#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 0.49 0.02 0.00 1.02 -1.20 -4.49 118.68 114.52 1gjx s LEU 2 Ca 0.00 1.19 0.00 0.00 0.02 0.00 0.00 54.13 55.34 1gjx s LEU 2 Cb 0.00 -3.01 -0.01 0.00 0.02 0.00 0.00 46.19 43.18 1gjx s LEU 2 CO 0.00 -4.27 -0.03 -0.69 0.02 0.00 0.00 176.35 171.38 1gjx s VAL 3 N -2.58 0.15 -0.32 -1.59 1.01 0.16 -4.92 120.40 112.31 1gjx s VAL 3 Ca 0.68 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1gjx s VAL 3 Cb -0.20 -0.25 0.10 0.00 0.00 0.00 0.00 36.38 36.03 1gjx s VAL 3 CO 0.61 -0.33 0.06 -1.61 0.00 0.00 0.00 175.10 173.83 1gjx s GLU 4 N -1.04 1.24 0.19 2.72 8.01 -1.26 0.99 118.70 129.54 1gjx s GLU 4 Ca -0.10 -1.55 -0.31 0.00 0.01 0.00 0.00 54.97 53.01 1gjx s GLU 4 Cb -0.07 -2.76 -0.10 0.00 -4.31 0.00 0.00 34.13 26.89 1gjx s GLU 4 CO -0.01 -0.93 1.56 -0.51 0.01 0.00 0.00 175.26 175.38 1gjx s LEU 5 N 1.17 4.37 -0.43 1.80 1.43 0.43 -4.87 118.68 122.58 1gjx s LEU 5 Ca 0.09 2.67 0.10 0.00 -1.03 0.00 0.00 54.13 55.96 1gjx s LEU 5 Cb -0.18 -3.60 0.39 0.00 0.03 0.00 0.00 46.19 42.82 1gjx s LEU 5 CO -0.14 -0.82 0.92 0.29 0.23 0.00 0.00 176.35 176.83 1gjx n LYS 6 N 3.56 2.15 -1.62 1.70 5.02 -1.26 0.14 118.16 127.85 1gjx n LYS 6 Ca 0.12 -4.00 0.00 0.00 -2.02 0.00 0.00 58.31 52.41 1gjx n LYS 6 Cb 0.38 -1.87 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 1gjx n LYS 6 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1gjx n VAL 7 N -0.10 -3.58 -2.68 -0.18 0.31 -1.26 0.19 118.33 111.03 1gjx n VAL 7 Ca 0.26 1.73 -0.19 0.00 -0.01 0.00 0.00 64.34 66.12 1gjx n VAL 7 Cb 0.62 -2.66 0.09 0.00 -0.91 0.00 0.00 33.84 30.98 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 -2.10 0.15 -0.69 5.55 -0.04 -1.26 -4.22 135.00 132.39 1gjx n PRO 8 Ca 0.00 -2.44 -0.29 0.00 -0.04 0.00 0.00 63.50 60.73 1gjx n PRO 8 Cb 0.33 -0.49 0.25 0.00 -0.04 0.00 0.00 33.50 33.55 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 -4.42 0.59 0.00 3.54 1.01 -1.26 -4.02 116.67 112.10 1gjx s ASP 9 Ca 0.56 1.10 0.00 0.00 0.71 0.00 0.00 52.55 54.93 1gjx s ASP 9 Cb -0.03 -1.67 0.00 0.00 1.01 0.00 0.00 42.92 42.23 1gjx s ASP 9 CO 0.37 -4.38 0.48 2.30 0.21 0.00 0.00 175.17 174.14 1gjx n ILE 10 N -5.00 0.00 -2.90 0.77 -6.64 -1.26 -4.42 119.36 99.91 1gjx n ILE 10 Ca 0.07 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.05 1gjx n ILE 10 Cb 0.57 0.22 0.00 0.00 -1.44 0.00 0.00 39.64 38.99 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 0.00 0.00 0.00 3.28 0.00 -1.26 -4.50 105.19 102.71 1gjx n GLY 11 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 1.81 -0.04 2.14 -0.02 0.00 -1.26 -4.85 105.19 102.98 1gjx n GLY 12 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 1gjx n GLY 12 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1gjx n HIS 13 N 0.00 -1.30 -0.27 1.61 -0.00 -1.26 -5.17 115.22 108.83 1gjx n HIS 13 Ca 0.00 -1.36 0.00 0.00 -0.00 0.00 0.00 57.72 56.36 1gjx n HIS 13 Cb 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 29.99 30.40 1gjx n HIS 13 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1gjx n GLU 14 N -0.35 -0.94 -3.04 -1.40 4.71 -1.26 -4.74 120.64 113.63 1gjx n GLU 14 Ca -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.13 1gjx n GLU 14 Cb 0.36 0.00 -0.01 0.00 -1.01 0.00 0.00 31.44 30.79 1gjx n GLU 14 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1gjx n ASN 15 N -2.48 -6.50 -2.35 1.62 0.23 -1.26 -4.96 115.26 99.55 1gjx n ASN 15 Ca 0.00 0.83 -0.11 0.00 -0.53 0.00 0.00 54.58 54.77 1gjx n ASN 15 Cb 0.00 -2.34 -0.04 0.00 -2.08 0.00 0.00 39.78 35.32 1gjx n ASN 15 CO 0.00 0.00 0.00 1.33 -0.93 0.00 0.00 177.26 177.66 1gjx n VAL 16 N 1.76 0.00 -4.73 3.53 0.24 0.44 -4.94 118.33 114.64 1gjx n VAL 16 Ca -0.05 -1.40 -0.33 0.00 -2.04 0.00 0.00 64.34 60.52 1gjx n VAL 16 Cb 0.27 0.74 -0.12 0.00 -1.47 0.00 0.00 33.84 33.26 1gjx n VAL 16 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1gjx s ASP 17 N -2.43 4.37 0.76 -1.34 1.01 -1.23 0.17 116.67 117.99 1gjx s ASP 17 Ca 0.23 -0.12 -0.11 0.00 0.71 0.00 0.00 52.55 53.26 1gjx s ASP 17 Cb 0.01 -1.11 0.05 0.00 1.01 0.00 0.00 42.92 42.87 1gjx s ASP 17 CO 0.16 0.33 1.08 -0.63 0.21 0.00 0.00 175.17 176.32 1gjx s ILE 18 N -0.63 3.47 0.00 0.77 1.01 -1.18 -3.29 121.20 121.35 1gjx s ILE 18 Ca 0.09 0.48 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1gjx s ILE 18 Cb -0.11 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.21 1gjx s ILE 18 CO 0.01 -0.63 0.04 0.00 0.00 0.00 0.00 174.94 174.37 1gjx n ILE 19 N -3.37 0.00 -3.67 2.92 3.06 0.13 -4.55 119.36 113.88 1gjx n ILE 19 Ca 0.08 -0.13 -0.12 0.00 -2.50 0.00 0.00 62.75 60.07 1gjx n ILE 19 Cb 0.54 1.22 -0.06 0.00 0.54 0.00 0.00 39.64 41.88 1gjx n ILE 19 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1gjx s ALA 20 N -0.19 -0.96 -0.13 1.51 0.00 -1.17 -4.73 121.76 116.09 1gjx s ALA 20 Ca 0.00 0.24 -0.06 0.00 0.00 0.00 0.00 51.96 52.14 1gjx s ALA 20 Cb 0.00 0.38 0.06 0.00 0.00 0.00 0.00 23.12 23.55 1gjx s ALA 20 CO 0.00 -0.47 0.28 0.08 0.00 0.00 0.00 175.76 175.65 1gjx s VAL 21 N -2.62 -0.19 -0.09 0.00 1.01 -1.26 -3.77 120.40 113.48 1gjx s VAL 21 Ca -0.04 0.18 0.11 0.00 0.00 0.00 0.00 61.98 62.23 1gjx s VAL 21 Cb -0.01 -0.44 0.23 0.00 0.00 0.00 0.00 36.38 36.16 1gjx s VAL 21 CO -0.03 0.08 1.16 -0.62 0.00 0.00 0.00 175.10 175.68 1gjx n GLU 22 N 4.65 0.43 -4.38 2.72 -0.58 -0.74 -4.98 120.64 117.75 1gjx n GLU 22 Ca -0.18 -1.52 -0.31 0.00 -0.42 0.00 0.00 57.16 54.73 1gjx n GLU 22 Cb 0.52 0.16 -0.16 0.00 -0.57 0.00 0.00 31.44 31.39 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 -0.34 1.74 0.00 2.62 -7.23 -1.26 -4.95 120.40 110.98 1gjx s VAL 23 Ca 0.12 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.52 1gjx s VAL 23 Cb 0.21 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.57 1gjx s VAL 23 CO -0.07 0.49 0.61 -3.20 -0.31 0.00 0.00 175.10 172.62 1gjx n ASN 24 N 4.34 0.49 -1.59 4.85 2.85 -1.26 -4.96 115.26 119.98 1gjx n ASN 24 Ca -0.19 -1.24 0.00 0.00 -0.11 0.00 0.00 54.58 53.04 1gjx n ASN 24 Cb 0.51 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.53 1gjx n ASN 24 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1gjx n VAL 25 N -0.12 -5.10 0.00 3.44 0.31 -1.26 -4.86 118.33 110.73 1gjx n VAL 25 Ca 0.00 2.28 0.00 0.00 -0.01 0.00 0.00 64.34 66.61 1gjx n VAL 25 Cb 0.43 -3.12 0.00 0.00 -0.91 0.00 0.00 33.84 30.24 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 0.18 2.42 3.82 2.92 0.00 -1.01 -4.99 105.19 108.52 1gjx n GLY 26 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.24 6.84 0.85 1.61 2.15 -1.26 -4.84 116.67 120.78 1gjx s ASP 27 Ca 0.00 1.00 -0.11 0.00 0.43 0.00 0.00 52.55 53.87 1gjx s ASP 27 Cb 0.00 -2.27 0.10 0.00 -0.30 0.00 0.00 42.92 40.45 1gjx s ASP 27 CO 0.00 0.29 1.10 0.28 -0.17 0.00 0.00 175.17 176.66 1gjx s THR 28 N -0.92 2.86 -0.07 1.71 -1.32 -1.26 -2.56 115.64 114.08 1gjx s THR 28 Ca 0.25 0.28 -0.03 0.00 -1.21 0.00 0.00 61.69 60.98 1gjx s THR 28 Cb -0.17 -2.68 0.04 0.00 -1.51 0.00 0.00 72.50 68.17 1gjx s THR 28 CO 0.14 -0.37 0.15 0.27 -2.21 0.00 0.00 174.62 172.61 1gjx s ILE 29 N -2.86 -0.05 0.37 5.08 -5.25 0.42 -4.87 121.20 114.04 1gjx s ILE 29 Ca 0.63 0.18 -0.03 0.00 -0.99 0.00 0.00 60.65 60.44 1gjx s ILE 29 Cb -0.18 -0.25 0.08 0.00 2.95 0.00 0.00 42.46 45.05 1gjx s ILE 29 CO 0.57 0.07 0.51 0.00 -1.79 0.00 0.00 174.94 174.30 1gjx n ALA 30 N 4.19 -0.18 -1.00 2.27 0.00 -1.22 -0.40 120.51 124.17 1gjx n ALA 30 Ca -0.26 -0.86 -0.19 0.00 0.00 0.00 0.00 53.44 52.13 1gjx n ALA 30 Cb 0.52 0.08 0.03 0.00 0.00 0.00 0.00 19.45 20.08 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 -2.32 2.91 0.00 0.00 0.31 -1.02 -3.44 118.33 114.77 1gjx n VAL 31 Ca 0.08 -1.91 0.00 0.00 -0.01 0.00 0.00 64.34 62.50 1gjx n VAL 31 Cb 0.27 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 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 0.34 0.00 -3.63 4.52 5.68 -1.12 -4.75 116.55 117.59 1gjx n ASP 32 Ca 0.35 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.44 1gjx n ASP 32 Cb 0.58 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.40 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 1.30 -0.09 -1.12 -4.77 0.12 -4.91 116.67 107.20 1gjx s ASP 33 Ca 0.00 -0.02 -0.29 0.00 -3.30 0.00 0.00 52.55 48.94 1gjx s ASP 33 Cb 0.00 0.04 -0.07 0.00 -1.09 0.00 0.00 42.92 41.80 1gjx s ASP 33 CO 0.00 -0.28 2.09 0.35 0.70 0.00 0.00 175.17 178.03 1gjx n THR 34 N 5.31 0.56 -0.02 2.11 -2.24 -1.25 -1.34 114.28 117.42 1gjx n THR 34 Ca -0.05 -0.29 -0.22 0.00 -2.27 0.00 0.00 64.05 61.23 1gjx n THR 34 Cb 0.50 -2.41 -0.13 0.00 -2.10 0.00 0.00 70.33 66.18 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 9.46 2.49 0.00 3.22 4.77 0.45 -4.92 117.00 132.48 1gjx n LEU 35 Ca 0.25 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.39 1gjx n LEU 35 Cb 0.42 -1.09 -0.01 0.00 -2.33 0.00 0.00 43.42 40.41 1gjx n LEU 35 CO 0.67 0.75 0.14 2.30 -1.33 0.00 0.00 177.39 179.92 1gjx n ILE 36 N -3.67 0.00 -4.14 -0.08 -6.64 -1.25 -1.80 119.36 101.79 1gjx n ILE 36 Ca -0.32 -1.02 -0.15 0.00 -1.77 0.00 0.00 62.75 59.48 1gjx n ILE 36 Cb 0.98 0.67 -0.11 0.00 -1.44 0.00 0.00 39.64 39.73 1gjx n ILE 36 CO 0.00 0.00 0.00 -0.89 -1.77 0.00 0.00 176.55 173.89 1gjx s THR 37 N -2.64 0.87 0.21 7.28 2.01 -1.25 -1.68 115.64 120.45 1gjx s THR 37 Ca 0.17 -1.41 0.02 0.00 0.31 0.00 0.00 61.69 60.78 1gjx s THR 37 Cb -0.01 -1.09 -0.05 0.00 0.01 0.00 0.00 72.50 71.37 1gjx s THR 37 CO 0.12 -0.43 0.04 -0.76 -0.69 0.00 0.00 174.62 172.90 1gjx s LEU 38 N -2.04 1.91 -0.10 4.42 2.01 0.20 -0.69 118.68 124.40 1gjx s LEU 38 Ca -0.01 -1.26 -0.33 0.00 0.01 0.00 0.00 54.13 52.54 1gjx s LEU 38 Cb -0.06 -0.03 0.13 0.00 0.01 0.00 0.00 46.19 46.23 1gjx s LEU 38 CO 0.01 -0.63 1.20 -0.70 1.01 0.00 0.00 176.35 177.24 1gjx s GLU 39 N -3.96 0.42 0.00 1.70 2.12 -1.21 0.16 118.70 117.93 1gjx s GLU 39 Ca 0.30 -0.19 0.00 0.00 0.36 0.00 0.00 54.97 55.44 1gjx s GLU 39 Cb 0.07 0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.62 1gjx s GLU 39 CO 0.08 -0.19 0.00 0.25 -0.54 0.00 0.00 175.26 174.87 1gjx n THR 40 N -0.26 0.00 -2.00 -1.70 -2.24 -1.06 -3.51 114.28 103.50 1gjx n THR 40 Ca -0.04 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 1gjx n THR 40 Cb 0.60 -0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 67.94 1gjx n THR 40 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1gjx n ASP 41 N -2.16 -0.56 0.00 3.42 8.00 -1.26 -4.90 116.55 119.09 1gjx n ASP 41 Ca 0.00 -1.58 0.00 0.00 0.71 0.00 0.00 54.79 53.92 1gjx n ASP 41 Cb 0.00 0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1gjx n ASP 41 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gjx n LYS 42 N 0.00 0.00 -3.64 -1.24 4.76 -1.26 -5.13 118.16 111.65 1gjx n LYS 42 Ca -0.16 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 54.92 1gjx n LYS 42 Cb 0.62 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.73 1gjx n LYS 42 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gjx s ALA 43 N 0.00 3.64 -0.23 7.82 0.00 -1.26 -5.07 121.76 126.65 1gjx s ALA 43 Ca 0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 1gjx s ALA 43 Cb 0.00 -2.29 0.03 0.00 0.00 0.00 0.00 23.12 20.86 1gjx s ALA 43 CO 0.00 0.04 -0.10 0.95 0.00 0.00 0.00 175.76 176.66 1gjx s THR 44 N 0.58 2.63 0.00 0.00 -4.23 -1.26 -2.57 115.64 110.79 1gjx s THR 44 Ca 0.11 -1.06 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 1gjx s THR 44 Cb -0.12 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1gjx s THR 44 CO 0.01 0.25 0.00 0.23 -0.54 0.00 0.00 174.62 174.58 1gjx n MET 45 N 4.63 2.15 -3.61 3.99 2.81 0.42 -4.86 117.12 122.65 1gjx n MET 45 Ca -0.17 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.72 1gjx n MET 45 Cb 0.47 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.97 1gjx n MET 45 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 1gjx s ASP 46 N -0.81 -0.07 -0.38 7.83 1.47 -1.26 0.62 116.67 124.07 1gjx s ASP 46 Ca 0.00 -0.10 -0.04 0.00 1.18 0.00 0.00 52.55 53.59 1gjx s ASP 46 Cb 0.00 0.15 0.08 0.00 -0.34 0.00 0.00 42.92 42.81 1gjx s ASP 46 CO 0.00 -0.27 0.16 -0.69 0.68 0.00 0.00 175.17 175.05 1gjx s VAL 47 N -2.40 3.43 -0.33 2.11 1.01 -0.68 -4.68 120.40 118.86 1gjx s VAL 47 Ca 0.13 -1.70 -0.02 0.00 0.00 0.00 0.00 61.98 60.40 1gjx s VAL 47 Cb 0.03 -3.18 0.17 0.00 0.00 0.00 0.00 36.38 33.41 1gjx s VAL 47 CO -0.04 -0.47 2.20 -0.81 0.00 0.00 0.00 175.10 175.98 1gjx n PRO 48 N 4.68 1.91 -1.19 2.72 -0.04 -1.26 0.17 135.00 142.00 1gjx n PRO 48 Ca -0.07 -1.67 0.15 0.00 -0.04 0.00 0.00 63.50 61.87 1gjx n PRO 48 Cb 0.42 -1.71 -0.04 0.00 -0.04 0.00 0.00 33.50 32.13 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 0.52 -3.42 -2.52 0.55 0.00 -0.45 0.16 120.51 115.35 1gjx n ALA 49 Ca 0.33 0.42 -0.02 0.00 0.00 0.00 0.00 53.44 54.17 1gjx n ALA 49 Cb 0.58 -1.18 0.08 0.00 0.00 0.00 0.00 19.45 18.93 1gjx n ALA 49 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1gjx n GLU 50 N -3.59 0.95 0.00 0.00 0.28 -1.26 -4.48 120.64 112.54 1gjx n GLU 50 Ca -0.00 -0.99 0.00 0.00 -0.16 0.00 0.00 57.16 56.01 1gjx n GLU 50 Cb 0.64 0.39 0.00 0.00 1.43 0.00 0.00 31.44 33.89 1gjx n GLU 50 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1gjx n VAL 51 N -1.08 0.00 -3.72 3.84 0.24 -1.22 -4.95 118.33 111.43 1gjx n VAL 51 Ca -0.17 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.77 1gjx n VAL 51 Cb 0.79 0.00 -0.10 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 s ALA 52 N -2.00 3.48 0.00 2.33 0.00 -1.24 -2.45 121.76 121.89 1gjx s ALA 52 Ca 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 51.96 48.90 1gjx s ALA 52 Cb 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.50 1gjx s ALA 52 CO 0.00 -2.02 0.00 0.41 0.00 0.00 0.00 175.76 174.15 1gjx n GLY 53 N 3.81 2.97 3.03 0.00 0.00 0.46 0.21 105.19 115.67 1gjx n GLY 53 Ca 0.05 -0.09 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 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 0.25 0.57 0.39 1.61 1.01 -1.26 0.16 120.40 123.13 1gjx s VAL 54 Ca 0.00 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 61.02 1gjx s VAL 54 Cb 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 36.38 35.73 1gjx s VAL 54 CO 0.00 -0.12 1.05 -0.69 0.00 0.00 0.00 175.10 175.34 1gjx s VAL 55 N -0.78 3.71 -0.07 2.92 1.01 -1.06 0.18 120.40 126.30 1gjx s VAL 55 Ca -0.03 1.33 -0.02 0.00 0.00 0.00 0.00 61.98 63.25 1gjx s VAL 55 Cb -0.06 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1gjx s VAL 55 CO 0.00 0.03 -0.08 0.29 0.00 0.00 0.00 175.10 175.34 1gjx n LYS 56 N 0.01 0.15 -3.86 2.72 4.76 0.33 -2.41 118.16 119.87 1gjx n LYS 56 Ca 0.05 0.06 -0.22 0.00 -2.87 0.00 0.00 58.31 55.32 1gjx n LYS 56 Cb 0.49 -0.83 -0.05 0.00 -1.84 0.00 0.00 35.03 32.80 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 -2.12 2.50 -0.29 1.97 2.02 -1.21 -4.86 118.70 116.71 1gjx s GLU 57 Ca -0.09 -1.51 -0.14 0.00 0.02 0.00 0.00 54.97 53.25 1gjx s GLU 57 Cb 0.03 -2.30 0.12 0.00 0.10 0.00 0.00 34.13 32.09 1gjx s GLU 57 CO 0.13 -0.02 0.76 0.54 0.02 0.00 0.00 175.26 176.69 1gjx s VAL 58 N -2.43 -0.46 -0.45 2.63 0.11 -1.24 -3.25 120.40 115.31 1gjx s VAL 58 Ca 0.42 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.52 1gjx s VAL 58 Cb -0.03 -1.00 0.18 0.00 -1.53 0.00 0.00 36.38 34.00 1gjx s VAL 58 CO 0.25 0.00 0.50 -0.54 -3.33 0.00 0.00 175.10 171.99 1gjx s LYS 59 N 2.21 0.95 -0.21 1.54 3.01 0.92 -4.97 119.74 123.19 1gjx s LYS 59 Ca -0.07 -1.57 -0.30 0.00 -1.01 0.00 0.00 55.97 53.01 1gjx s LYS 59 Cb -0.08 -0.79 0.15 0.00 -1.01 0.00 0.00 37.83 36.11 1gjx s LYS 59 CO -0.19 -1.35 1.16 0.54 0.51 0.00 0.00 175.35 176.02 1gjx s VAL 60 N 0.52 0.00 0.14 3.17 0.11 -1.26 -4.51 120.40 118.57 1gjx s VAL 60 Ca 0.30 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.34 1gjx s VAL 60 Cb 0.01 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1gjx s VAL 60 CO -0.12 0.00 0.21 1.17 -3.33 0.00 0.00 175.10 173.02 1gjx n LYS 61 N 0.53 0.30 -3.28 1.54 3.00 -1.26 -5.01 118.16 113.98 1gjx n LYS 61 Ca -0.05 -1.11 -0.43 0.00 -0.00 0.00 0.00 58.31 56.72 1gjx n LYS 61 Cb 0.58 1.09 -0.00 0.00 0.00 0.00 0.00 35.03 36.70 1gjx n LYS 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1gjx n VAL 62 N -0.23 4.60 0.00 3.15 0.31 -1.26 -4.38 118.33 120.52 1gjx n VAL 62 Ca -0.00 -5.51 0.00 0.00 -0.01 0.00 0.00 64.34 58.82 1gjx n VAL 62 Cb 0.24 -2.43 0.00 0.00 -0.91 0.00 0.00 33.84 30.74 1gjx n VAL 62 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gjx n GLY 63 N 2.25 0.01 3.28 2.92 0.00 -1.26 -5.07 105.19 107.32 1gjx n GLY 63 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.03 1.56 -0.55 1.61 1.47 -1.26 -5.04 116.67 114.44 1gjx s ASP 64 Ca 0.00 -1.16 -0.23 0.00 1.18 0.00 0.00 52.55 52.34 1gjx s ASP 64 Cb 0.00 0.05 0.05 0.00 -0.34 0.00 0.00 42.92 42.68 1gjx s ASP 64 CO 0.00 -0.50 0.86 -0.54 0.68 0.00 0.00 175.17 175.66 1gjx s LYS 65 N -3.86 3.25 0.20 2.11 -0.14 -1.26 -3.13 119.74 116.90 1gjx s LYS 65 Ca 0.24 -0.51 0.03 0.00 -1.36 0.00 0.00 55.97 54.37 1gjx s LYS 65 Cb 0.05 -4.09 -0.05 0.00 -1.68 0.00 0.00 37.83 32.07 1gjx s LYS 65 CO 0.05 -1.45 -0.01 0.42 -0.76 0.00 0.00 175.35 173.60 1gjx s ILE 66 N 3.59 0.88 0.12 2.17 1.09 0.46 -4.82 121.20 124.68 1gjx s ILE 66 Ca 0.25 -2.01 -0.26 0.00 -1.10 0.00 0.00 60.65 57.53 1gjx s ILE 66 Cb -0.15 -2.20 0.07 0.00 -1.06 0.00 0.00 42.46 39.12 1gjx s ILE 66 CO 0.16 -0.42 0.97 -0.94 -0.10 0.00 0.00 174.94 174.60 1gjx s SER 67 N -3.23 -0.20 -0.92 3.58 1.04 -1.26 0.17 113.70 112.87 1gjx s SER 67 Ca 0.26 -0.32 -0.17 0.00 0.48 0.00 0.00 55.95 56.19 1gjx s SER 67 Cb 0.06 0.45 -0.26 0.00 0.10 0.00 0.00 66.02 66.37 1gjx s SER 67 CO 0.06 -0.82 2.30 -0.62 0.98 0.00 0.00 173.24 175.14 1gjx n GLU 68 N -0.44 0.19 0.00 4.02 1.02 -1.26 -2.91 120.64 121.26 1gjx n GLU 68 Ca -0.07 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 1gjx n GLU 68 Cb 0.61 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 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 5.97 0.35 0.00 0.62 0.00 0.51 -4.96 105.19 107.69 1gjx n GLY 69 Ca 0.61 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.55 4.06 -0.02 0.00 -1.15 -4.98 105.19 103.66 1gjx n GLY 70 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.28 -1.98 0.00 0.99 7.94 -1.20 -4.88 117.00 117.60 1gjx n LEU 71 Ca 0.00 -1.03 0.00 0.00 -1.11 0.00 0.00 56.01 53.87 1gjx n LEU 71 Cb 0.32 -2.14 0.00 0.00 0.53 0.00 0.00 43.42 42.13 1gjx n LEU 71 CO 0.00 0.40 0.33 -0.38 -1.11 0.00 0.00 177.39 176.62 1gjx n ILE 72 N -4.42 0.00 -4.11 1.96 5.41 0.37 -4.57 119.36 114.00 1gjx n ILE 72 Ca -0.19 1.16 -0.14 0.00 1.00 0.00 0.00 62.75 64.57 1gjx n ILE 72 Cb 0.63 -1.74 -0.12 0.00 -0.71 0.00 0.00 39.64 37.70 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 -1.63 0.57 -0.06 1.39 -7.23 -1.17 -0.06 120.40 112.22 1gjx s VAL 73 Ca 0.00 -0.87 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1gjx s VAL 73 Cb 0.00 -0.59 -0.03 0.00 0.56 0.00 0.00 36.38 36.32 1gjx s VAL 73 CO 0.00 -0.23 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.82 1gjx s VAL 74 N -1.03 3.81 0.27 1.32 1.01 -1.20 0.16 120.40 124.74 1gjx s VAL 74 Ca -0.06 -0.48 0.09 0.00 0.00 0.00 0.00 61.98 61.53 1gjx s VAL 74 Cb -0.08 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1gjx s VAL 74 CO 0.00 0.57 -0.13 0.68 0.00 0.00 0.00 175.10 176.21 1gjx s VAL 75 N -0.86 2.04 0.12 2.92 -7.23 0.28 0.12 120.40 117.79 1gjx s VAL 75 Ca 0.13 -2.26 -0.14 0.00 -1.81 0.00 0.00 61.98 57.91 1gjx s VAL 75 Cb -0.11 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.46 1gjx s VAL 75 CO 0.03 -0.40 1.48 -0.08 -0.31 0.00 0.00 175.10 175.82 1gjx h GLU 76 N 2.31 0.77 -4.23 4.82 4.81 0.15 0.48 114.58 123.70 1gjx h GLU 76 Ca -0.40 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.49 1gjx h GLU 76 Cb 1.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1gjx h GLU 76 CO 0.64 0.97 -0.97 0.00 -0.73 0.00 0.00 179.01 178.92 1gjx n ALA 77 N -2.48 -1.97 -4.06 2.92 0.00 -1.25 -3.24 120.51 110.43 1gjx n ALA 77 Ca -0.02 0.48 -0.42 0.00 0.00 0.00 0.00 53.44 53.48 1gjx n ALA 77 Cb 0.42 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.42 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 0.41 -0.29 0.00 0.00 0.28 0.56 -4.60 120.64 117.00 1gjx n GLU 78 Ca 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 1gjx n GLU 78 Cb 0.00 -2.07 0.00 0.00 1.43 0.00 0.00 31.44 30.80 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 -1.99 1.02 0.00 -1.84 0.00 -0.95 -4.97 105.19 96.45 1gjx n GLY 79 Ca -0.10 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1gjx n GLY 79 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1gjx n THR 80 N 0.00 0.00 -1.31 2.61 5.66 -1.26 -5.09 114.28 114.89 1gjx n THR 80 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1gjx n THR 80 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1gjx n THR 80 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02