#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 4.38 0.11 2.12 2.20 -1.26 -5.01 119.74 122.29 1gjs s LYS 2 Ca 0.00 2.09 -0.19 0.00 -0.36 0.00 0.00 55.97 57.51 1gjs s LYS 2 Cb 0.00 -3.18 0.05 0.00 -1.51 0.00 0.00 37.83 33.19 1gjs s LYS 2 CO 0.00 -0.26 0.47 0.00 -0.36 0.00 0.00 175.35 175.20 1gjs s ALA 3 N -0.01 -1.17 0.00 3.13 0.00 -1.26 -5.04 121.76 117.42 1gjs s ALA 3 Ca 0.56 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.74 1gjs s ALA 3 Cb -0.37 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.41 1gjs s ALA 3 CO 0.40 -0.64 0.00 1.51 0.00 0.00 0.00 175.76 177.03 1gjs n ILE 4 N -0.11 0.00 0.63 0.00 0.13 -1.26 -4.92 119.36 113.84 1gjs n ILE 4 Ca -0.17 0.00 0.12 0.00 -1.10 0.00 0.00 62.75 61.60 1gjs n ILE 4 Cb 0.63 0.00 0.46 0.00 -0.84 0.00 0.00 39.64 39.89 1gjs n ILE 4 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 1gjs n PHE 5 N -0.12 0.51 -0.35 9.51 1.16 -1.26 -3.15 117.46 123.76 1gjs n PHE 5 Ca 0.00 0.17 -0.03 0.00 -1.87 0.00 0.00 57.45 55.72 1gjs n PHE 5 Cb 0.00 -0.78 0.10 0.00 -1.61 0.00 0.00 39.48 37.19 1gjs n PHE 5 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1gjs h VAL 6 N 0.00 1.26 -3.82 1.97 2.07 -2.01 -3.42 116.25 112.30 1gjs h VAL 6 Ca 0.00 -0.58 -0.68 0.00 0.82 0.00 0.00 66.70 66.26 1gjs h VAL 6 Cb 0.49 -0.06 -0.20 0.00 -1.52 0.00 0.00 31.29 30.00 1gjs h VAL 6 CO 0.00 0.28 -0.79 -0.76 0.02 0.00 0.00 177.57 176.32 1gjs s LEU 7 N -9.99 2.71 0.30 2.57 1.43 -1.19 -5.14 118.68 109.38 1gjs s LEU 7 Ca -0.13 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.55 1gjs s LEU 7 Cb 0.17 -1.57 -0.06 0.00 0.03 0.00 0.00 46.19 44.76 1gjs s LEU 7 CO 0.83 0.22 0.07 0.54 0.23 0.00 0.00 176.35 178.24 1gjs s ASN 8 N -1.76 1.94 -0.54 2.29 2.20 -1.26 -4.95 114.94 112.86 1gjs s ASN 8 Ca 0.17 -1.38 -0.26 0.00 -0.94 0.00 0.00 52.86 50.44 1gjs s ASN 8 Cb -0.11 0.01 -0.07 0.00 -2.00 0.00 0.00 41.25 39.08 1gjs s ASN 8 CO 0.08 -0.66 2.36 0.00 -2.94 0.00 0.00 177.10 175.95 1gjs s ALA 9 N -3.47 1.55 0.51 3.54 0.00 -1.26 -4.93 121.76 117.71 1gjs s ALA 9 Ca 0.37 -0.14 -0.17 0.00 0.00 0.00 0.00 51.96 52.02 1gjs s ALA 9 Cb 0.08 -4.37 -0.08 0.00 0.00 0.00 0.00 23.12 18.75 1gjs s ALA 9 CO 0.15 -4.61 0.99 -1.14 0.00 0.00 0.00 175.76 171.15 1gjs s GLN 10 N 8.24 3.95 -0.03 0.00 0.74 -1.26 -4.97 119.66 126.33 1gjs s GLN 10 Ca 0.94 0.99 -0.30 0.00 0.05 0.00 0.00 55.36 57.04 1gjs s GLN 10 Cb -0.16 -2.14 -0.06 0.00 1.10 0.00 0.00 33.01 31.76 1gjs s GLN 10 CO 0.23 -0.27 1.56 -1.58 -0.55 0.00 0.00 175.29 174.68 1gjs s HIS 11 N -2.56 2.31 0.00 1.67 5.65 -1.26 -4.94 115.29 116.15 1gjs s HIS 11 Ca 0.60 0.42 0.00 0.00 0.25 0.00 0.00 55.06 56.32 1gjs s HIS 11 Cb -0.10 -3.83 0.00 0.00 -1.18 0.00 0.00 32.58 27.47 1gjs s HIS 11 CO 0.29 -3.36 0.00 -0.25 -0.65 0.00 0.00 174.74 170.77 1gjs n ASP 12 N 6.48 0.00 -0.28 9.88 8.00 -1.26 -4.95 116.55 134.42 1gjs n ASP 12 Ca 0.16 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.62 1gjs n ASP 12 Cb 0.43 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.60 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 0.00 1.02 -1.79 -1.24 4.81 -2.06 -3.46 114.58 111.85 1gjs h GLU 13 Ca 0.00 -0.06 0.28 0.00 -0.13 0.00 0.00 59.36 59.45 1gjs h GLU 13 Cb 0.00 -0.23 -0.10 0.00 0.63 0.00 0.00 28.75 29.05 1gjs h GLU 13 CO 0.00 0.68 0.73 0.00 -0.73 0.00 0.00 179.01 179.69 1gjs s ALA 14 N -6.14 -2.07 0.60 2.92 0.00 -1.26 -5.15 121.76 110.67 1gjs s ALA 14 Ca -0.13 0.43 -0.17 0.00 0.00 0.00 0.00 51.96 52.09 1gjs s ALA 14 Cb 0.15 0.50 -0.03 0.00 0.00 0.00 0.00 23.12 23.74 1gjs s ALA 14 CO 0.78 -1.06 1.12 0.54 0.00 0.00 0.00 175.76 177.14 1gjs s VAL 15 N -2.60 3.22 -0.45 0.00 0.11 -1.26 -4.92 120.40 114.49 1gjs s VAL 15 Ca 0.15 0.66 -0.29 0.00 -2.93 0.00 0.00 61.98 59.58 1gjs s VAL 15 Cb 0.02 -3.20 0.01 0.00 -1.53 0.00 0.00 36.38 31.68 1gjs s VAL 15 CO -0.01 -0.26 1.38 -1.81 -3.33 0.00 0.00 175.10 171.07 1gjs s ASP 16 N -2.18 6.33 0.00 3.54 1.01 -1.26 -4.80 116.67 119.31 1gjs s ASP 16 Ca 0.70 0.67 0.10 0.00 0.71 0.00 0.00 52.55 54.72 1gjs s ASP 16 Cb -0.22 -2.54 0.26 0.00 1.01 0.00 0.00 42.92 41.43 1gjs s ASP 16 CO 0.34 -1.47 1.21 0.00 0.21 0.00 0.00 175.17 175.46 1gjs n ALA 17 N 8.87 2.18 -0.37 5.23 0.00 -1.26 -4.60 120.51 130.55 1gjs n ALA 17 Ca 0.15 -1.10 -0.02 0.00 0.00 0.00 0.00 53.44 52.47 1gjs n ALA 17 Cb 0.48 -0.39 0.11 0.00 0.00 0.00 0.00 19.45 19.65 1gjs n ALA 17 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1gjs h ASN 18 N 1.83 1.13 -0.96 0.00 -0.26 -1.99 0.60 115.58 115.93 1gjs h ASN 18 Ca 0.00 -0.03 0.01 0.00 -0.56 0.00 0.00 56.30 55.72 1gjs h ASN 18 Cb 0.69 -0.28 -0.05 0.00 -1.06 0.00 0.00 38.32 37.62 1gjs h ASN 18 CO 0.00 0.82 0.64 0.28 -1.06 0.00 0.00 177.43 178.11 1gjs h SER 19 N 1.34 1.11 -0.37 5.81 0.02 -2.00 0.81 113.55 120.27 1gjs h SER 19 Ca 0.36 -0.03 -0.16 0.00 -0.84 0.00 0.00 61.79 61.12 1gjs h SER 19 Cb -0.16 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.10 1gjs h SER 19 CO -0.08 0.81 -0.40 -0.07 -1.14 0.00 0.00 176.83 175.94 1gjs h LEU 20 N 1.31 0.99 0.08 5.07 3.38 -1.63 -1.58 115.31 122.94 1gjs h LEU 20 Ca 0.35 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1gjs h LEU 20 Cb -0.15 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.32 1gjs h LEU 20 CO -0.08 1.27 -0.04 0.00 0.09 0.00 0.00 178.44 179.68 1gjs h ALA 21 N 0.75 -0.11 -0.56 1.53 0.00 -0.13 0.23 119.26 120.97 1gjs h ALA 21 Ca 0.05 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1gjs h ALA 21 Cb 1.00 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1gjs h ALA 21 CO 0.10 -0.56 0.37 1.49 0.00 0.00 0.00 179.25 180.65 1gjs h GLU 22 N -0.11 0.74 -0.62 0.00 4.81 -0.83 0.86 114.58 119.43 1gjs h GLU 22 Ca -0.01 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1gjs h GLU 22 Cb 0.08 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1gjs h GLU 22 CO 0.02 0.49 0.41 0.00 -0.73 0.00 0.00 179.01 179.20 1gjs h ALA 23 N 1.21 0.79 -0.38 2.92 0.00 -0.89 0.62 119.26 123.52 1gjs h ALA 23 Ca 0.21 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 1gjs h ALA 23 Cb -0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1gjs h ALA 23 CO -0.04 0.22 -0.40 0.87 0.00 0.00 0.00 179.25 179.90 1gjs h LYS 24 N 0.85 0.94 0.19 0.00 1.57 0.15 -0.28 116.57 119.99 1gjs h LYS 24 Ca 0.23 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.49 1gjs h LYS 24 Cb -0.09 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1gjs h LYS 24 CO -0.05 1.16 -0.09 0.28 -0.57 0.00 0.00 179.45 180.18 1gjs h VAL 25 N 0.77 0.91 -1.01 0.50 2.07 0.13 2.24 116.25 121.86 1gjs h VAL 25 Ca 0.06 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 66.97 1gjs h VAL 25 Cb 1.00 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 32.00 1gjs h VAL 25 CO 0.10 0.15 0.66 -0.07 0.02 0.00 0.00 177.57 178.42 1gjs h LEU 26 N -0.59 1.08 0.41 2.57 3.38 0.21 2.09 115.31 124.46 1gjs h LEU 26 Ca -0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1gjs h LEU 26 Cb 0.44 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1gjs h LEU 26 CO 0.04 0.72 -0.20 0.00 0.09 0.00 0.00 178.44 179.10 1gjs h ALA 27 N 1.43 -0.56 -0.82 1.53 0.00 -0.82 -2.57 119.26 117.45 1gjs h ALA 27 Ca 0.41 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1gjs h ALA 27 Cb 0.06 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1gjs h ALA 27 CO -0.14 -0.52 0.53 -0.97 0.00 0.00 0.00 179.25 178.15 1gjs h ASN 28 N -1.15 0.96 -0.91 0.00 -0.73 0.39 -2.40 115.58 111.75 1gjs h ASN 28 Ca -0.06 -0.04 0.01 0.00 1.87 0.00 0.00 56.30 58.08 1gjs h ASN 28 Cb 0.43 -0.24 -0.04 0.00 0.27 0.00 0.00 38.32 38.73 1gjs h ASN 28 CO 0.09 0.71 0.60 -0.09 -0.37 0.00 0.00 177.43 178.37 1gjs h ARG 29 N 1.12 1.19 -0.97 6.67 9.65 0.33 -1.91 114.38 130.47 1gjs h ARG 29 Ca 0.30 -0.07 0.01 0.00 -1.10 0.00 0.00 59.98 59.12 1gjs h ARG 29 Cb -0.10 -0.27 -0.05 0.00 -1.39 0.00 0.00 29.97 28.16 1gjs h ARG 29 CO -0.06 0.79 0.64 1.49 2.80 0.00 0.00 179.97 185.63 1gjs h GLU 30 N 1.23 1.28 -0.71 0.20 4.57 -1.00 -1.51 114.58 118.64 1gjs h GLU 30 Ca 0.33 -0.08 -0.06 0.00 -1.18 0.00 0.00 59.36 58.37 1gjs h GLU 30 Cb -0.14 -0.29 -0.03 0.00 -0.16 0.00 0.00 28.75 28.13 1gjs h GLU 30 CO -0.07 0.85 0.19 -0.07 -1.18 0.00 0.00 179.01 178.72 1gjs h LEU 31 N 1.32 1.05 -1.04 1.64 3.38 -1.25 -2.46 115.31 117.94 1gjs h LEU 31 Ca 0.36 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1gjs h LEU 31 Cb -0.15 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.28 1gjs h LEU 31 CO -0.08 0.99 0.64 -0.78 0.09 0.00 0.00 178.44 179.31 1gjs h ASP 32 N 1.06 1.12 -0.28 -0.43 1.82 -0.72 0.26 116.42 119.25 1gjs h ASP 32 Ca 0.22 -0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.84 1gjs h ASP 32 Cb 0.34 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.06 1gjs h ASP 32 CO -0.00 0.81 0.17 0.50 -1.61 0.00 0.00 179.24 179.11 1gjs h LYS 33 N 1.32 0.33 -0.03 0.28 3.64 -0.86 -1.81 116.57 119.44 1gjs h LYS 33 Ca 0.36 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.61 1gjs h LYS 33 Cb -0.15 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1gjs h LYS 33 CO -0.08 0.22 -0.49 1.88 -2.27 0.00 0.00 179.45 178.71 1gjs h TYR 34 N 0.34 0.10 0.00 1.91 0.05 -1.27 -3.47 116.97 114.63 1gjs h TYR 34 Ca 0.11 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1gjs h TYR 34 Cb -0.01 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.71 1gjs h TYR 34 CO -0.07 0.56 0.00 0.41 -1.05 0.00 0.00 178.16 178.01 1gjs n GLY 35 N -0.07 0.77 3.33 3.88 0.00 0.86 -5.06 105.19 108.90 1gjs n GLY 35 Ca -0.02 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1gjs n GLY 35 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1gjs n VAL 36 N -2.37 0.00 -1.78 1.61 0.31 -0.97 -4.85 118.33 110.28 1gjs n VAL 36 Ca 0.00 -0.36 -0.41 0.00 -0.01 0.00 0.00 64.34 63.56 1gjs n VAL 36 Cb 0.00 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 1gjs n VAL 36 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1gjs s SER 37 N -2.02 6.27 0.24 4.52 0.15 -1.26 -4.84 113.70 116.76 1gjs s SER 37 Ca 0.60 3.07 0.19 0.00 0.70 0.00 0.00 55.95 60.51 1gjs s SER 37 Cb -0.16 -2.67 0.94 0.00 -1.71 0.00 0.00 66.02 62.42 1gjs s SER 37 CO 0.66 -0.93 1.59 0.47 1.20 0.00 0.00 173.24 176.23 1gjs n ASP 38 N 0.37 0.50 0.01 5.45 8.00 -1.26 -2.69 116.55 126.93 1gjs n ASP 38 Ca 0.01 0.68 -0.11 0.00 0.71 0.00 0.00 54.79 56.08 1gjs n ASP 38 Cb 0.39 -0.77 -0.06 0.00 -0.02 0.00 0.00 41.12 40.67 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 0.08 -0.98 1.24 3.20 -2.00 -0.93 116.97 117.58 1gjs h TYR 39 Ca 0.00 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.88 1gjs h TYR 39 Cb 0.14 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.33 1gjs h TYR 39 CO 0.00 0.05 0.65 1.88 -1.64 0.00 0.00 178.16 179.10 1gjs h TYR 40 N 0.09 1.23 -0.63 -3.82 0.05 -1.89 -0.73 116.97 111.27 1gjs h TYR 40 Ca 0.03 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1gjs h TYR 40 Cb -0.01 -0.42 -0.03 0.00 1.01 0.00 0.00 36.73 37.28 1gjs h TYR 40 CO -0.08 0.77 0.41 0.87 -1.05 0.00 0.00 178.16 179.08 1gjs h LYS 41 N 1.32 0.84 -0.98 4.88 1.57 -1.56 -1.06 116.57 121.58 1gjs h LYS 41 Ca 0.36 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1gjs h LYS 41 Cb -0.14 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 31.94 1gjs h LYS 41 CO -0.08 0.57 0.62 -0.91 -0.57 0.00 0.00 179.45 179.08 1gjs h ASN 42 N 0.86 1.15 -0.97 0.86 -0.26 -0.15 -1.65 115.58 115.41 1gjs h ASN 42 Ca 0.23 -0.05 0.01 0.00 -0.56 0.00 0.00 56.30 55.93 1gjs h ASN 42 Cb -0.08 -0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 36.85 1gjs h ASN 42 CO -0.05 0.86 0.64 0.25 -1.06 0.00 0.00 177.43 178.07 1gjs h LEU 43 N 1.34 1.12 -1.01 1.61 5.85 0.05 -1.31 115.31 122.96 1gjs h LEU 43 Ca 0.35 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.05 1gjs h LEU 43 Cb -0.11 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.59 1gjs h LEU 43 CO -0.07 0.81 0.67 0.40 -0.34 0.00 0.00 178.44 179.91 1gjs h ILE 44 N 1.32 1.26 -0.39 4.05 1.08 -0.37 -0.90 117.51 123.57 1gjs h ILE 44 Ca 0.36 -0.47 0.05 0.00 -0.39 0.00 0.00 64.86 64.41 1gjs h ILE 44 Cb -0.15 -0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 33.36 1gjs h ILE 44 CO -0.08 0.25 0.26 -1.13 -0.69 0.00 0.00 178.15 176.77 1gjs h ASN 45 N 1.37 0.26 -0.10 1.72 -1.24 -0.85 0.73 115.58 117.47 1gjs h ASN 45 Ca 0.37 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.38 1gjs h ASN 45 Cb -0.16 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 38.84 1gjs h ASN 45 CO -0.08 0.17 0.00 0.59 -1.29 0.00 0.00 177.43 176.82 1gjs n ASN 46 N -4.48 1.48 -4.78 1.15 5.03 -0.38 -4.92 115.26 108.37 1gjs n ASN 46 Ca 0.05 -1.60 -0.41 0.00 0.87 0.00 0.00 54.58 53.49 1gjs n ASN 46 Cb 0.24 -0.06 -0.00 0.00 -1.02 0.00 0.00 39.78 38.94 1gjs n ASN 46 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gjs n ALA 47 N 0.18 2.45 0.06 5.41 0.00 0.25 -4.91 120.51 123.95 1gjs n ALA 47 Ca 0.17 0.34 0.02 0.00 0.00 0.00 0.00 53.44 53.97 1gjs n ALA 47 Cb 0.32 -2.43 -0.05 0.00 0.00 0.00 0.00 19.45 17.28 1gjs n ALA 47 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1gjs h LYS 48 N 3.13 0.00 -3.76 0.00 2.10 -1.91 -3.49 116.57 112.64 1gjs h LYS 48 Ca -0.51 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.04 1gjs h LYS 48 Cb 1.24 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.48 1gjs h LYS 48 CO 0.65 0.30 -0.14 -0.08 -2.00 0.00 0.00 179.45 178.19 1gjs s THR 49 N -2.97 0.00 0.22 0.07 -1.32 -1.26 -5.05 115.64 105.33 1gjs s THR 49 Ca -0.01 -1.46 -0.04 0.00 -1.21 0.00 0.00 61.69 58.97 1gjs s THR 49 Cb 0.09 -2.34 0.04 0.00 -1.51 0.00 0.00 72.50 68.78 1gjs s THR 49 CO 0.80 0.00 1.64 -0.37 -2.21 0.00 0.00 174.62 174.48 1gjs h VAL 50 N 2.23 1.27 -1.00 5.08 -1.51 -1.97 -2.43 116.25 117.92 1gjs h VAL 50 Ca -0.27 -1.30 0.01 0.00 -1.23 0.00 0.00 66.70 63.91 1gjs h VAL 50 Cb 1.25 1.16 -0.05 0.00 -2.13 0.00 0.00 31.29 31.52 1gjs h VAL 50 CO 0.37 0.44 0.67 -0.08 -1.23 0.00 0.00 177.57 177.74 1gjs h GLU 51 N 0.69 1.32 -0.59 5.19 4.81 -1.98 0.32 114.58 124.34 1gjs h GLU 51 Ca 0.10 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 1gjs h GLU 51 Cb 0.70 -0.30 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1gjs h GLU 51 CO 0.05 0.87 -0.03 0.78 -0.73 0.00 0.00 179.01 179.95 1gjs h GLY 52 N 1.36 1.16 0.75 1.92 0.00 -1.92 -0.05 103.07 106.28 1gjs h GLY 52 Ca 0.37 -0.88 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 1gjs h GLY 52 CO -0.08 0.81 0.00 -2.08 0.00 0.00 0.00 176.54 175.19 1gjs h VAL 53 N 0.97 1.20 -0.40 4.60 2.07 -0.76 -0.28 116.25 123.65 1gjs h VAL 53 Ca 0.16 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1gjs h VAL 53 Cb 0.60 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1gjs h VAL 53 CO 0.04 0.16 0.17 0.50 0.02 0.00 0.00 177.57 178.45 1gjs h LYS 54 N -0.24 0.58 0.00 1.57 3.64 -0.31 -2.53 116.57 119.28 1gjs h LYS 54 Ca 0.00 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1gjs h LYS 54 Cb 0.25 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1gjs h LYS 54 CO 0.00 0.54 -0.18 0.00 -2.27 0.00 0.00 179.45 177.54 1gjs h ALA 55 N 1.02 1.06 -0.07 5.00 0.00 -0.98 -2.66 119.26 122.63 1gjs h ALA 55 Ca 0.13 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1gjs h ALA 55 Cb 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1gjs h ALA 55 CO -0.01 0.23 -0.48 1.25 0.00 0.00 0.00 179.25 180.23 1gjs h LEU 56 N 0.00 0.18 0.13 0.00 5.85 -0.61 -0.60 115.31 120.26 1gjs h LEU 56 Ca -0.00 -0.08 -0.27 0.00 0.84 0.00 0.00 57.88 58.36 1gjs h LEU 56 Cb 0.64 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1gjs h LEU 56 CO 0.02 0.64 -1.24 0.40 -0.34 0.00 0.00 178.44 177.92 1gjs h ILE 57 N 0.14 1.50 -0.58 4.05 1.08 -1.32 -2.55 117.51 119.83 1gjs h ILE 57 Ca 0.01 -3.07 -0.11 0.00 -0.39 0.00 0.00 64.86 61.30 1gjs h ILE 57 Cb 0.90 2.95 -0.02 0.00 -3.07 0.00 0.00 36.82 37.58 1gjs h ILE 57 CO 0.07 0.90 -0.07 0.44 -0.69 0.00 0.00 178.15 178.80 1gjs h ASP 58 N 0.07 1.06 -0.01 1.72 3.32 -1.24 0.25 116.42 121.59 1gjs h ASP 58 Ca -0.13 -0.33 -0.17 0.00 0.02 0.00 0.00 57.03 56.42 1gjs h ASP 58 Cb 1.97 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 41.23 1gjs h ASP 58 CO 0.20 1.14 -0.56 1.05 -1.72 0.00 0.00 179.24 179.35 1gjs h GLU 59 N 0.95 0.59 -0.35 3.56 4.11 -1.17 -1.05 114.58 121.22 1gjs h GLU 59 Ca 0.16 -0.38 -0.15 0.00 0.07 0.00 0.00 59.36 59.05 1gjs h GLU 59 Cb 0.64 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1gjs h GLU 59 CO 0.04 0.99 -0.38 0.82 0.07 0.00 0.00 179.01 180.55 1gjs h ILE 60 N 0.45 1.28 -0.53 -1.06 2.04 -1.20 -2.99 117.51 115.50 1gjs h ILE 60 Ca 0.01 -1.56 -0.12 0.00 1.00 0.00 0.00 64.86 64.19 1gjs h ILE 60 Cb 1.11 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 1gjs h ILE 60 CO 0.11 0.52 -0.14 -0.07 0.00 0.00 0.00 178.15 178.56 1gjs h LEU 61 N 0.69 1.04 -1.32 1.44 3.38 -0.43 -2.39 115.31 117.72 1gjs h LEU 61 Ca 0.05 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 1gjs h LEU 61 Cb 0.98 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1gjs h LEU 61 CO 0.09 1.17 0.01 0.00 0.09 0.00 0.00 178.44 179.80 1gjs n ALA 62 N -2.51 2.58 -1.79 1.53 0.00 -0.41 -3.19 120.51 116.72 1gjs n ALA 62 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1gjs n ALA 62 Cb 0.42 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1gjs n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gjs n ALA 63 N 0.11 1.83 -1.77 0.00 0.00 -0.90 -5.01 120.51 114.76 1gjs n ALA 63 Ca 0.02 -0.95 -0.35 0.00 0.00 0.00 0.00 53.44 52.15 1gjs n ALA 63 Cb 0.35 -0.41 -0.00 0.00 0.00 0.00 0.00 19.45 19.39 1gjs n ALA 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gjs s LEU 64 N -0.07 3.77 0.00 0.00 1.43 -1.19 -5.04 118.68 117.57 1gjs s LEU 64 Ca 0.01 2.17 0.00 0.00 -1.03 0.00 0.00 54.13 55.28 1gjs s LEU 64 Cb 0.01 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.66 1gjs s LEU 64 CO 0.00 -1.18 0.47 -0.81 0.23 0.00 0.00 176.35 175.05