28 Cb 0.06 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1gjx s THR 28 CO 0.12 0.19 -0.26 0.27 -0.69 0.00 0.00 174.62 174.25 1gjx s ILE 29 N 1.47 2.08 0.08 1.82 -4.36 -0.78 -5.02 121.20 116.49 1gjx s ILE 29 Ca 0.27 -1.30 0.01 0.00 -0.26 0.00 0.00 60.65 59.36 1gjx s ILE 29 Cb -0.16 -1.77 -0.00 0.00 1.25 0.00 0.00 42.46 41.78 1gjx s ILE 29 CO 0.11 0.41 0.02 0.00 0.24 0.00 0.00 174.94 175.72 1gjx n ALA 30 N 1.96 0.10 -1.15 2.27 0.00 -1.26 -1.88 120.51 120.55 1gjx n ALA 30 Ca -0.17 -0.40 -0.21 0.00 0.00 0.00 0.00 53.44 52.66 1gjx n ALA 30 Cb 0.52 0.25 -0.00 0.00 0.00 0.00 0.00 19.45 20.21 1gjx n ALA 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1gjx n VAL 31 N -0.19 3.02 0.00 0.00 0.31 0.47 -3.55 118.33 118.40 1gjx n VAL 31 Ca -0.02 -2.22 0.00 0.00 -0.01 0.00 0.00 64.34 62.09 1gjx n VAL 31 Cb 0.12 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.59 1gjx n VAL 31 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1gjx n ASP 32 N 0.58 0.00 -3.29 4.52 5.68 -1.04 -4.91 116.55 118.09 1gjx n ASP 32 Ca 0.39 0.00 -0.08 0.00 -0.50 0.00 0.00 54.79 54.59 1gjx n ASP 32 Cb 0.58 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.50 1gjx n ASP 32 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 1gjx s ASP 33 N 0.00 0.24 -0.39 -1.12 -4.77 0.26 -4.97 116.67 105.91 1gjx s ASP 33 Ca 0.00 -0.46 -0.42 0.00 -3.30 0.00 0.00 52.55 48.37 1gjx s ASP 33 Cb 0.00 1.16 -0.17 0.00 -1.09 0.00 0.00 42.92 42.82 1gjx s ASP 33 CO 0.00 -0.34 1.87 0.35 0.70 0.00 0.00 175.17 177.75 1gjx n THR 34 N 5.23 0.16 -0.02 2.11 -2.24 -1.25 -2.82 114.28 115.45 1gjx n THR 34 Ca 0.02 -0.07 -0.21 0.00 -2.27 0.00 0.00 64.05 61.52 1gjx n THR 34 Cb 0.50 -0.99 -0.13 0.00 -2.10 0.00 0.00 70.33 67.60 1gjx n THR 34 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gjx n LEU 35 N 6.24 2.54 0.00 3.22 4.77 0.47 -4.77 117.00 129.46 1gjx n LEU 35 Ca 0.36 0.22 -0.10 0.00 -0.03 0.00 0.00 56.01 56.46 1gjx n LEU 35 Cb 0.07 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1gjx n LEU 35 CO 0.84 0.77 0.32 2.30 -1.33 0.00 0.00 177.39 180.28 1gjx n ILE 36 N -3.62 0.00 -2.98 -0.08 -6.64 -1.24 0.05 119.36 104.84 1gjx n ILE 36 Ca -0.33 -1.16 -0.14 0.00 -1.77 0.00 0.00 62.75 59.34 1gjx n ILE 36 Cb 0.99 0.89 0.01 0.00 -1.44 0.00 0.00 39.64 40.09 1gjx n ILE 36 CO 0.00 0.00 0.00 0.41 -1.77 0.00 0.00 176.55 175.19 1gjx n THR 37 N -0.48 0.09 -0.96 7.28 -1.04 -1.25 -2.07 114.28 115.86 1gjx n THR 37 Ca -0.04 -3.61 -0.35 0.00 -2.04 0.00 0.00 64.05 58.01 1gjx n THR 37 Cb 0.51 0.28 0.04 0.00 -1.82 0.00 0.00 70.33 69.33 1gjx n THR 37 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1gjx n LEU 38 N 0.18 -5.03 -3.61 -4.42 7.99 0.15 -4.07 117.00 108.19 1gjx n LEU 38 Ca 0.17 0.13 -0.05 0.00 -0.01 0.00 0.00 56.01 56.25 1gjx n LEU 38 Cb 0.71 -0.66 -0.03 0.00 -0.11 0.00 0.00 43.42 43.33 1gjx n LEU 38 CO 0.18 -4.91 1.02 -0.70 -1.51 0.00 0.00 177.39 171.47 1gjx s GLU 39 N -1.92 0.27 0.00 3.23 2.12 -1.21 -0.25 118.70 120.94 1gjx s GLU 39 Ca 0.37 -0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1gjx s GLU 39 Cb -0.10 0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.42 1gjx s GLU 39 CO 0.75 -0.11 0.00 -2.37 -0.54 0.00 0.00 175.26 172.99 1gjx n THR 40 N 0.18 0.00 0.00 -1.70 5.66 -0.94 -3.46 114.28 114.03 1gjx n THR 40 Ca -0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1gjx n THR 40 Cb 0.58 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.11 1gjx n THR 40 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1gjx n ASP 41 N -0.62 0.00 -2.32 1.09 5.68 -1.26 -4.90 116.55 114.21 1gjx n ASP 41 Ca 0.00 0.00 -0.19 0.00 -0.50 0.00 0.00 54.79 54.10 1gjx n ASP 41 Cb 0.00 0.03 0.02 0.00 -1.14 0.00 0.00 41.12 40.03 1gjx n ASP 41 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1gjx n LYS 42 N -1.77 3.03 0.00 0.11 3.00 -1.26 -5.02 118.16 116.24 1gjx n LYS 42 Ca 0.00 -4.05 0.00 0.00 -0.00 0.00 0.00 58.31 54.26 1gjx n LYS 42 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 35.03 32.96 1gjx n LYS 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1gjx n ALA 43 N -0.59 0.00 -3.87 3.14 0.00 -1.26 -4.99 120.51 112.94 1gjx n ALA 43 Ca 0.33 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.51 1gjx n ALA 43 Cb 0.86 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 20.14 1gjx n ALA 43 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1gjx s THR 44 N -0.66 1.03 0.19 0.00 -4.23 -1.26 -2.22 115.64 108.49 1gjx s THR 44 Ca 0.00 -0.30 0.07 0.00 -1.18 0.00 0.00 61.69 60.28 1gjx s THR 44 Cb 0.00 -1.04 -0.04 0.00 1.34 0.00 0.00 72.50 72.76 1gjx s THR 44 CO 0.00 0.37 0.08 -0.04 -0.54 0.00 0.00 174.62 174.48 1gjx s MET 45 N 1.63 2.64 -0.00 3.99 -1.94 0.65 -4.96 119.30 121.30 1gjx s MET 45 Ca 0.04 -1.05 -0.02 0.00 -1.71 0.00 0.00 55.69 52.94 1gjx s MET 45 Cb -0.13 -2.46 -0.00 0.00 2.01 0.00 0.00 34.83 34.24 1gjx s MET 45 CO -0.07 0.45 0.04 0.16 -0.01 0.00 0.00 175.02 175.58 1gjx s ASP 46 N -3.22 0.06 -0.21 3.03 -4.77 -1.26 0.31 116.67 110.61 1gjx s ASP 46 Ca 0.30 -0.15 -0.00 0.00 -3.30 0.00 0.00 52.55 49.40 1gjx s ASP 46 Cb -0.09 0.12 0.02 0.00 -1.09 0.00 0.00 42.92 41.88 1gjx s ASP 46 CO 0.21 -0.16 -0.13 -0.69 0.70 0.00 0.00 175.17 175.10 1gjx s VAL 47 N -0.68 2.51 -0.23 2.11 1.01 -0.88 -4.98 120.40 119.27 1gjx s VAL 47 Ca -0.08 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.02 1gjx s VAL 47 Cb -0.05 -2.16 0.33 0.00 0.00 0.00 0.00 36.38 34.51 1gjx s VAL 47 CO -0.00 0.41 1.47 -0.81 0.00 0.00 0.00 175.10 176.16 1gjx n PRO 48 N 4.65 1.63 -2.64 2.72 -0.04 -1.26 0.18 135.00 140.24 1gjx n PRO 48 Ca -0.19 -1.51 -0.02 0.00 -0.04 0.00 0.00 63.50 61.74 1gjx n PRO 48 Cb 0.49 -1.59 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 1gjx n PRO 48 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1gjx n ALA 49 N -0.32 -2.28 -2.72 0.55 0.00 -1.13 0.90 120.51 115.50 1gjx n ALA 49 Ca 0.30 1.11 -0.42 0.00 0.00 0.00 0.00 53.44 54.43 1gjx n ALA 49 Cb 1.08 -2.46 0.01 0.00 0.00 0.00 0.00 19.45 18.08 1gjx n ALA 49 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1gjx n GLU 50 N 2.04 4.46 -1.88 0.00 4.71 -1.26 -2.87 120.64 125.83 1gjx n GLU 50 Ca -0.18 -4.27 -0.03 0.00 -0.01 0.00 0.00 57.16 52.67 1gjx n GLU 50 Cb 0.28 -2.60 0.01 0.00 -1.01 0.00 0.00 31.44 28.11 1gjx n GLU 50 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 1gjx n VAL 51 N 1.57 0.00 -2.74 2.62 0.24 -1.23 -5.01 118.33 113.78 1gjx n VAL 51 Ca 0.35 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.34 62.24 1gjx n VAL 51 Cb 0.32 0.30 0.08 0.00 -1.47 0.00 0.00 33.84 33.06 1gjx n VAL 51 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gjx n ALA 52 N -2.28 -0.92 -2.00 2.33 0.00 -1.26 -0.39 120.51 115.98 1gjx n ALA 52 Ca -0.05 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 51.92 1gjx n ALA 52 Cb 0.18 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1gjx n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gjx n GLY 53 N 0.74 2.49 3.11 0.00 0.00 -0.79 0.18 105.19 110.93 1gjx n GLY 53 Ca 0.07 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 1gjx n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gjx s VAL 54 N 2.12 0.00 0.55 1.61 1.01 -1.26 -1.87 120.40 122.56 1gjx s VAL 54 Ca 0.00 -0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.80 1gjx s VAL 54 Cb 0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 35.99 1gjx s VAL 54 CO 0.00 -0.01 1.01 -0.69 0.00 0.00 0.00 175.10 175.41 1gjx s VAL 55 N 0.07 4.30 0.00 2.92 1.01 -1.03 0.15 120.40 127.83 1gjx s VAL 55 Ca -0.00 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.04 1gjx s VAL 55 Cb -0.02 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1gjx s VAL 55 CO 0.00 -0.67 0.00 0.29 0.00 0.00 0.00 175.10 174.73 1gjx n LYS 56 N -1.84 0.00 -3.91 2.72 4.76 0.11 -3.73 118.16 116.28 1gjx n LYS 56 Ca 0.07 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.29 1gjx n LYS 56 Cb 0.54 -0.52 -0.04 0.00 -1.84 0.00 0.00 35.03 33.16 1gjx n LYS 56 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1gjx s GLU 57 N -1.86 2.61 -0.29 1.97 2.02 -1.22 -4.81 118.70 117.11 1gjx s GLU 57 Ca 0.00 -1.38 -0.13 0.00 0.02 0.00 0.00 54.97 53.48 1gjx s GLU 57 Cb 0.00 -2.38 0.12 0.00 0.10 0.00 0.00 34.13 31.97 1gjx s GLU 57 CO 0.00 0.10 0.74 0.54 0.02 0.00 0.00 175.26 176.65 1gjx s VAL 58 N -2.34 -0.55 -0.43 2.63 0.11 -1.24 -3.33 120.40 115.25 1gjx s VAL 58 Ca 0.40 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.50 1gjx s VAL 58 Cb -0.05 -1.00 0.19 0.00 -1.53 0.00 0.00 36.38 33.99 1gjx s VAL 58 CO 0.25 0.00 0.44 0.29 -3.33 0.00 0.00 175.10 172.75 1gjx n LYS 59 N 4.90 0.32 -3.61 1.54 4.01 0.55 -4.97 118.16 120.90 1gjx n LYS 59 Ca -0.15 -2.98 -0.07 0.00 -0.51 0.00 0.00 58.31 54.61 1gjx n LYS 59 Cb 0.53 -1.57 -0.05 0.00 -0.51 0.00 0.00 35.03 33.43 1gjx n LYS 59 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1gjx s VAL 60 N 0.03 0.00 0.17 -0.18 0.11 -1.26 -4.50 120.40 114.76 1gjx s VAL 60 Ca 0.33 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.37 1gjx s VAL 60 Cb 0.06 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 1gjx s VAL 60 CO -0.17 0.00 0.09 -0.75 -3.33 0.00 0.00 175.10 170.94 1gjx s LYS 61 N -0.90 1.08 -0.93 1.54 2.47 -1.26 -5.03 119.74 116.70 1gjx s LYS 61 Ca 0.03 -1.54 -0.08 0.00 -1.56 0.00 0.00 55.97 52.82 1gjx s LYS 61 Cb -0.01 0.20 -0.12 0.00 -1.46 0.00 0.00 37.83 36.44 1gjx s LYS 61 CO -0.04 -0.31 3.14 1.55 0.16 0.00 0.00 175.35 179.85 1gjx n VAL 62 N -0.20 3.87 0.00 4.02 3.14 -1.26 -4.02 118.33 123.88 1gjx n VAL 62 Ca -0.02 -2.39 0.00 0.00 -2.96 0.00 0.00 64.34 58.97 1gjx n VAL 62 Cb 0.65 -2.27 0.00 0.00 -1.06 0.00 0.00 33.84 31.16 1gjx n VAL 62 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1gjx n GLY 63 N 2.82 -0.82 3.22 7.55 0.00 -1.23 -4.82 105.19 111.91 1gjx n GLY 63 Ca 0.62 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.60 1gjx n GLY 63 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1gjx s ASP 64 N 0.00 -0.16 0.02 1.61 1.47 -1.26 -4.86 116.67 113.50 1gjx s ASP 64 Ca 0.00 0.02 -0.30 0.00 1.18 0.00 0.00 52.55 53.45 1gjx s ASP 64 Cb 0.00 0.30 -0.07 0.00 -0.34 0.00 0.00 42.92 42.81 1gjx s ASP 64 CO 0.00 -0.46 1.71 -0.54 0.68 0.00 0.00 175.17 176.56 1gjx s LYS 65 N -1.46 4.18 0.29 2.11 1.02 -1.26 -1.56 119.74 123.06 1gjx s LYS 65 Ca -0.13 2.33 0.03 0.00 0.02 0.00 0.00 55.97 58.22 1gjx s LYS 65 Cb -0.05 -3.83 -0.06 0.00 -0.52 0.00 0.00 37.83 33.38 1gjx s LYS 65 CO 0.03 -0.81 0.07 -1.50 -0.92 0.00 0.00 175.35 172.22 1gjx s ILE 66 N 3.42 0.91 -0.01 2.17 1.10 0.46 -4.82 121.20 124.42 1gjx s ILE 66 Ca 0.76 -2.00 -0.18 0.00 -0.51 0.00 0.00 60.65 58.72 1gjx s ILE 66 Cb -0.38 -2.69 0.03 0.00 0.15 0.00 0.00 42.46 39.57 1gjx s ILE 66 CO 0.33 -0.03 0.39 -0.94 -2.11 0.00 0.00 174.94 172.58 1gjx s SER 67 N -3.40 -0.29 -0.75 4.50 1.04 -1.26 0.16 113.70 113.70 1gjx s SER 67 Ca 0.36 0.20 -0.27 0.00 0.48 0.00 0.00 55.95 56.72 1gjx s SER 67 Cb 0.08 0.37 -0.15 0.00 0.10 0.00 0.00 66.02 66.41 1gjx s SER 67 CO 0.14 -0.50 2.51 -0.62 0.98 0.00 0.00 173.24 175.75 1gjx n GLU 68 N 1.12 0.51 0.00 4.02 1.02 -1.26 -2.53 120.64 123.52 1gjx n GLU 68 Ca -0.21 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 1gjx n GLU 68 Cb 0.57 -2.52 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 1gjx n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gjx n GLY 69 N 6.23 0.69 0.97 0.62 0.00 -1.26 -4.88 105.19 107.57 1gjx n GLY 69 Ca 0.52 -0.47 0.08 0.00 0.00 0.00 0.00 46.02 46.15 1gjx n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjx n GLY 70 N 0.00 3.73 4.13 -0.02 0.00 -1.05 -4.91 105.19 107.08 1gjx n GLY 70 Ca 0.00 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1gjx n GLY 70 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1gjx n LEU 71 N -0.22 -1.72 0.00 0.99 7.94 -1.24 -4.88 117.00 117.87 1gjx n LEU 71 Ca 0.21 -1.09 0.00 0.00 -1.11 0.00 0.00 56.01 54.01 1gjx n LEU 71 Cb 0.85 -2.00 0.00 0.00 0.53 0.00 0.00 43.42 42.81 1gjx n LEU 71 CO 0.16 0.40 0.18 -0.38 -1.11 0.00 0.00 177.39 176.64 1gjx n ILE 72 N -4.43 0.00 -4.33 1.96 5.41 -0.84 -4.54 119.36 112.59 1gjx n ILE 72 Ca -0.22 0.85 -0.22 0.00 1.00 0.00 0.00 62.75 64.16 1gjx n ILE 72 Cb 0.64 -1.43 -0.13 0.00 -0.71 0.00 0.00 39.64 38.01 1gjx n ILE 72 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 1gjx s VAL 73 N -0.71 1.44 -0.08 1.39 -7.23 -1.26 -0.33 120.40 113.62 1gjx s VAL 73 Ca 0.00 -1.33 0.04 0.00 -1.81 0.00 0.00 61.98 58.89 1gjx s VAL 73 Cb 0.00 -1.31 -0.01 0.00 0.56 0.00 0.00 36.38 35.62 1gjx s VAL 73 CO 0.00 -0.05 -0.22 -0.69 -0.31 0.00 0.00 175.10 173.83 1gjx s VAL 74 N -1.07 2.32 0.36 1.32 1.01 -1.21 0.16 120.40 123.29 1gjx s VAL 74 Ca 0.03 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.15 1gjx s VAL 74 Cb -0.09 -1.89 -0.07 0.00 0.00 0.00 0.00 36.38 34.34 1gjx s VAL 74 CO 0.03 0.56 -0.04 0.68 0.00 0.00 0.00 175.10 176.33 1gjx s VAL 75 N -0.01 2.26 0.10 2.92 -7.23 0.17 0.10 120.40 118.71 1gjx s VAL 75 Ca -0.07 -2.09 -0.06 0.00 -1.81 0.00 0.00 61.98 57.94 1gjx s VAL 75 Cb -0.15 -2.77 -0.23 0.00 0.56 0.00 0.00 36.38 33.79 1gjx s VAL 75 CO 0.05 -0.15 1.21 -0.33 -0.31 0.00 0.00 175.10 175.58 1gjx h GLU 76 N 1.90 0.41 -3.59 4.82 5.08 0.11 0.87 114.58 124.17 1gjx h GLU 76 Ca -0.43 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 57.41 1gjx h GLU 76 Cb 1.25 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1gjx h GLU 76 CO 0.72 1.19 -0.85 0.00 -1.00 0.00 0.00 179.01 179.08 1gjx n ALA 77 N -2.57 -1.85 -4.13 3.43 0.00 -1.26 -2.68 120.51 111.46 1gjx n ALA 77 Ca -0.09 0.42 -0.37 0.00 0.00 0.00 0.00 53.44 53.41 1gjx n ALA 77 Cb 0.92 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.99 1gjx n ALA 77 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1gjx n GLU 78 N -2.39 -0.58 0.00 0.00 0.28 0.47 -4.59 120.64 113.82 1gjx n GLU 78 Ca 0.00 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 1gjx n GLU 78 Cb 0.38 -2.74 0.00 0.00 1.43 0.00 0.00 31.44 30.51 1gjx n GLU 78 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1gjx n GLY 79 N -2.25 0.56 4.00 -1.84 0.00 -0.86 -4.99 105.19 99.80 1gjx n GLY 79 Ca -0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 1gjx n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gjx s THR 80 N 0.02 1.84 0.00 2.61 -4.23 -1.26 -5.06 115.64 109.56 1gjx s THR 80 Ca 0.00 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1gjx s THR 80 Cb 0.00 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.83 1gjx s THR 80 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08