#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjs h LYS 2 N 0.00 1.28 -3.06 2.12 3.64 -2.03 -3.45 116.57 115.07 1gjs h LYS 2 Ca 0.00 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1gjs h LYS 2 Cb 0.00 -0.29 -0.12 0.00 -0.41 0.00 0.00 32.23 31.41 1gjs h LYS 2 CO 0.00 0.85 0.17 0.00 -2.27 0.00 0.00 179.45 178.20 1gjs s ALA 3 N -6.12 -1.50 0.21 5.00 0.00 -1.26 -5.04 121.76 113.06 1gjs s ALA 3 Ca -0.13 0.41 -0.10 0.00 0.00 0.00 0.00 51.96 52.13 1gjs s ALA 3 Cb 0.18 0.86 0.15 0.00 0.00 0.00 0.00 23.12 24.31 1gjs s ALA 3 CO 0.81 -0.75 1.88 0.82 0.00 0.00 0.00 175.76 178.52 1gjs h ILE 4 N 2.05 1.19 -3.92 0.00 1.08 -2.08 -3.42 117.51 112.42 1gjs h ILE 4 Ca -0.34 -0.36 -0.53 0.00 -0.39 0.00 0.00 64.86 63.24 1gjs h ILE 4 Cb 1.30 0.09 0.09 0.00 -3.07 0.00 0.00 36.82 35.24 1gjs h ILE 4 CO 0.39 0.19 0.72 0.12 -0.69 0.00 0.00 178.15 178.88 1gjs s PHE 5 N -6.12 2.79 -0.31 1.37 2.19 -1.26 -4.97 117.98 111.67 1gjs s PHE 5 Ca -0.13 1.28 -0.13 0.00 0.33 0.00 0.00 56.93 58.28 1gjs s PHE 5 Cb 0.15 -3.87 -0.03 0.00 -1.31 0.00 0.00 43.02 37.95 1gjs s PHE 5 CO 0.78 -2.50 0.27 0.08 1.83 0.00 0.00 175.22 175.68 1gjs s VAL 6 N -1.13 5.25 -0.18 3.12 1.01 -1.26 -4.94 120.40 122.28 1gjs s VAL 6 Ca 0.51 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.56 1gjs s VAL 6 Cb -0.44 -3.66 -0.22 0.00 0.00 0.00 0.00 36.38 32.06 1gjs s VAL 6 CO 0.59 0.10 0.12 0.00 0.00 0.00 0.00 175.10 175.91 1gjs n LEU 7 N 5.18 2.71 -3.67 3.92 -0.00 -1.26 -5.01 117.00 118.87 1gjs n LEU 7 Ca -0.12 0.10 -0.11 0.00 -0.00 0.00 0.00 56.01 55.88 1gjs n LEU 7 Cb 0.51 -1.03 -0.05 0.00 -0.00 0.00 0.00 43.42 42.84 1gjs n LEU 7 CO 0.36 0.85 0.13 0.21 -0.00 0.00 0.00 177.39 178.94 1gjs s ASN 8 N -6.86 -0.22 0.46 1.45 2.47 -1.26 -5.15 114.94 105.84 1gjs s ASN 8 Ca -0.28 -0.23 -0.23 0.00 0.42 0.00 0.00 52.86 52.55 1gjs s ASN 8 Cb 0.08 0.44 -0.07 0.00 -1.45 0.00 0.00 41.25 40.24 1gjs s ASN 8 CO 0.69 -0.77 1.15 0.00 -3.72 0.00 0.00 177.10 174.45 1gjs s ALA 9 N -3.29 2.95 0.24 1.71 0.00 -1.26 -4.92 121.76 117.19 1gjs s ALA 9 Ca -0.00 0.90 -0.07 0.00 0.00 0.00 0.00 51.96 52.78 1gjs s ALA 9 Cb 0.01 -3.37 0.23 0.00 0.00 0.00 0.00 23.12 19.99 1gjs s ALA 9 CO -0.08 -0.62 1.91 0.37 0.00 0.00 0.00 175.76 177.34 1gjs h GLN 10 N 1.99 1.21 -4.53 0.00 4.15 -2.02 -3.45 115.11 112.46 1gjs h GLN 10 Ca -0.49 -0.07 -0.22 0.00 0.77 0.00 0.00 58.65 58.63 1gjs h GLN 10 Cb 1.25 -0.27 -0.15 0.00 0.21 0.00 0.00 27.48 28.51 1gjs h GLN 10 CO 0.60 0.80 -0.62 -1.01 -1.93 0.00 0.00 178.83 176.67 1gjs s HIS 11 N -6.12 1.07 -1.07 3.99 3.76 -1.26 -5.04 115.29 110.61 1gjs s HIS 11 Ca -0.13 -1.33 -0.22 0.00 -0.15 0.00 0.00 55.06 53.23 1gjs s HIS 11 Cb 0.17 -0.52 -0.10 0.00 1.11 0.00 0.00 32.58 33.23 1gjs s HIS 11 CO 0.81 -0.61 1.92 -0.25 -0.85 0.00 0.00 174.74 175.75 1gjs n ASP 12 N -0.23 2.99 -4.72 1.40 8.00 -1.26 -4.91 116.55 117.82 1gjs n ASP 12 Ca -0.00 -2.70 -0.42 0.00 0.71 0.00 0.00 54.79 52.38 1gjs n ASP 12 Cb 0.65 -1.56 -0.04 0.00 -0.02 0.00 0.00 41.12 40.16 1gjs n ASP 12 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1gjs s GLU 13 N 5.96 4.61 0.00 -1.24 2.12 -1.26 -4.95 118.70 123.94 1gjs s GLU 13 Ca 0.65 1.44 0.00 0.00 0.36 0.00 0.00 54.97 57.42 1gjs s GLU 13 Cb 0.04 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 31.01 1gjs s GLU 13 CO 0.13 0.05 0.00 0.00 -0.54 0.00 0.00 175.26 174.90 1gjs n ALA 14 N 3.45 0.00 -2.16 6.30 0.00 -1.26 -5.11 120.51 121.72 1gjs n ALA 14 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 1gjs n ALA 14 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 1gjs n ALA 14 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gjs s VAL 15 N 1.46 3.47 -1.32 0.00 1.01 -1.26 -4.91 120.40 118.85 1gjs s VAL 15 Ca 0.00 1.12 -0.16 0.00 0.00 0.00 0.00 61.98 62.94 1gjs s VAL 15 Cb 0.00 -3.71 0.09 0.00 0.00 0.00 0.00 36.38 32.76 1gjs s VAL 15 CO 0.00 0.12 1.80 0.47 0.00 0.00 0.00 175.10 177.49 1gjs n ASP 16 N 3.38 4.78 0.26 3.32 8.00 -1.26 -4.70 116.55 130.34 1gjs n ASP 16 Ca 0.08 -2.93 0.16 0.00 0.71 0.00 0.00 54.79 52.81 1gjs n ASP 16 Cb 0.44 -1.67 0.61 0.00 -0.02 0.00 0.00 41.12 40.47 1gjs n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gjs h ALA 17 N 7.01 1.01 -1.00 2.24 0.00 -2.02 -3.02 119.26 123.48 1gjs h ALA 17 Ca 0.45 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.32 1gjs h ALA 17 Cb 0.80 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1gjs h ALA 17 CO 1.52 0.05 0.66 -0.91 0.00 0.00 0.00 179.25 180.57 1gjs h ASN 18 N 0.00 1.16 -0.68 0.00 -0.26 -1.99 -2.09 115.58 111.72 1gjs h ASN 18 Ca -0.00 -0.03 0.01 0.00 -0.56 0.00 0.00 56.30 55.71 1gjs h ASN 18 Cb 0.58 -0.29 -0.03 0.00 -1.06 0.00 0.00 38.32 37.52 1gjs h ASN 18 CO 0.01 0.84 0.45 0.77 -1.06 0.00 0.00 177.43 178.44 1gjs h SER 19 N 1.36 0.78 -0.00 5.81 4.64 -1.94 1.08 113.55 125.28 1gjs h SER 19 Ca 0.37 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1gjs h SER 19 Cb -0.15 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 61.75 1gjs h SER 19 CO -0.08 0.57 0.00 0.25 -0.87 0.00 0.00 176.83 176.70 1gjs h LEU 20 N 0.92 0.00 -0.57 5.97 5.85 -1.55 -0.46 115.31 125.48 1gjs h LEU 20 Ca 0.25 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.84 1gjs h LEU 20 Cb -0.11 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1gjs h LEU 20 CO -0.05 0.00 -0.22 0.00 -0.34 0.00 0.00 178.44 177.83 1gjs h ALA 21 N 1.00 0.76 -1.01 1.25 0.00 -0.95 -2.94 119.26 117.36 1gjs h ALA 21 Ca 0.00 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.53 1gjs h ALA 21 Cb -0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1gjs h ALA 21 CO -0.00 0.66 0.67 1.49 0.00 0.00 0.00 179.25 182.07 1gjs h GLU 22 N 0.79 1.33 -1.01 0.00 4.81 0.15 -1.15 114.58 119.50 1gjs h GLU 22 Ca 0.10 -0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.31 1gjs h GLU 22 Cb 0.78 -0.30 -0.06 0.00 0.63 0.00 0.00 28.75 29.79 1gjs h GLU 22 CO 0.06 0.88 0.65 0.00 -0.73 0.00 0.00 179.01 179.88 1gjs h ALA 23 N 1.37 1.38 -0.57 2.92 0.00 -0.91 0.31 119.26 123.76 1gjs h ALA 23 Ca 0.37 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1gjs h ALA 23 Cb -0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.28 1gjs h ALA 23 CO -0.08 0.49 -0.07 0.87 0.00 0.00 0.00 179.25 180.45 1gjs h LYS 24 N 1.22 1.06 -0.26 0.00 1.57 -1.22 -0.12 116.57 118.82 1gjs h LYS 24 Ca 0.42 -0.38 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1gjs h LYS 24 Cb 0.11 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1gjs h LYS 24 CO -0.16 1.08 0.04 0.28 -0.57 0.00 0.00 179.45 180.12 1gjs h VAL 25 N 0.95 1.23 -0.69 0.50 2.07 0.01 0.55 116.25 120.87 1gjs h VAL 25 Ca 0.15 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1gjs h VAL 25 Cb 0.65 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1gjs h VAL 25 CO 0.04 0.25 0.34 -0.07 0.02 0.00 0.00 177.57 178.15 1gjs h LEU 26 N 0.24 0.90 -0.74 2.57 3.38 -0.32 -2.14 115.31 119.20 1gjs h LEU 26 Ca 0.08 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1gjs h LEU 26 Cb 0.33 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1gjs h LEU 26 CO 0.01 0.78 -0.48 0.00 0.09 0.00 0.00 178.44 178.83 1gjs h ALA 27 N 1.16 0.92 -0.37 1.53 0.00 -0.79 -2.75 119.26 118.96 1gjs h ALA 27 Ca 0.24 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1gjs h ALA 27 Cb 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1gjs h ALA 27 CO -0.03 0.65 0.24 -0.97 0.00 0.00 0.00 179.25 179.15 1gjs h ASN 28 N 0.29 0.42 0.62 0.00 -0.73 0.73 -2.09 115.58 114.84 1gjs h ASN 28 Ca 0.02 -0.01 -0.08 0.00 1.87 0.00 0.00 56.30 58.09 1gjs h ASN 28 Cb 0.95 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.43 1gjs h ASN 28 CO 0.08 0.31 -0.38 0.03 -0.37 0.00 0.00 177.43 177.10 1gjs h ARG 29 N 0.50 0.00 -1.00 6.67 3.08 -1.36 -2.99 114.38 119.28 1gjs h ARG 29 Ca 0.14 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.20 1gjs h ARG 29 Cb -0.06 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.94 1gjs h ARG 29 CO -0.03 0.38 0.66 1.49 -1.07 0.00 0.00 179.97 181.40 1gjs h GLU 30 N 0.00 1.31 -0.80 0.04 4.81 -1.07 -1.71 114.58 117.16 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 0.80 -0.30 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1gjs h GLU 30 CO 0.05 0.87 0.51 -0.07 -0.73 0.00 0.00 179.01 179.64 1gjs h LEU 31 N 1.35 0.93 -0.98 1.64 3.38 -1.36 -2.66 115.31 117.61 1gjs h LEU 31 Ca 0.37 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.31 1gjs h LEU 31 Cb -0.16 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.31 1gjs h LEU 31 CO -0.08 0.68 0.65 -0.78 0.09 0.00 0.00 178.44 179.00 1gjs h ASP 32 N 1.09 1.13 -0.71 -0.43 1.82 -1.39 -0.04 116.42 117.89 1gjs h ASP 32 Ca 0.29 -0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.82 1gjs h ASP 32 Cb -0.10 -0.28 -0.03 0.00 0.68 0.00 0.00 39.33 39.60 1gjs h ASP 32 CO -0.06 0.83 0.16 0.07 -1.61 0.00 0.00 179.24 178.62 1gjs h LYS 33 N 1.34 1.14 -0.23 0.28 5.09 -1.37 -2.84 116.57 119.99 1gjs h LYS 33 Ca 0.36 -0.28 -0.18 0.00 0.09 0.00 0.00 60.65 60.63 1gjs h LYS 33 Cb -0.15 -0.15 -0.00 0.00 0.10 0.00 0.00 32.23 32.04 1gjs h LYS 33 CO -0.08 1.01 -0.59 1.88 -2.09 0.00 0.00 179.45 179.59 1gjs h TYR 34 N 1.08 0.94 0.00 0.07 0.05 -1.46 -3.47 116.97 114.17 1gjs h TYR 34 Ca 0.22 -0.35 0.00 0.00 0.05 0.00 0.00 58.73 58.65 1gjs h TYR 34 Cb 0.39 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1gjs h TYR 34 CO 0.03 1.14 0.00 0.41 -1.05 0.00 0.00 178.16 178.70 1gjs n GLY 35 N 0.38 1.09 0.21 3.88 0.00 -0.06 -5.08 105.19 105.62 1gjs n GLY 35 Ca -0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 46.02 45.50 1gjs n GLY 35 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1gjs n VAL 36 N -2.49 0.00 -2.26 1.61 0.24 -1.20 -4.97 118.33 109.26 1gjs n VAL 36 Ca 0.00 -0.03 -0.35 0.00 -2.04 0.00 0.00 64.34 61.92 1gjs n VAL 36 Cb 0.20 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.55 1gjs n VAL 36 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1gjs s SER 37 N -1.67 5.74 0.00 -1.34 0.15 -1.26 -4.90 113.70 110.41 1gjs s SER 37 Ca 0.04 2.16 0.20 0.00 0.70 0.00 0.00 55.95 59.05 1gjs s SER 37 Cb -0.00 -2.58 1.03 0.00 -1.71 0.00 0.00 66.02 62.76 1gjs s SER 37 CO 0.03 -1.20 1.69 -0.90 1.20 0.00 0.00 173.24 174.06 1gjs n ASP 38 N -1.31 0.57 0.09 5.45 5.75 -1.26 -3.66 116.55 122.18 1gjs n ASP 38 Ca 0.11 -1.49 -0.23 0.00 -0.01 0.00 0.00 54.79 53.18 1gjs n ASP 38 Cb 0.51 -0.03 -0.15 0.00 -1.03 0.00 0.00 41.12 40.42 1gjs n ASP 38 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 1gjs h TYR 39 N 0.77 0.74 -0.00 2.11 3.20 -2.02 -3.31 116.97 118.45 1gjs h TYR 39 Ca 0.00 -0.54 0.00 0.00 3.14 0.00 0.00 58.73 61.33 1gjs h TYR 39 Cb 0.17 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 1gjs h TYR 39 CO 0.03 1.50 0.00 1.88 -1.64 0.00 0.00 178.16 179.93 1gjs h TYR 40 N -0.09 0.00 -0.39 -3.82 0.05 -1.97 -1.23 116.97 109.52 1gjs h TYR 40 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.54 1gjs h TYR 40 Cb 1.94 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 39.66 1gjs h TYR 40 CO 0.15 0.00 0.26 1.57 -1.05 0.00 0.00 178.16 179.08 1gjs h LYS 41 N 0.00 0.51 -0.33 4.88 5.09 -1.76 -0.97 116.57 124.00 1gjs h LYS 41 Ca 0.00 -0.03 -0.16 0.00 0.09 0.00 0.00 60.65 60.55 1gjs h LYS 41 Cb 0.00 -0.12 -0.01 0.00 0.10 0.00 0.00 32.23 32.21 1gjs h LYS 41 CO -0.00 0.34 -0.42 -0.91 -2.09 0.00 0.00 179.45 176.37 1gjs h ASN 42 N 0.53 0.88 -0.83 7.07 2.35 -1.38 -2.96 115.58 121.23 1gjs h ASN 42 Ca 0.14 -0.41 0.01 0.00 -0.55 0.00 0.00 56.30 55.49 1gjs h ASN 42 Cb -0.06 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.02 1gjs h ASN 42 CO -0.03 1.18 0.55 0.25 -1.65 0.00 0.00 177.43 177.73 1gjs h LEU 43 N 0.66 0.95 -0.98 1.61 5.85 -1.12 -1.55 115.31 120.74 1gjs h LEU 43 Ca 0.05 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1gjs h LEU 43 Cb 0.99 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.74 1gjs h LEU 43 CO 0.09 0.69 0.60 0.40 -0.34 0.00 0.00 178.44 179.89 1gjs h ILE 44 N 1.13 1.26 -0.96 4.05 2.04 -1.31 -1.37 117.51 122.35 1gjs h ILE 44 Ca 0.31 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.65 1gjs h ILE 44 Cb -0.12 -0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 35.78 1gjs h ILE 44 CO -0.07 0.26 0.63 0.78 0.00 0.00 0.00 178.15 179.76 1gjs h ASN 45 N 1.32 1.11 0.94 1.72 2.35 -1.15 -0.56 115.58 121.32 1gjs h ASN 45 Ca 0.35 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 56.06 1gjs h ASN 45 Cb -0.09 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.00 1gjs h ASN 45 CO -0.07 0.81 -0.02 0.78 -1.65 0.00 0.00 177.43 177.28 1gjs h ASN 46 N 1.31 0.00 -3.80 5.81 2.35 -0.57 -3.44 115.58 117.25 1gjs h ASN 46 Ca 0.35 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.57 1gjs h ASN 46 Cb -0.14 0.00 0.10 0.00 0.05 0.00 0.00 38.32 38.33 1gjs h ASN 46 CO -0.08 0.02 0.80 0.00 -1.65 0.00 0.00 177.43 176.52 1gjs s ALA 47 N -3.71 3.61 -1.80 -0.83 0.00 -0.22 -4.90 121.76 113.92 1gjs s ALA 47 Ca 0.01 1.57 0.15 0.00 0.00 0.00 0.00 51.96 53.68 1gjs s ALA 47 Cb 0.09 -3.62 0.14 0.00 0.00 0.00 0.00 23.12 19.74 1gjs s ALA 47 CO 0.54 -1.03 1.00 0.36 0.00 0.00 0.00 175.76 176.64 1gjs n LYS 48 N 0.87 1.22 -4.09 0.00 2.85 -1.26 -4.97 118.16 112.78 1gjs n LYS 48 Ca 0.03 -1.46 -0.14 0.00 -1.05 0.00 0.00 58.31 55.68 1gjs n LYS 48 Cb 0.39 -1.29 -0.13 0.00 -0.65 0.00 0.00 35.03 33.34 1gjs n LYS 48 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1gjs s THR 49 N -1.21 0.39 0.25 0.58 -4.23 -1.26 -5.03 115.64 105.12 1gjs s THR 49 Ca 0.19 -0.49 0.13 0.00 -1.18 0.00 0.00 61.69 60.33 1gjs s THR 49 Cb 0.13 -0.39 0.02 0.00 1.34 0.00 0.00 72.50 73.60 1gjs s THR 49 CO 0.19 -0.08 1.65 1.62 -0.54 0.00 0.00 174.62 177.46 1gjs h VAL 50 N 4.86 1.28 -1.01 2.29 3.04 -1.93 -2.89 116.25 121.89 1gjs h VAL 50 Ca -0.30 -1.92 0.02 0.00 -1.01 0.00 0.00 66.70 63.49 1gjs h VAL 50 Cb 1.20 2.06 -0.05 0.00 -2.01 0.00 0.00 31.29 32.49 1gjs h VAL 50 CO 0.47 0.53 0.67 -0.33 -1.01 0.00 0.00 177.57 177.90 1gjs h GLU 51 N 0.00 1.31 -0.06 4.17 5.08 -2.01 -0.22 114.58 122.85 1gjs h GLU 51 Ca -0.01 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 1gjs h GLU 51 Cb 1.02 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1gjs h GLU 51 CO 0.07 0.86 -0.48 0.78 -1.00 0.00 0.00 179.01 179.25 1gjs h GLY 52 N 1.35 0.16 1.00 -3.84 0.00 -1.93 -2.37 103.07 97.44 1gjs h GLY 52 Ca 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1gjs h GLY 52 CO -0.09 0.15 0.03 -2.08 0.00 0.00 0.00 176.54 174.55 1gjs h VAL 53 N 0.12 1.01 -0.60 4.60 2.07 -0.85 0.25 116.25 122.85 1gjs h VAL 53 Ca 0.01 -0.03 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 1gjs h VAL 53 Cb 0.89 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1gjs h VAL 53 CO 0.07 0.01 -0.03 0.50 0.02 0.00 0.00 177.57 178.15 1gjs h LYS 54 N 0.05 1.08 0.00 1.57 3.64 -1.38 -2.24 116.57 119.29 1gjs h LYS 54 Ca 0.01 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 1gjs h LYS 54 Cb -0.00 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1gjs h LYS 54 CO -0.00 1.06 0.00 0.00 -2.27 0.00 0.00 179.45 178.24 1gjs n ALA 55 N -2.49 1.95 -0.08 5.00 0.00 -0.90 -2.90 120.51 121.10 1gjs n ALA 55 Ca 0.03 -0.07 -0.16 0.00 0.00 0.00 0.00 53.44 53.23 1gjs n ALA 55 Cb 0.36 -1.34 -0.12 0.00 0.00 0.00 0.00 19.45 18.36 1gjs n ALA 55 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1gjs h LEU 56 N 0.00 0.00 -0.49 0.00 5.85 0.12 -3.24 115.31 117.54 1gjs h LEU 56 Ca 0.00 -0.80 -0.02 0.00 0.84 0.00 0.00 57.88 57.90 1gjs h LEU 56 Cb 0.36 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1gjs h LEU 56 CO 0.00 1.15 0.24 0.40 -0.34 0.00 0.00 178.44 179.89 1gjs h ILE 57 N -1.00 1.19 -1.00 4.05 1.08 -1.51 -0.28 117.51 120.04 1gjs h ILE 57 Ca -0.12 -0.53 0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1gjs h ILE 57 Cb 1.08 0.63 -0.05 0.00 -3.07 0.00 0.00 36.82 35.41 1gjs h ILE 57 CO -0.07 0.21 0.65 -2.24 -0.69 0.00 0.00 178.15 176.01 1gjs h ASP 58 N 0.65 1.15 -0.37 1.72 2.03 -1.70 0.58 116.42 120.48 1gjs h ASP 58 Ca 0.17 -0.03 -0.16 0.00 -0.73 0.00 0.00 57.03 56.27 1gjs h ASP 58 Cb 0.11 -0.29 -0.00 0.00 -0.83 0.00 0.00 39.33 38.32 1gjs h ASP 58 CO -0.02 0.84 -0.41 -0.33 -1.03 0.00 0.00 179.24 178.29 1gjs h GLU 59 N 1.35 0.93 -0.01 4.15 3.07 -1.52 0.67 114.58 123.23 1gjs h GLU 59 Ca 0.36 -0.50 -0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1gjs h GLU 59 Cb -0.15 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.79 1gjs h GLU 59 CO -0.08 1.16 0.00 0.82 -1.40 0.00 0.00 179.01 179.51 1gjs h ILE 60 N 0.75 1.22 -0.39 3.13 2.04 -0.26 -0.64 117.51 123.35 1gjs h ILE 60 Ca 0.05 -0.64 -0.16 0.00 1.00 0.00 0.00 64.86 65.12 1gjs h ILE 60 Cb 1.00 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 1gjs h ILE 60 CO 0.10 0.17 -0.37 -0.07 0.00 0.00 0.00 178.15 177.97 1gjs h LEU 61 N -0.25 1.00 -2.16 1.44 3.38 0.16 -2.65 115.31 116.22 1gjs h LEU 61 Ca 0.00 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1gjs h LEU 61 Cb 0.27 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1gjs h LEU 61 CO 0.00 1.25 -0.07 0.00 0.09 0.00 0.00 178.44 179.71 1gjs h ALA 62 N 0.80 1.33 -0.61 1.53 0.00 0.45 -1.95 119.26 120.80 1gjs h ALA 62 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1gjs h ALA 62 Cb 0.97 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1gjs h ALA 62 CO 0.09 0.09 0.41 0.00 0.00 0.00 0.00 179.25 179.84 1gjs h ALA 63 N 1.93 1.56 -3.60 0.00 0.00 -0.73 -3.42 119.26 115.00 1gjs h ALA 63 Ca -0.00 -0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.35 1gjs h ALA 63 Cb 0.21 -0.25 -0.22 0.00 0.00 0.00 0.00 17.79 17.53 1gjs h ALA 63 CO 0.01 0.41 -0.81 -0.48 0.00 0.00 0.00 179.25 178.37 1gjs s LEU 64 N -9.71 2.29 0.00 0.00 0.05 -0.73 -5.12 118.68 105.46 1gjs s LEU 64 Ca -0.10 -0.67 0.02 0.00 0.05 0.00 0.00 54.13 53.43 1gjs s LEU 64 Cb 0.18 -0.78 0.10 0.00 -2.05 0.00 0.00 46.19 43.63 1gjs s LEU 64 CO 0.76 0.02 0.59 -0.81 -0.55 0.00 0.00 176.35 176.36