#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjs s LYS 2 N 0.00 3.42 0.52 0.03 3.01 -1.26 -4.98 119.74 120.48 1gjs s LYS 2 Ca 0.00 1.62 -0.21 0.00 -1.01 0.00 0.00 55.97 56.37 1gjs s LYS 2 Cb 0.00 -2.06 -0.06 0.00 -1.01 0.00 0.00 37.83 34.70 1gjs s LYS 2 CO 0.00 -0.79 1.15 0.00 0.51 0.00 0.00 175.35 176.22 1gjs s ALA 3 N -1.75 2.78 0.14 5.17 0.00 -1.26 -5.04 121.76 121.80 1gjs s ALA 3 Ca 0.71 0.89 0.05 0.00 0.00 0.00 0.00 51.96 53.62 1gjs s ALA 3 Cb -0.24 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1gjs s ALA 3 CO 0.27 -0.78 -0.12 0.96 0.00 0.00 0.00 175.76 176.10 1gjs s ILE 4 N -1.67 1.28 0.00 0.00 -0.00 -1.26 -5.03 121.20 114.52 1gjs s ILE 4 Ca 0.70 -1.89 0.00 0.00 -0.00 0.00 0.00 60.65 59.45 1gjs s ILE 4 Cb -0.26 -1.69 0.00 0.00 -0.00 0.00 0.00 42.46 40.51 1gjs s ILE 4 CO 0.31 -0.57 0.00 0.33 -0.00 0.00 0.00 174.94 175.00 1gjs n PHE 5 N 0.16 0.00 -3.00 1.37 -0.00 -1.26 -5.05 117.46 109.68 1gjs n PHE 5 Ca -0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.32 1gjs n PHE 5 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.07 1gjs n PHE 5 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1gjs s VAL 6 N -1.00 -0.89 -0.02 -2.13 0.11 -1.26 -5.05 120.40 110.16 1gjs s VAL 6 Ca 0.00 -0.34 -0.20 0.00 -2.93 0.00 0.00 61.98 58.51 1gjs s VAL 6 Cb 0.00 0.00 -0.12 0.00 -1.53 0.00 0.00 36.38 34.73 1gjs s VAL 6 CO 0.00 0.00 0.85 0.25 -3.33 0.00 0.00 175.10 172.87 1gjs h LEU 7 N 6.06 -0.56 0.00 2.54 6.46 -2.00 -3.46 115.31 124.35 1gjs h LEU 7 Ca 0.04 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1gjs h LEU 7 Cb 1.16 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.23 1gjs h LEU 7 CO 0.05 -0.14 0.00 0.59 -0.62 0.00 0.00 178.44 178.32 1gjs n ASN 8 N -5.22 0.00 -3.89 1.25 5.03 -1.26 -5.15 115.26 106.03 1gjs n ASN 8 Ca -0.09 0.00 -0.08 0.00 0.87 0.00 0.00 54.58 55.28 1gjs n ASN 8 Cb 0.28 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.01 1gjs n ASN 8 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gjs s ALA 9 N -0.63 -0.89 0.64 5.41 0.00 -1.26 -5.16 121.76 119.87 1gjs s ALA 9 Ca 0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 51.96 51.38 1gjs s ALA 9 Cb 0.00 0.92 -0.03 0.00 0.00 0.00 0.00 23.12 24.02 1gjs s ALA 9 CO 0.00 -0.96 1.04 -0.65 0.00 0.00 0.00 175.76 175.19 1gjs s GLN 10 N -3.94 3.40 0.81 0.00 -0.21 -1.26 -5.01 119.66 113.44 1gjs s GLN 10 Ca 0.14 0.82 -0.12 0.00 0.02 0.00 0.00 55.36 56.22 1gjs s GLN 10 Cb -0.04 -2.05 0.08 0.00 1.00 0.00 0.00 33.01 32.00 1gjs s GLN 10 CO 0.07 -0.73 1.15 -1.58 -2.12 0.00 0.00 175.29 172.08 1gjs s HIS 11 N -3.13 2.01 0.00 0.91 5.65 -1.26 -4.78 115.29 114.69 1gjs s HIS 11 Ca 0.56 1.67 -0.01 0.00 0.25 0.00 0.00 55.06 57.53 1gjs s HIS 11 Cb -0.12 -3.32 -0.04 0.00 -1.18 0.00 0.00 32.58 27.93 1gjs s HIS 11 CO 0.54 -2.47 1.28 -0.25 -0.65 0.00 0.00 174.74 173.19 1gjs n ASP 12 N -3.48 2.57 -0.38 9.88 8.00 -1.26 -4.28 116.55 127.60 1gjs n ASP 12 Ca 0.12 -1.77 -0.02 0.00 0.71 0.00 0.00 54.79 53.83 1gjs n ASP 12 Cb 0.52 -0.59 0.11 0.00 -0.02 0.00 0.00 41.12 41.14 1gjs n ASP 12 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1gjs h GLU 13 N 3.14 1.32 -7.25 -1.24 4.81 -2.03 -3.42 114.58 109.91 1gjs h GLU 13 Ca 0.03 -0.08 -0.53 0.00 -0.13 0.00 0.00 59.36 58.65 1gjs h GLU 13 Cb 0.56 -0.30 0.19 0.00 0.63 0.00 0.00 28.75 29.83 1gjs h GLU 13 CO 0.11 0.88 0.27 0.00 -0.73 0.00 0.00 179.01 179.54 1gjs s ALA 14 N -6.12 1.65 0.09 2.92 0.00 -1.26 -5.02 121.76 114.02 1gjs s ALA 14 Ca -0.13 0.68 0.07 0.00 0.00 0.00 0.00 51.96 52.58 1gjs s ALA 14 Cb 0.18 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1gjs s ALA 14 CO 0.82 -2.53 -0.13 0.14 0.00 0.00 0.00 175.76 174.05 1gjs s VAL 15 N -2.46 3.14 0.67 0.00 -7.23 -1.26 -5.12 120.40 108.14 1gjs s VAL 15 Ca 0.69 -1.27 -0.12 0.00 -1.81 0.00 0.00 61.98 59.47 1gjs s VAL 15 Cb -0.25 -2.42 -0.00 0.00 0.56 0.00 0.00 36.38 34.27 1gjs s VAL 15 CO 0.55 0.18 1.06 -1.81 -0.31 0.00 0.00 175.10 174.76 1gjs s ASP 16 N -1.97 5.48 0.61 4.85 1.01 -1.26 -4.91 116.67 120.48 1gjs s ASP 16 Ca 0.19 1.64 0.35 0.00 0.71 0.00 0.00 52.55 55.44 1gjs s ASP 16 Cb -0.11 -2.50 1.96 0.00 1.01 0.00 0.00 42.92 43.28 1gjs s ASP 16 CO 0.11 -1.37 2.26 0.00 0.21 0.00 0.00 175.17 176.37 1gjs h ALA 17 N -0.50 1.29 -0.65 5.23 0.00 -2.04 -1.63 119.26 120.97 1gjs h ALA 17 Ca -0.44 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 54.63 1gjs h ALA 17 Cb 1.21 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1gjs h ALA 17 CO 0.57 0.02 0.46 -0.97 0.00 0.00 0.00 179.25 179.34 1gjs h ASN 18 N 0.00 0.04 -0.80 0.00 -1.24 -2.02 0.18 115.58 111.73 1gjs h ASN 18 Ca -0.00 0.00 0.23 0.00 0.71 0.00 0.00 56.30 57.24 1gjs h ASN 18 Cb 0.07 -0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.09 1gjs h ASN 18 CO 0.00 0.02 0.58 0.28 -1.29 0.00 0.00 177.43 177.02 1gjs h SER 19 N 0.04 0.00 -0.05 1.15 0.02 -1.66 0.24 113.55 113.29 1gjs h SER 19 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1gjs h SER 19 Cb 1.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 1gjs h SER 19 CO -0.02 0.00 0.03 0.25 -1.14 0.00 0.00 176.83 175.96 1gjs h LEU 20 N 0.00 0.06 -0.53 5.07 5.85 -0.85 0.79 115.31 125.69 1gjs h LEU 20 Ca 0.38 -0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.97 1gjs h LEU 20 Cb 1.54 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 1gjs h LEU 20 CO -0.00 0.04 -0.19 0.00 -0.34 0.00 0.00 178.44 177.95 1gjs h ALA 21 N 1.02 0.73 -0.80 1.25 0.00 -1.13 -2.90 119.26 117.43 1gjs h ALA 21 Ca 0.02 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1gjs h ALA 21 Cb -0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1gjs h ALA 21 CO -0.01 0.67 0.47 1.49 0.00 0.00 0.00 179.25 181.87 1gjs h GLU 22 N 0.86 1.09 -0.38 0.00 4.57 -1.00 -1.86 114.58 117.85 1gjs h GLU 22 Ca 0.12 -0.10 0.04 0.00 -1.18 0.00 0.00 59.36 58.24 1gjs h GLU 22 Cb 0.76 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.09 1gjs h GLU 22 CO 0.06 0.77 0.15 0.00 -1.18 0.00 0.00 179.01 178.81 1gjs h ALA 23 N 1.41 0.45 -0.75 2.92 0.00 -0.64 0.29 119.26 122.94 1gjs h ALA 23 Ca 0.29 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1gjs h ALA 23 Cb -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1gjs h ALA 23 CO -0.05 -0.24 0.24 0.87 0.00 0.00 0.00 179.25 180.07 1gjs h LYS 24 N 0.31 1.17 -0.20 0.00 1.57 -1.41 0.14 116.57 118.16 1gjs h LYS 24 Ca 0.17 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1gjs h LYS 24 Cb 0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1gjs h LYS 24 CO -0.16 0.99 0.10 0.28 -0.57 0.00 0.00 179.45 180.09 1gjs h VAL 25 N 1.12 1.12 -0.63 0.50 2.07 -0.47 0.12 116.25 120.08 1gjs h VAL 25 Ca 0.24 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.34 1gjs h VAL 25 Cb 0.31 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1gjs h VAL 25 CO -0.01 0.11 0.03 -0.07 0.02 0.00 0.00 177.57 177.66 1gjs h LEU 26 N 0.20 1.07 -0.58 2.57 3.38 -0.21 -2.89 115.31 118.85 1gjs h LEU 26 Ca 0.07 -0.29 -0.12 0.00 0.09 0.00 0.00 57.88 57.62 1gjs h LEU 26 Cb 0.09 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1gjs h LEU 26 CO -0.01 1.10 -0.17 0.00 0.09 0.00 0.00 178.44 179.45 1gjs h ALA 27 N 1.01 0.78 -0.91 1.53 0.00 -0.46 -2.77 119.26 118.44 1gjs h ALA 27 Ca 0.18 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1gjs h ALA 27 Cb 0.53 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1gjs h ALA 27 CO 0.03 0.66 0.60 -0.97 0.00 0.00 0.00 179.25 179.57 1gjs h ASN 28 N 0.84 1.04 0.49 0.00 -0.73 -0.59 -1.96 115.58 114.67 1gjs h ASN 28 Ca 0.12 -0.03 -0.11 0.00 1.87 0.00 0.00 56.30 58.16 1gjs h ASN 28 Cb 0.73 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.04 1gjs h ASN 28 CO 0.06 0.75 -0.50 0.03 -0.37 0.00 0.00 177.43 177.40 1gjs h ARG 29 N 1.23 0.01 -1.01 6.67 3.08 -1.40 -3.00 114.38 119.96 1gjs h ARG 29 Ca 0.33 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.39 1gjs h ARG 29 Cb -0.14 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.86 1gjs h ARG 29 CO -0.07 0.51 0.67 1.49 -1.07 0.00 0.00 179.97 181.50 1gjs h GLU 30 N 0.01 1.33 -0.04 0.04 4.81 -1.07 -1.09 114.58 118.57 1gjs h GLU 30 Ca -0.00 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1gjs h GLU 30 Cb 0.89 -0.30 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1gjs h GLU 30 CO 0.07 0.88 0.03 -0.07 -0.73 0.00 0.00 179.01 179.18 1gjs h LEU 31 N 1.37 0.04 -0.93 1.64 3.38 -1.39 -2.00 115.31 117.42 1gjs h LEU 31 Ca 0.37 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.35 1gjs h LEU 31 Cb -0.16 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1gjs h LEU 31 CO -0.08 0.03 0.62 -0.78 0.09 0.00 0.00 178.44 178.31 1gjs h ASP 32 N 0.05 1.06 -0.07 -0.43 1.82 -1.27 1.34 116.42 118.93 1gjs h ASP 32 Ca 0.01 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1gjs h ASP 32 Cb 0.00 -0.27 -0.00 0.00 0.68 0.00 0.00 39.33 39.74 1gjs h ASP 32 CO -0.00 0.77 0.04 0.11 -1.61 0.00 0.00 179.24 178.55 1gjs h LYS 33 N 1.26 0.09 -0.08 0.28 1.57 -1.40 -2.25 116.57 116.04 1gjs h LYS 33 Ca 0.34 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 59.00 1gjs h LYS 33 Cb -0.14 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1gjs h LYS 33 CO -0.07 0.06 -0.48 1.88 -0.57 0.00 0.00 179.45 180.26 1gjs h TYR 34 N 0.09 0.23 0.00 -1.35 0.05 -1.40 -3.46 116.97 111.12 1gjs h TYR 34 Ca 0.02 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.73 1gjs h TYR 34 Cb -0.01 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.68 1gjs h TYR 34 CO -0.08 0.64 0.00 0.41 -1.05 0.00 0.00 178.16 178.08 1gjs n GLY 35 N -0.04 0.72 0.46 3.88 0.00 0.45 -4.89 105.19 105.77 1gjs n GLY 35 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1gjs n GLY 35 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1gjs n VAL 36 N -2.00 0.00 -2.59 1.61 3.14 -1.04 -4.69 118.33 112.76 1gjs n VAL 36 Ca 0.00 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 60.97 1gjs n VAL 36 Cb 0.00 -0.34 -0.03 0.00 -1.06 0.00 0.00 33.84 32.41 1gjs n VAL 36 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1gjs s SER 37 N -0.37 6.16 0.00 6.55 0.01 -1.23 -4.33 113.70 120.49 1gjs s SER 37 Ca 0.00 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 56.74 1gjs s SER 37 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1gjs s SER 37 CO 0.00 -1.79 0.00 0.47 0.41 0.00 0.00 173.24 172.33 1gjs n ASP 38 N 9.16 0.00 -0.34 2.44 8.00 -1.26 -4.83 116.55 129.72 1gjs n ASP 38 Ca 0.02 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.49 1gjs n ASP 38 Cb 0.49 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.68 1gjs n ASP 38 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1gjs h TYR 39 N 0.00 1.14 -0.45 1.24 5.03 -2.00 -1.43 116.97 120.50 1gjs h TYR 39 Ca 0.00 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.32 1gjs h TYR 39 Cb 0.00 -0.39 -0.02 0.00 1.55 0.00 0.00 36.73 37.87 1gjs h TYR 39 CO 0.00 0.71 0.20 1.88 -1.32 0.00 0.00 178.16 179.63 1gjs h TYR 40 N 1.23 0.63 -0.81 -3.82 0.05 -1.93 -2.07 116.97 110.25 1gjs h TYR 40 Ca 0.33 -0.02 -0.04 0.00 0.05 0.00 0.00 58.73 59.05 1gjs h TYR 40 Cb -0.14 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.37 1gjs h TYR 40 CO -0.01 0.48 0.33 1.57 -1.05 0.00 0.00 178.16 179.48 1gjs h LYS 41 N 0.64 1.20 -0.27 4.88 2.10 -1.46 -1.81 116.57 121.84 1gjs h LYS 41 Ca 0.16 -0.21 -0.10 0.00 -2.00 0.00 0.00 60.65 58.49 1gjs h LYS 41 Cb 0.10 -0.20 -0.01 0.00 -0.90 0.00 0.00 32.23 31.22 1gjs h LYS 41 CO -0.02 0.97 -0.27 -0.91 -2.00 0.00 0.00 179.45 177.22 1gjs h ASN 42 N 1.17 0.54 -1.00 7.07 -0.26 -1.20 -2.67 115.58 119.23 1gjs h ASN 42 Ca 0.27 -0.19 0.01 0.00 -0.56 0.00 0.00 56.30 55.83 1gjs h ASN 42 Cb 0.21 -0.15 -0.05 0.00 -1.06 0.00 0.00 38.32 37.27 1gjs h ASN 42 CO -0.02 0.79 0.66 0.25 -1.06 0.00 0.00 177.43 178.06 1gjs h LEU 43 N 0.47 1.15 -0.97 1.61 5.85 -0.69 -1.30 115.31 121.42 1gjs h LEU 43 Ca 0.06 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1gjs h LEU 43 Cb 0.71 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1gjs h LEU 43 CO 0.05 0.83 0.65 0.40 -0.34 0.00 0.00 178.44 180.03 1gjs h ILE 44 N 1.36 1.25 -0.86 4.05 1.08 -1.07 -0.64 117.51 122.68 1gjs h ILE 44 Ca 0.37 -0.45 0.01 0.00 -0.39 0.00 0.00 64.86 64.39 1gjs h ILE 44 Cb -0.16 -0.18 -0.04 0.00 -3.07 0.00 0.00 36.82 33.36 1gjs h ILE 44 CO -0.08 0.24 0.57 0.78 -0.69 0.00 0.00 178.15 178.97 1gjs h ASN 45 N 1.32 0.98 0.99 1.72 -0.26 -1.17 0.18 115.58 119.35 1gjs h ASN 45 Ca 0.36 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 56.07 1gjs h ASN 45 Cb -0.15 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 36.87 1gjs h ASN 45 CO -0.08 0.71 0.00 0.78 -1.06 0.00 0.00 177.43 177.78 1gjs h ASN 46 N 1.16 0.00 -3.13 5.81 2.35 -0.55 -3.44 115.58 117.78 1gjs h ASN 46 Ca 0.31 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.53 1gjs h ASN 46 Cb -0.13 0.00 0.08 0.00 0.05 0.00 0.00 38.32 38.32 1gjs h ASN 46 CO -0.07 0.00 0.88 0.00 -1.65 0.00 0.00 177.43 176.60 1gjs n ALA 47 N -2.08 2.49 -0.07 -0.83 0.00 0.05 -4.89 120.51 115.19 1gjs n ALA 47 Ca 0.01 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1gjs n ALA 47 Cb 0.30 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.29 1gjs n ALA 47 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1gjs n LYS 48 N 2.45 2.54 -3.69 0.00 -0.00 -1.26 -4.97 118.16 113.23 1gjs n LYS 48 Ca 0.10 -1.36 -0.22 0.00 -0.00 0.00 0.00 58.31 56.82 1gjs n LYS 48 Cb 0.36 -0.96 -0.18 0.00 -0.00 0.00 0.00 35.03 34.25 1gjs n LYS 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1gjs s THR 49 N -0.87 0.06 0.31 0.58 2.01 -1.26 -5.02 115.64 111.46 1gjs s THR 49 Ca 0.00 0.16 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 1gjs s THR 49 Cb 0.00 -0.39 0.26 0.00 0.01 0.00 0.00 72.50 72.38 1gjs s THR 49 CO 0.00 0.08 1.98 1.62 -0.69 0.00 0.00 174.62 177.61 1gjs h VAL 50 N 6.41 1.20 -1.00 3.82 3.04 -1.93 0.14 116.25 127.93 1gjs h VAL 50 Ca -0.15 -0.36 0.01 0.00 -1.01 0.00 0.00 66.70 65.19 1gjs h VAL 50 Cb 1.13 0.05 -0.05 0.00 -2.01 0.00 0.00 31.29 30.41 1gjs h VAL 50 CO 0.22 0.19 0.66 -0.33 -1.01 0.00 0.00 177.57 177.31 1gjs h GLU 51 N 1.06 1.32 0.00 4.17 4.39 -2.00 -0.93 114.58 122.58 1gjs h GLU 51 Ca 0.29 -0.08 -0.14 0.00 0.34 0.00 0.00 59.36 59.76 1gjs h GLU 51 Cb -0.12 -0.30 -0.02 0.00 -0.10 0.00 0.00 28.75 28.21 1gjs h GLU 51 CO -0.06 0.87 -0.68 0.78 -1.16 0.00 0.00 179.01 178.76 1gjs h GLY 52 N 1.36 0.00 1.00 -3.84 0.00 -1.59 -3.00 103.07 97.00 1gjs h GLY 52 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1gjs h GLY 52 CO -0.08 0.00 0.00 -2.08 0.00 0.00 0.00 176.54 174.38 1gjs h VAL 53 N 0.00 1.00 -0.64 4.60 2.07 0.63 0.62 116.25 124.53 1gjs h VAL 53 Ca -0.01 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.42 1gjs h VAL 53 Cb 1.22 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 1gjs h VAL 53 CO 0.09 0.00 0.04 0.11 0.02 0.00 0.00 177.57 177.83 1gjs h LYS 54 N 0.01 1.10 0.00 1.57 6.56 -1.53 -2.46 116.57 121.81 1gjs h LYS 54 Ca 0.00 -0.33 -0.06 0.00 -1.06 0.00 0.00 60.65 59.20 1gjs h LYS 54 Cb 0.00 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 31.54 1gjs h LYS 54 CO -0.00 1.05 -0.29 0.00 -2.06 0.00 0.00 179.45 178.14 1gjs h ALA 55 N 1.01 1.01 -0.41 3.86 0.00 -1.34 -3.03 119.26 120.36 1gjs h ALA 55 Ca 0.19 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1gjs h ALA 55 Cb 0.52 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1gjs h ALA 55 CO 0.02 0.37 -0.34 1.25 0.00 0.00 0.00 179.25 180.55 1gjs h LEU 56 N 0.00 1.01 -1.05 0.00 5.85 0.71 -2.68 115.31 119.15 1gjs h LEU 56 Ca -0.00 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 1gjs h LEU 56 Cb 0.82 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1gjs h LEU 56 CO 0.04 1.24 0.09 0.40 -0.34 0.00 0.00 178.44 179.88 1gjs h ILE 57 N 0.78 1.22 -1.00 4.05 1.08 -1.38 -0.73 117.51 121.53 1gjs h ILE 57 Ca 0.07 -0.83 0.01 0.00 -0.39 0.00 0.00 64.86 63.73 1gjs h ILE 57 Cb 0.93 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 35.38 1gjs h ILE 57 CO 0.09 0.30 0.66 0.44 -0.69 0.00 0.00 178.15 178.95 1gjs h ASP 58 N 0.74 1.15 -0.38 1.72 3.32 -1.40 0.78 116.42 122.36 1gjs h ASP 58 Ca 0.16 -0.03 -0.16 0.00 0.02 0.00 0.00 57.03 57.01 1gjs h ASP 58 Cb 0.31 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1gjs h ASP 58 CO 0.00 0.84 -0.40 -0.33 -1.72 0.00 0.00 179.24 177.63 1gjs h GLU 59 N 1.36 0.94 -0.40 3.56 5.08 -1.05 0.42 114.58 124.48 1gjs h GLU 59 Ca 0.37 -0.51 -0.14 0.00 -1.00 0.00 0.00 59.36 58.08 1gjs h GLU 59 Cb -0.15 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1gjs h GLU 59 CO -0.08 1.16 -0.30 0.82 -1.00 0.00 0.00 179.01 179.61 1gjs h ILE 60 N 0.76 1.27 -0.43 3.13 2.04 -0.27 -2.28 117.51 121.74 1gjs h ILE 60 Ca 0.06 -1.47 -0.15 0.00 1.00 0.00 0.00 64.86 64.30 1gjs h ILE 60 Cb 1.00 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1gjs h ILE 60 CO 0.10 0.49 -0.31 -0.07 0.00 0.00 0.00 178.15 178.37 1gjs h LEU 61 N 0.74 1.00 -2.18 1.44 3.38 0.62 -2.32 115.31 117.99 1gjs h LEU 61 Ca 0.08 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1gjs h LEU 61 Cb 0.89 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1gjs h LEU 61 CO 0.08 1.22 0.00 0.00 0.09 0.00 0.00 178.44 179.83 1gjs h ALA 62 N 0.84 1.00 -1.01 1.53 0.00 -0.79 -2.40 119.26 118.43 1gjs h ALA 62 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1gjs h ALA 62 Cb 0.89 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 1gjs h ALA 62 CO 0.08 0.00 0.67 0.00 0.00 0.00 0.00 179.25 180.00 1gjs h ALA 63 N 2.02 1.28 -2.83 0.00 0.00 -0.81 -3.42 119.26 115.50 1gjs h ALA 63 Ca 0.00 -0.07 -0.53 0.00 0.00 0.00 0.00 54.91 54.31 1gjs h ALA 63 Cb 0.20 -0.41 0.11 0.00 0.00 0.00 0.00 17.79 17.70 1gjs h ALA 63 CO 0.00 0.67 0.48 -0.51 0.00 0.00 0.00 179.25 179.88 1gjs s LEU 64 N -10.12 3.69 0.00 0.00 1.43 -0.90 -5.13 118.68 107.65 1gjs s LEU 64 Ca -0.13 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 1gjs s LEU 64 Cb 0.18 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.83 1gjs s LEU 64 CO 0.82 -1.54 0.47 -0.81 0.23 0.00 0.00 176.35 175.52