#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 4.15 -0.42 0.03 1.02 -1.26 -4.98 119.74 118.29 1gjs s LYS 2 Ca 0.00 2.14 0.07 0.00 0.02 0.00 0.00 55.97 58.20 1gjs s LYS 2 Cb 0.00 -2.89 0.24 0.00 -0.52 0.00 0.00 37.83 34.66 1gjs s LYS 2 CO 0.00 -0.33 0.59 0.00 -0.92 0.00 0.00 175.35 174.69 1gjs n ALA 3 N 0.43 1.49 1.11 5.17 0.00 -1.26 -4.92 120.51 122.53 1gjs n ALA 3 Ca 0.02 -2.85 0.12 0.00 0.00 0.00 0.00 53.44 50.73 1gjs n ALA 3 Cb 0.43 -0.94 0.17 0.00 0.00 0.00 0.00 19.45 19.11 1gjs n ALA 3 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1gjs n ILE 4 N 1.67 0.00 0.35 0.00 5.41 -1.26 -4.15 119.36 121.38 1gjs n ILE 4 Ca 0.19 -0.39 0.05 0.00 1.00 0.00 0.00 62.75 63.61 1gjs n ILE 4 Cb 0.55 1.20 0.22 0.00 -0.71 0.00 0.00 39.64 40.90 1gjs n ILE 4 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 1gjs n PHE 5 N 0.76 0.00 0.00 1.39 -1.74 -1.26 -2.98 117.46 113.62 1gjs n PHE 5 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.03 1gjs n PHE 5 Cb 0.52 -0.50 0.00 0.00 1.52 0.00 0.00 39.48 41.02 1gjs n PHE 5 CO 0.00 0.00 0.00 1.33 -0.56 0.00 0.00 176.76 177.53 1gjs n VAL 6 N -1.50 1.01 1.14 1.97 0.24 -1.26 -0.99 118.33 118.94 1gjs n VAL 6 Ca 0.02 0.49 0.00 0.00 -2.04 0.00 0.00 64.34 62.82 1gjs n VAL 6 Cb 0.12 -1.49 0.00 0.00 -1.47 0.00 0.00 33.84 31.00 1gjs n VAL 6 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1gjs n LEU 7 N -1.25 0.16 -4.78 1.34 4.77 -1.16 -4.82 117.00 111.26 1gjs n LEU 7 Ca 0.00 -0.08 -0.41 0.00 -0.03 0.00 0.00 56.01 55.49 1gjs n LEU 7 Cb 0.24 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1gjs n LEU 7 CO 0.00 0.04 1.15 0.59 -1.33 0.00 0.00 177.39 177.84 1gjs n ASN 8 N -0.34 3.86 -4.43 -1.43 3.02 -0.16 -4.93 115.26 110.84 1gjs n ASN 8 Ca 0.00 1.23 -0.44 0.00 -0.03 0.00 0.00 54.58 55.34 1gjs n ASN 8 Cb 0.04 -1.63 -0.07 0.00 -0.61 0.00 0.00 39.78 37.51 1gjs n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gjs s ALA 9 N -1.12 3.43 0.24 5.41 0.00 -1.26 -4.91 121.76 123.55 1gjs s ALA 9 Ca 0.53 -1.82 -0.06 0.00 0.00 0.00 0.00 51.96 50.61 1gjs s ALA 9 Cb -0.47 -3.27 0.23 0.00 0.00 0.00 0.00 23.12 19.61 1gjs s ALA 9 CO 0.64 -1.92 1.86 1.96 0.00 0.00 0.00 175.76 178.30 1gjs h GLN 10 N 8.92 1.26 0.00 0.00 1.08 -1.97 -3.43 115.11 120.98 1gjs h GLN 10 Ca -0.28 -0.14 -0.07 0.00 -1.45 0.00 0.00 58.65 56.71 1gjs h GLN 10 Cb 1.10 -0.25 0.03 0.00 -0.05 0.00 0.00 27.48 28.31 1gjs h GLN 10 CO 0.94 0.91 0.06 0.72 -0.95 0.00 0.00 178.83 180.51 1gjs n HIS 11 N -4.33 -3.85 -3.62 2.96 8.25 -1.26 -5.02 115.22 108.35 1gjs n HIS 11 Ca 0.10 -0.19 -0.27 0.00 -0.26 0.00 0.00 57.72 57.09 1gjs n HIS 11 Cb 0.09 -0.17 -0.10 0.00 1.12 0.00 0.00 29.99 30.93 1gjs n HIS 11 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1gjs n ASP 12 N -3.17 3.38 -3.94 0.41 -0.08 -1.26 -4.98 116.55 106.91 1gjs n ASP 12 Ca 0.03 -3.33 -0.43 0.00 -1.51 0.00 0.00 54.79 49.55 1gjs n ASP 12 Cb 0.10 -0.71 0.00 0.00 2.34 0.00 0.00 41.12 42.85 1gjs n ASP 12 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1gjs n GLU 13 N 1.33 3.71 -2.77 -0.67 -0.58 -1.26 -4.96 120.64 115.44 1gjs n GLU 13 Ca 0.26 -3.69 -0.43 0.00 -0.42 0.00 0.00 57.16 52.87 1gjs n GLU 13 Cb 0.39 -2.88 -0.04 0.00 -0.57 0.00 0.00 31.44 28.34 1gjs n GLU 13 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1gjs s ALA 14 N 0.06 3.27 0.23 0.62 0.00 -1.26 -4.90 121.76 119.77 1gjs s ALA 14 Ca 0.39 -0.64 -0.07 0.00 0.00 0.00 0.00 51.96 51.63 1gjs s ALA 14 Cb 0.08 -3.66 0.22 0.00 0.00 0.00 0.00 23.12 19.75 1gjs s ALA 14 CO 0.02 -1.97 1.89 -0.24 0.00 0.00 0.00 175.76 175.45 1gjs h VAL 15 N 6.04 1.25 -2.95 0.00 3.04 -2.06 -3.41 116.25 118.16 1gjs h VAL 15 Ca -0.24 -0.52 -0.64 0.00 -1.01 0.00 0.00 66.70 64.30 1gjs h VAL 15 Cb 1.07 -0.05 -0.09 0.00 -2.01 0.00 0.00 31.29 30.21 1gjs h VAL 15 CO 1.03 0.26 -0.48 1.51 -1.01 0.00 0.00 177.57 178.88 1gjs s ASP 16 N -6.12 6.31 0.00 3.17 -4.77 -1.26 -4.83 116.67 109.18 1gjs s ASP 16 Ca -0.13 0.37 0.00 0.00 -3.30 0.00 0.00 52.55 49.49 1gjs s ASP 16 Cb 0.17 -2.08 0.00 0.00 -1.09 0.00 0.00 42.92 39.91 1gjs s ASP 16 CO 0.82 0.30 0.00 0.00 0.70 0.00 0.00 175.17 176.98 1gjs n ALA 17 N 2.72 0.00 -0.18 2.11 0.00 -1.26 -4.97 120.51 118.93 1gjs n ALA 17 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 1gjs n ALA 17 Cb 0.54 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.01 1gjs n ALA 17 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1gjs h ASN 18 N 0.00 0.60 -0.28 0.00 -0.00 -1.95 0.55 115.58 114.50 1gjs h ASN 18 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.28 1gjs h ASN 18 Cb 0.00 -0.15 -0.01 0.00 -0.00 0.00 0.00 38.32 38.16 1gjs h ASN 18 CO 0.00 0.43 0.15 -1.28 -0.00 0.00 0.00 177.43 176.74 1gjs h SER 19 N 0.71 0.35 -0.04 1.15 0.87 -1.99 0.22 113.55 114.81 1gjs h SER 19 Ca 0.19 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1gjs h SER 19 Cb -0.08 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1gjs h SER 19 CO -0.04 0.34 0.03 0.25 -0.53 0.00 0.00 176.83 176.87 1gjs h LEU 20 N 0.33 0.05 -0.79 2.23 5.85 -1.84 -1.92 115.31 119.21 1gjs h LEU 20 Ca 0.10 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1gjs h LEU 20 Cb 0.06 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1gjs h LEU 20 CO -0.02 0.04 0.32 0.00 -0.34 0.00 0.00 178.44 178.44 1gjs h ALA 21 N 1.01 1.03 -0.93 1.25 0.00 -0.69 -2.65 119.26 118.28 1gjs h ALA 21 Ca 0.02 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1gjs h ALA 21 Cb -0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.43 1gjs h ALA 21 CO -0.00 0.65 0.62 1.49 0.00 0.00 0.00 179.25 182.01 1gjs h GLU 22 N 1.15 1.23 -0.65 0.00 4.57 -0.25 0.26 114.58 120.89 1gjs h GLU 22 Ca 0.26 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 1gjs h GLU 22 Cb 0.21 -0.28 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 1gjs h GLU 22 CO -0.02 0.81 0.42 0.00 -1.18 0.00 0.00 179.01 179.04 1gjs h ALA 23 N 1.34 0.83 -0.44 2.92 0.00 -1.01 0.40 119.26 123.30 1gjs h ALA 23 Ca 0.34 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 1gjs h ALA 23 Cb -0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1gjs h ALA 23 CO -0.07 0.27 -0.30 0.87 0.00 0.00 0.00 179.25 180.01 1gjs h LYS 24 N 0.88 0.97 -0.09 0.00 1.57 -1.12 -0.72 116.57 118.06 1gjs h LYS 24 Ca 0.24 -0.46 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1gjs h LYS 24 Cb -0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1gjs h LYS 24 CO -0.05 1.13 0.02 0.28 -0.57 0.00 0.00 179.45 180.26 1gjs h VAL 25 N 0.82 1.21 -0.90 0.50 2.07 0.08 0.25 116.25 120.27 1gjs h VAL 25 Ca 0.09 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1gjs h VAL 25 Cb 0.89 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 1gjs h VAL 25 CO 0.08 0.19 0.48 -0.07 0.02 0.00 0.00 177.57 178.27 1gjs h LEU 26 N -0.09 1.13 -0.68 2.57 3.38 -0.18 -1.69 115.31 119.74 1gjs h LEU 26 Ca 0.03 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 1gjs h LEU 26 Cb 0.28 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1gjs h LEU 26 CO 0.00 0.91 -0.25 0.00 0.09 0.00 0.00 178.44 179.19 1gjs h ALA 27 N 1.26 0.87 -1.01 1.53 0.00 -0.92 -2.76 119.26 118.23 1gjs h ALA 27 Ca 0.32 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1gjs h ALA 27 Cb 0.04 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1gjs h ALA 27 CO -0.05 0.63 0.67 -0.97 0.00 0.00 0.00 179.25 179.53 1gjs h ASN 28 N 0.64 1.16 -0.32 0.00 -0.73 0.24 -1.68 115.58 114.89 1gjs h ASN 28 Ca 0.08 -0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.18 1gjs h ASN 28 Cb 0.76 -0.29 -0.02 0.00 0.27 0.00 0.00 38.32 39.04 1gjs h ASN 28 CO 0.06 0.84 0.06 0.03 -0.37 0.00 0.00 177.43 178.06 1gjs h ARG 29 N 1.37 0.62 -0.95 6.67 2.47 -1.06 -2.62 114.38 120.87 1gjs h ARG 29 Ca 0.37 -0.12 0.01 0.00 -1.26 0.00 0.00 59.98 58.98 1gjs h ARG 29 Cb -0.16 -0.10 -0.05 0.00 -1.65 0.00 0.00 29.97 28.02 1gjs h ARG 29 CO -0.08 0.59 0.63 0.93 0.56 0.00 0.00 179.97 182.60 1gjs h GLU 30 N 0.60 1.26 -0.48 0.04 5.08 -1.11 -1.33 114.58 118.64 1gjs h GLU 30 Ca 0.13 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1gjs h GLU 30 Cb 0.28 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1gjs h GLU 30 CO 0.00 0.84 0.32 -0.07 -1.00 0.00 0.00 179.01 179.10 1gjs h LEU 31 N 1.30 0.55 -0.98 1.33 3.38 -1.36 -1.91 115.31 117.61 1gjs h LEU 31 Ca 0.35 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1gjs h LEU 31 Cb -0.14 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1gjs h LEU 31 CO -0.07 0.40 0.61 -0.78 0.09 0.00 0.00 178.44 178.68 1gjs h ASP 32 N 0.65 1.15 -1.00 -0.43 1.82 -1.34 1.12 116.42 118.39 1gjs h ASP 32 Ca 0.18 -0.05 0.01 0.00 -0.39 0.00 0.00 57.03 56.77 1gjs h ASP 32 Cb -0.07 -0.29 -0.05 0.00 0.68 0.00 0.00 39.33 39.60 1gjs h ASP 32 CO -0.04 0.86 0.66 0.11 -1.61 0.00 0.00 179.24 179.22 1gjs h LYS 33 N 1.33 1.31 -0.02 0.28 1.79 -0.49 -2.60 116.57 118.18 1gjs h LYS 33 Ca 0.35 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1gjs h LYS 33 Cb -0.10 -0.30 0.00 0.00 -1.58 0.00 0.00 32.23 30.25 1gjs h LYS 33 CO -0.07 0.87 -0.27 0.66 -1.08 0.00 0.00 179.45 179.56 1gjs n TYR 34 N -4.38 0.00 -3.04 -1.35 4.01 -0.94 -4.98 117.16 106.48 1gjs n TYR 34 Ca 0.12 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.69 1gjs n TYR 34 Cb 0.01 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.08 1gjs n TYR 34 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gjs n GLY 35 N 1.30 -0.19 3.73 2.72 0.00 0.38 -4.98 105.19 108.15 1gjs n GLY 35 Ca 0.10 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1gjs n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gjs s VAL 36 N -3.11 2.90 0.29 1.61 1.01 -0.57 -4.90 120.40 117.63 1gjs s VAL 36 Ca 0.32 0.29 -0.28 0.00 0.00 0.00 0.00 61.98 62.31 1gjs s VAL 36 Cb -0.14 -2.75 -0.14 0.00 0.00 0.00 0.00 36.38 33.35 1gjs s VAL 36 CO 0.39 -0.38 1.01 -1.20 0.00 0.00 0.00 175.10 174.92 1gjs n SER 37 N -3.77 1.31 0.13 3.32 7.64 -1.26 -4.80 113.62 116.18 1gjs n SER 37 Ca 0.08 1.18 0.12 0.00 1.01 0.00 0.00 58.87 61.26 1gjs n SER 37 Cb 0.54 -1.29 0.49 0.00 -1.01 0.00 0.00 64.21 62.94 1gjs n SER 37 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1gjs n ASP 38 N 1.22 0.64 -0.14 6.43 8.00 -1.26 -3.05 116.55 128.40 1gjs n ASP 38 Ca 0.10 0.66 -0.08 0.00 0.71 0.00 0.00 54.79 56.18 1gjs n ASP 38 Cb 0.32 -0.80 0.01 0.00 -0.02 0.00 0.00 41.12 40.63 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 0.53 0.00 1.24 5.03 -2.03 -1.92 116.97 119.82 1gjs h TYR 39 Ca 0.00 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.32 1gjs h TYR 39 Cb 0.34 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.44 1gjs h TYR 39 CO 0.00 0.33 0.31 1.88 -1.32 0.00 0.00 178.16 179.36 1gjs h TYR 40 N 0.57 0.00 -0.49 -3.82 0.05 -1.91 -0.73 116.97 110.63 1gjs h TYR 40 Ca 0.16 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.81 1gjs h TYR 40 Cb -0.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.66 1gjs h TYR 40 CO -0.05 0.00 -0.19 1.57 -1.05 0.00 0.00 178.16 178.44 1gjs h LYS 41 N 0.00 1.00 -0.79 4.88 2.10 -1.55 -1.38 116.57 120.83 1gjs h LYS 41 Ca 0.00 -0.42 -0.05 0.00 -2.00 0.00 0.00 60.65 58.18 1gjs h LYS 41 Cb 0.61 -0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.87 1gjs h LYS 41 CO 0.00 1.10 0.30 -0.97 -2.00 0.00 0.00 179.45 177.87 1gjs h ASN 42 N 0.86 1.11 -0.83 7.07 -1.24 -1.26 -1.13 115.58 120.16 1gjs h ASN 42 Ca 0.12 -0.18 -0.04 0.00 0.71 0.00 0.00 56.30 56.90 1gjs h ASN 42 Cb 0.77 -0.29 -0.04 0.00 0.73 0.00 0.00 38.32 39.49 1gjs h ASN 42 CO 0.06 0.99 0.36 0.25 -1.29 0.00 0.00 177.43 177.80 1gjs h LEU 43 N 1.16 1.11 -0.73 0.34 5.85 -1.47 -2.29 115.31 119.29 1gjs h LEU 43 Ca 0.26 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1gjs h LEU 43 Cb 0.24 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1gjs h LEU 43 CO -0.02 0.97 0.26 0.40 -0.34 0.00 0.00 178.44 179.71 1gjs h ILE 44 N 1.19 1.26 -0.75 4.05 1.08 -0.60 -2.30 117.51 121.44 1gjs h ILE 44 Ca 0.28 -0.85 0.21 0.00 -0.39 0.00 0.00 64.86 64.11 1gjs h ILE 44 Cb 0.18 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 34.32 1gjs h ILE 44 CO -0.03 0.34 0.54 0.78 -0.69 0.00 0.00 178.15 179.09 1gjs h ASN 45 N 1.07 0.05 -0.66 1.72 -0.26 -0.63 0.66 115.58 117.53 1gjs h ASN 45 Ca 0.24 0.00 -0.37 0.00 -0.56 0.00 0.00 56.30 55.61 1gjs h ASN 45 Cb 0.26 -0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 37.30 1gjs h ASN 45 CO -0.01 0.02 0.21 -0.46 -1.06 0.00 0.00 177.43 176.12 1gjs n ASN 46 N -4.34 3.64 -4.74 5.81 0.23 -0.87 -5.02 115.26 109.96 1gjs n ASN 46 Ca 0.15 -3.74 -0.42 0.00 -0.53 0.00 0.00 54.58 50.05 1gjs n ASN 46 Cb 0.79 -0.72 -0.01 0.00 -2.08 0.00 0.00 39.78 37.77 1gjs n ASN 46 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gjs n ALA 47 N -1.08 2.03 -0.23 -2.53 0.00 0.22 -4.89 120.51 114.03 1gjs n ALA 47 Ca 0.46 0.36 -0.09 0.00 0.00 0.00 0.00 53.44 54.17 1gjs n ALA 47 Cb 1.20 -2.37 0.03 0.00 0.00 0.00 0.00 19.45 18.31 1gjs n ALA 47 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1gjs h LYS 48 N 3.30 1.10 -3.29 0.00 1.57 -1.91 -3.47 116.57 113.88 1gjs h LYS 48 Ca -0.48 -0.32 0.01 0.00 -1.87 0.00 0.00 60.65 57.99 1gjs h LYS 48 Cb 1.25 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 33.38 1gjs h LYS 48 CO 0.68 1.04 0.07 -0.08 -0.57 0.00 0.00 179.45 180.59 1gjs s THR 49 N -5.12 0.00 0.23 -0.16 -1.32 -1.26 -5.03 115.64 102.97 1gjs s THR 49 Ca -0.12 -1.19 -0.05 0.00 -1.21 0.00 0.00 61.69 59.12 1gjs s THR 49 Cb 0.14 -2.10 0.12 0.00 -1.51 0.00 0.00 72.50 69.15 1gjs s THR 49 CO 0.86 0.00 1.75 -0.37 -2.21 0.00 0.00 174.62 174.64 1gjs h VAL 50 N 2.11 1.25 -1.00 5.08 -1.51 -1.95 -2.54 116.25 117.69 1gjs h VAL 50 Ca -0.22 -0.96 0.01 0.00 -1.23 0.00 0.00 66.70 64.30 1gjs h VAL 50 Cb 1.25 0.65 -0.05 0.00 -2.13 0.00 0.00 31.29 31.01 1gjs h VAL 50 CO 0.29 0.36 0.66 -0.33 -1.23 0.00 0.00 177.57 177.32 1gjs h GLU 51 N 0.94 1.32 0.00 5.19 5.08 -2.01 -1.82 114.58 123.28 1gjs h GLU 51 Ca 0.19 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.39 1gjs h GLU 51 Cb 0.38 -0.30 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1gjs h GLU 51 CO 0.01 0.87 -0.42 0.78 -1.00 0.00 0.00 179.01 179.24 1gjs h GLY 52 N 1.36 0.00 0.99 -3.84 0.00 -1.88 -2.87 103.07 96.83 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 0.02 -2.08 0.00 0.00 0.00 176.54 174.40 1gjs h VAL 53 N 0.00 1.00 -0.37 4.60 2.07 -0.93 0.60 116.25 123.23 1gjs h VAL 53 Ca -0.00 -0.01 -0.17 0.00 0.82 0.00 0.00 66.70 67.34 1gjs h VAL 53 Cb 0.82 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1gjs h VAL 53 CO 0.06 0.01 -0.42 0.11 0.02 0.00 0.00 177.57 177.35 1gjs h LYS 54 N 0.04 0.93 -0.15 1.57 1.57 -1.55 -3.13 116.57 115.84 1gjs h LYS 54 Ca 0.01 -0.51 -0.13 0.00 -1.87 0.00 0.00 60.65 58.15 1gjs h LYS 54 Cb -0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1gjs h LYS 54 CO -0.01 1.16 -0.46 0.00 -0.57 0.00 0.00 179.45 179.57 1gjs h ALA 55 N 0.76 0.92 -0.42 3.86 0.00 -1.31 -2.83 119.26 120.24 1gjs h ALA 55 Ca 0.05 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.51 1gjs h ALA 55 Cb 1.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1gjs h ALA 55 CO 0.10 0.65 0.28 1.25 0.00 0.00 0.00 179.25 181.53 1gjs h LEU 56 N 0.31 0.48 -1.05 0.00 5.85 0.27 -1.32 115.31 119.85 1gjs h LEU 56 Ca 0.02 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1gjs h LEU 56 Cb 0.94 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1gjs h LEU 56 CO 0.08 0.35 0.46 0.40 -0.34 0.00 0.00 178.44 179.39 1gjs h ILE 57 N 0.57 1.23 -0.98 4.05 1.08 -1.49 -0.74 117.51 121.23 1gjs h ILE 57 Ca 0.16 -0.56 0.01 0.00 -0.39 0.00 0.00 64.86 64.08 1gjs h ILE 57 Cb -0.06 0.12 -0.05 0.00 -3.07 0.00 0.00 36.82 33.76 1gjs h ILE 57 CO -0.04 0.26 0.64 0.44 -0.69 0.00 0.00 178.15 178.76 1gjs h ASP 58 N 1.13 1.13 -0.34 1.72 3.32 -1.03 0.60 116.42 122.95 1gjs h ASP 58 Ca 0.29 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.13 1gjs h ASP 58 Cb 0.00 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.26 1gjs h ASP 58 CO -0.05 0.82 -0.46 -0.33 -1.72 0.00 0.00 179.24 177.51 1gjs h GLU 59 N 1.33 0.91 -0.15 3.56 4.39 -0.61 0.69 114.58 124.71 1gjs h GLU 59 Ca 0.36 -0.53 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 1gjs h GLU 59 Cb -0.14 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1gjs h GLU 59 CO -0.08 1.17 -0.06 0.82 -1.16 0.00 0.00 179.01 179.70 1gjs h ILE 60 N 0.72 1.31 -0.21 3.13 2.04 -0.37 -2.52 117.51 121.62 1gjs h ILE 60 Ca 0.04 -1.08 -0.14 0.00 1.00 0.00 0.00 64.86 64.68 1gjs h ILE 60 Cb 1.06 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 1gjs h ILE 60 CO 0.11 0.32 -0.45 -0.07 0.00 0.00 0.00 178.15 178.06 1gjs h LEU 61 N -0.01 0.55 -1.17 1.44 3.38 0.15 -3.00 115.31 116.65 1gjs h LEU 61 Ca 0.04 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1gjs h LEU 61 Cb 0.52 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1gjs h LEU 61 CO 0.02 0.93 0.56 0.00 0.09 0.00 0.00 178.44 180.04 1gjs h ALA 62 N 1.10 1.40 -0.64 1.53 0.00 -0.79 0.11 119.26 121.97 1gjs h ALA 62 Ca 0.03 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1gjs h ALA 62 Cb 0.95 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1gjs h ALA 62 CO 0.08 0.55 0.13 0.00 0.00 0.00 0.00 179.25 180.02 1gjs h ALA 63 N 1.47 1.03 -2.52 0.00 0.00 -1.31 -3.35 119.26 114.59 1gjs h ALA 63 Ca 0.31 -0.24 -0.60 0.00 0.00 0.00 0.00 54.91 54.38 1gjs h ALA 63 Cb -0.12 -0.25 -0.39 0.00 0.00 0.00 0.00 17.79 17.03 1gjs h ALA 63 CO -0.07 0.63 -0.87 1.47 0.00 0.00 0.00 179.25 180.40 1gjs n LEU 64 N -4.24 0.54 0.00 0.00 -0.00 -0.67 -5.14 117.00 107.50 1gjs n LEU 64 Ca 0.05 -4.63 0.10 0.00 -0.00 0.00 0.00 56.01 51.53 1gjs n LEU 64 Cb 0.26 0.19 0.62 0.00 -0.00 0.00 0.00 43.42 44.49 1gjs n LEU 64 CO 0.42 1.85 0.81 -0.81 -0.00 0.00 0.00 177.39 179.66