#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 4.65 0.00 0.03 -2.85 -1.26 -4.79 119.74 115.53 1gjs s LYS 2 Ca 0.00 1.43 0.00 0.00 -1.00 0.00 0.00 55.97 56.40 1gjs s LYS 2 Cb 0.00 -3.40 0.00 0.00 -2.06 0.00 0.00 37.83 32.37 1gjs s LYS 2 CO 0.00 0.14 0.00 0.00 0.10 0.00 0.00 175.35 175.59 1gjs n ALA 3 N 3.10 0.00 -2.58 0.59 0.00 -1.26 -5.13 120.51 115.23 1gjs n ALA 3 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.21 1gjs n ALA 3 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 1gjs n ALA 3 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1gjs s ILE 4 N 0.00 5.06 0.00 0.00 -4.36 -1.26 -5.09 121.20 115.56 1gjs s ILE 4 Ca 0.00 -0.22 0.00 0.00 -0.26 0.00 0.00 60.65 60.17 1gjs s ILE 4 Cb 0.00 -3.81 0.00 0.00 1.25 0.00 0.00 42.46 39.90 1gjs s ILE 4 CO 0.00 -0.49 0.00 0.33 0.24 0.00 0.00 174.94 175.02 1gjs n PHE 5 N -1.50 0.00 -3.40 1.37 7.35 -1.26 -4.99 117.46 115.03 1gjs n PHE 5 Ca -0.03 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.58 1gjs n PHE 5 Cb 0.55 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.30 1gjs n PHE 5 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1gjs s VAL 6 N 0.00 -0.64 0.00 -2.13 -7.23 -1.26 -4.99 120.40 104.15 1gjs s VAL 6 Ca 0.00 -0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.16 1gjs s VAL 6 Cb 0.00 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.15 1gjs s VAL 6 CO 0.00 -0.07 0.00 0.00 -0.31 0.00 0.00 175.10 174.72 1gjs n LEU 7 N 5.37 0.00 -0.19 1.32 -0.00 -1.26 -4.95 117.00 117.30 1gjs n LEU 7 Ca -0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.86 1gjs n LEU 7 Cb 0.50 0.11 0.02 0.00 -0.00 0.00 0.00 43.42 44.05 1gjs n LEU 7 CO 0.04 -0.11 0.75 0.78 -0.00 0.00 0.00 177.39 178.85 1gjs h ASN 8 N 0.00 1.04 -3.32 1.45 2.35 -2.01 -3.38 115.58 111.71 1gjs h ASN 8 Ca 0.00 -0.34 -0.73 0.00 -0.55 0.00 0.00 56.30 54.68 1gjs h ASN 8 Cb 0.00 -0.28 -0.29 0.00 0.05 0.00 0.00 38.32 37.80 1gjs h ASN 8 CO 0.00 1.14 -0.35 0.00 -1.65 0.00 0.00 177.43 176.57 1gjs s ALA 9 N -4.86 3.46 0.31 -0.83 0.00 -1.26 -4.92 121.76 113.67 1gjs s ALA 9 Ca -0.11 -2.60 0.11 0.00 0.00 0.00 0.00 51.96 49.36 1gjs s ALA 9 Cb 0.13 -2.90 0.51 0.00 0.00 0.00 0.00 23.12 20.86 1gjs s ALA 9 CO 0.86 -1.94 1.70 -0.56 0.00 0.00 0.00 175.76 175.82 1gjs h GLN 10 N 8.43 0.00 -5.24 0.00 3.07 -1.98 -3.41 115.11 115.99 1gjs h GLN 10 Ca -0.20 -0.00 -0.65 0.00 0.09 0.00 0.00 58.65 57.88 1gjs h GLN 10 Cb 1.07 0.00 -0.15 0.00 0.08 0.00 0.00 27.48 28.48 1gjs h GLN 10 CO 0.87 0.52 -0.02 -3.38 0.09 0.00 0.00 178.83 176.91 1gjs s HIS 11 N -3.86 3.15 -0.65 0.06 -3.43 -1.26 -4.88 115.29 104.42 1gjs s HIS 11 Ca -0.02 0.07 0.09 0.00 -0.80 0.00 0.00 55.06 54.40 1gjs s HIS 11 Cb 0.13 -3.03 0.25 0.00 -1.43 0.00 0.00 32.58 28.50 1gjs s HIS 11 CO 0.75 -0.64 1.20 -0.25 -2.00 0.00 0.00 174.74 173.80 1gjs n ASP 12 N 5.86 2.76 -4.78 7.38 8.00 -1.26 -5.03 116.55 129.48 1gjs n ASP 12 Ca -0.04 -2.08 -0.41 0.00 0.71 0.00 0.00 54.79 52.97 1gjs n ASP 12 Cb 0.48 -0.20 -0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1gjs n ASP 12 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1gjs s GLU 13 N -1.15 4.09 0.00 -1.24 2.02 -1.26 -4.81 118.70 116.36 1gjs s GLU 13 Ca 0.19 2.54 0.00 0.00 0.02 0.00 0.00 54.97 57.72 1gjs s GLU 13 Cb 0.11 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.39 1gjs s GLU 13 CO 0.11 -0.53 0.00 0.00 0.02 0.00 0.00 175.26 174.86 1gjs n ALA 14 N 0.43 0.00 -0.29 5.21 0.00 -1.26 -4.93 120.51 119.67 1gjs n ALA 14 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.40 1gjs n ALA 14 Cb 0.40 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.92 1gjs n ALA 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1gjs h VAL 15 N 0.00 1.26 -4.03 0.00 2.07 -2.06 -3.44 116.25 110.05 1gjs h VAL 15 Ca 0.00 -0.82 -0.18 0.00 0.82 0.00 0.00 66.70 66.52 1gjs h VAL 15 Cb 0.00 0.30 -0.17 0.00 -1.52 0.00 0.00 31.29 29.89 1gjs h VAL 15 CO 0.00 0.34 -0.70 1.51 0.02 0.00 0.00 177.57 178.74 1gjs s ASP 16 N -6.36 0.66 0.00 0.57 -4.77 -1.26 -5.01 116.67 100.50 1gjs s ASP 16 Ca -0.12 -0.81 0.00 0.00 -3.30 0.00 0.00 52.55 48.32 1gjs s ASP 16 Cb 0.16 0.12 0.00 0.00 -1.09 0.00 0.00 42.92 42.11 1gjs s ASP 16 CO 0.84 -0.43 0.00 0.00 0.70 0.00 0.00 175.17 176.28 1gjs n ALA 17 N 0.64 0.00 -0.37 2.11 0.00 -1.26 -4.95 120.51 116.67 1gjs n ALA 17 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.25 1gjs n ALA 17 Cb 0.58 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.15 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 1.15 -0.99 0.00 -0.73 -1.98 -2.08 115.58 110.95 1gjs h ASN 18 Ca 0.00 -0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.15 1gjs h ASN 18 Cb 0.00 -0.29 -0.05 0.00 0.27 0.00 0.00 38.32 38.25 1gjs h ASN 18 CO 0.00 0.83 0.66 -1.28 -0.37 0.00 0.00 177.43 177.27 1gjs h SER 19 N 1.35 1.14 -0.29 1.15 0.87 -1.97 0.52 113.55 116.31 1gjs h SER 19 Ca 0.36 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 1gjs h SER 19 Cb -0.15 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.51 1gjs h SER 19 CO -0.08 0.82 0.19 0.25 -0.53 0.00 0.00 176.83 177.49 1gjs h LEU 20 N 1.34 0.34 -0.27 2.23 5.85 -1.76 0.42 115.31 123.46 1gjs h LEU 20 Ca 0.36 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.96 1gjs h LEU 20 Cb -0.15 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 1gjs h LEU 20 CO -0.08 0.24 -0.27 0.00 -0.34 0.00 0.00 178.44 178.00 1gjs h ALA 21 N 1.11 0.39 -0.94 1.25 0.00 -1.16 -2.73 119.26 117.18 1gjs h ALA 21 Ca 0.11 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1gjs h ALA 21 Cb -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1gjs h ALA 21 CO -0.02 0.39 0.55 1.49 0.00 0.00 0.00 179.25 181.65 1gjs h GLU 22 N 0.38 1.28 -0.33 0.00 4.81 0.31 -0.14 114.58 120.89 1gjs h GLU 22 Ca 0.04 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1gjs h GLU 22 Cb 0.83 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 1gjs h GLU 22 CO 0.07 0.91 0.19 0.00 -0.73 0.00 0.00 179.01 179.44 1gjs h ALA 23 N 1.30 0.41 -0.83 2.92 0.00 -0.06 0.71 119.26 123.71 1gjs h ALA 23 Ca 0.33 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 1gjs h ALA 23 Cb -0.03 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1gjs h ALA 23 CO -0.06 -0.17 0.37 0.87 0.00 0.00 0.00 179.25 180.26 1gjs h LYS 24 N 0.39 1.22 -0.02 0.00 1.57 -1.10 0.41 116.57 119.04 1gjs h LYS 24 Ca 0.13 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1gjs h LYS 24 Cb 0.01 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 1gjs h LYS 24 CO -0.06 0.96 0.00 0.28 -0.57 0.00 0.00 179.45 180.05 1gjs h VAL 25 N 1.20 1.22 -0.98 0.50 2.07 -0.13 2.42 116.25 122.55 1gjs h VAL 25 Ca 0.28 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1gjs h VAL 25 Cb 0.16 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.51 1gjs h VAL 25 CO -0.03 0.17 0.65 -0.07 0.02 0.00 0.00 177.57 178.32 1gjs h LEU 26 N -0.23 1.13 0.08 2.57 3.38 0.71 0.63 115.31 123.57 1gjs h LEU 26 Ca 0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1gjs h LEU 26 Cb 0.28 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1gjs h LEU 26 CO 0.00 0.81 -0.04 0.00 0.09 0.00 0.00 178.44 179.30 1gjs h ALA 27 N 1.36 -0.11 -0.39 1.53 0.00 0.11 -2.28 119.26 119.49 1gjs h ALA 27 Ca 0.36 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1gjs h ALA 27 Cb -0.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1gjs h ALA 27 CO -0.08 -0.22 0.25 -0.97 0.00 0.00 0.00 179.25 178.23 1gjs h ASN 28 N -0.80 0.43 0.01 0.00 -0.73 0.43 -1.81 115.58 113.12 1gjs h ASN 28 Ca -0.01 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.12 1gjs h ASN 28 Cb 0.59 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 39.07 1gjs h ASN 28 CO 0.02 0.31 -0.08 -0.09 -0.37 0.00 0.00 177.43 177.22 1gjs h ARG 29 N 0.51 0.17 -1.01 6.67 1.12 0.18 -2.22 114.38 119.81 1gjs h ARG 29 Ca 0.14 -0.03 0.01 0.00 -1.11 0.00 0.00 59.98 58.99 1gjs h ARG 29 Cb -0.05 -0.03 -0.05 0.00 -0.01 0.00 0.00 29.97 29.83 1gjs h ARG 29 CO -0.04 0.27 0.67 1.49 -3.11 0.00 0.00 179.97 179.25 1gjs h GLU 30 N 0.17 1.33 -0.38 0.20 4.57 -0.71 -1.67 114.58 118.09 1gjs h GLU 30 Ca 0.04 -0.08 -0.09 0.00 -1.18 0.00 0.00 59.36 58.05 1gjs h GLU 30 Cb 0.26 -0.30 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1gjs h GLU 30 CO 0.01 0.88 -0.12 -0.07 -1.18 0.00 0.00 179.01 178.53 1gjs h LEU 31 N 1.37 0.66 -0.48 1.64 3.38 -1.21 -3.11 115.31 117.55 1gjs h LEU 31 Ca 0.37 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1gjs h LEU 31 Cb -0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1gjs h LEU 31 CO -0.08 0.81 0.32 -0.78 0.09 0.00 0.00 178.44 178.80 1gjs h ASP 32 N 0.61 0.55 -0.97 -0.43 1.82 -1.16 -1.14 116.42 115.71 1gjs h ASP 32 Ca 0.11 -0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.74 1gjs h ASP 32 Cb 0.56 -0.14 -0.05 0.00 0.68 0.00 0.00 39.33 40.39 1gjs h ASP 32 CO 0.04 0.40 0.64 0.07 -1.61 0.00 0.00 179.24 178.78 1gjs h LYS 33 N 0.66 1.28 -0.03 0.28 2.10 -1.43 -1.54 116.57 117.88 1gjs h LYS 33 Ca 0.18 -0.08 -0.11 0.00 -2.00 0.00 0.00 60.65 58.64 1gjs h LYS 33 Cb -0.07 -0.29 -0.01 0.00 -0.90 0.00 0.00 32.23 30.95 1gjs h LYS 33 CO -0.04 0.85 -0.49 1.88 -2.00 0.00 0.00 179.45 179.65 1gjs h TYR 34 N 1.32 0.09 0.00 0.07 0.05 -1.52 -3.47 116.97 113.51 1gjs h TYR 34 Ca 0.35 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.11 1gjs h TYR 34 Cb -0.15 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.58 1gjs h TYR 34 CO -0.00 0.55 0.00 0.41 -1.05 0.00 0.00 178.16 178.07 1gjs n GLY 35 N -0.08 0.90 3.25 3.88 0.00 -0.46 -5.06 105.19 107.63 1gjs n GLY 35 Ca -0.02 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.19 0.00 -0.83 1.61 0.31 -1.08 -4.88 118.33 111.27 1gjs n VAL 36 Ca 0.00 -0.27 -0.31 0.00 -0.01 0.00 0.00 64.34 63.75 1gjs n VAL 36 Cb 0.00 -0.54 0.15 0.00 -0.91 0.00 0.00 33.84 32.54 1gjs n VAL 36 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1gjs s SER 37 N -1.76 3.25 -0.02 4.52 1.04 -1.26 -4.88 113.70 114.59 1gjs s SER 37 Ca 0.54 2.14 0.11 0.00 0.48 0.00 0.00 55.95 59.21 1gjs s SER 37 Cb -0.10 -2.56 0.34 0.00 0.10 0.00 0.00 66.02 63.80 1gjs s SER 37 CO 0.66 -2.88 1.25 -0.90 0.98 0.00 0.00 173.24 172.36 1gjs n ASP 38 N -4.04 2.19 0.03 7.02 5.75 -1.26 -4.02 116.55 122.22 1gjs n ASP 38 Ca 0.11 -2.07 -0.22 0.00 -0.01 0.00 0.00 54.79 52.61 1gjs n ASP 38 Cb 0.52 -0.30 -0.14 0.00 -1.03 0.00 0.00 41.12 40.17 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 2.16 0.54 -0.15 2.11 5.03 -2.02 -3.36 116.97 121.28 1gjs h TYR 39 Ca 0.00 -0.40 -0.04 0.00 2.58 0.00 0.00 58.73 60.88 1gjs h TYR 39 Cb 0.60 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.85 1gjs h TYR 39 CO 0.29 1.57 -0.07 1.88 -1.32 0.00 0.00 178.16 180.51 1gjs h TYR 40 N -0.19 0.23 -0.99 -3.82 0.05 -1.97 -2.49 116.97 107.79 1gjs h TYR 40 Ca -0.30 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.47 1gjs h TYR 40 Cb 1.85 -0.07 -0.05 0.00 1.01 0.00 0.00 36.73 39.47 1gjs h TYR 40 CO 0.13 0.31 0.65 1.57 -1.05 0.00 0.00 178.16 179.77 1gjs h LYS 41 N 0.22 1.31 -0.82 4.88 2.10 -1.78 -1.18 116.57 121.29 1gjs h LYS 41 Ca 0.05 -0.08 -0.04 0.00 -2.00 0.00 0.00 60.65 58.58 1gjs h LYS 41 Cb 0.28 -0.29 -0.04 0.00 -0.90 0.00 0.00 32.23 31.27 1gjs h LYS 41 CO 0.01 0.87 0.37 -0.97 -2.00 0.00 0.00 179.45 177.73 1gjs h ASN 42 N 1.35 1.10 -0.97 7.07 -1.24 -1.60 -2.23 115.58 119.06 1gjs h ASN 42 Ca 0.36 -0.15 -0.00 0.00 0.71 0.00 0.00 56.30 57.22 1gjs h ASN 42 Cb -0.15 -0.28 -0.05 0.00 0.73 0.00 0.00 38.32 38.57 1gjs h ASN 42 CO -0.08 0.95 0.61 0.25 -1.29 0.00 0.00 177.43 177.87 1gjs h LEU 43 N 1.18 1.15 -0.99 0.34 5.85 -1.17 -1.74 115.31 119.94 1gjs h LEU 43 Ca 0.28 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1gjs h LEU 43 Cb 0.16 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1gjs h LEU 43 CO -0.03 0.86 0.65 0.40 -0.34 0.00 0.00 178.44 179.99 1gjs h ILE 44 N 1.33 1.25 -1.00 4.05 1.08 -0.74 -0.81 117.51 122.68 1gjs h ILE 44 Ca 0.35 -0.46 0.25 0.00 -0.39 0.00 0.00 64.86 64.60 1gjs h ILE 44 Cb -0.09 -0.20 -0.08 0.00 -3.07 0.00 0.00 36.82 33.38 1gjs h ILE 44 CO -0.07 0.25 0.66 -1.13 -0.69 0.00 0.00 178.15 177.16 1gjs h ASN 45 N 1.34 0.39 0.58 1.72 -0.73 -0.94 1.02 115.58 118.96 1gjs h ASN 45 Ca 0.36 0.06 -0.09 0.00 1.87 0.00 0.00 56.30 58.50 1gjs h ASN 45 Cb -0.15 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.42 1gjs h ASN 45 CO -0.08 0.11 -0.41 -1.13 -0.37 0.00 0.00 177.43 175.55 1gjs h ASN 46 N 0.36 0.00 -0.26 1.15 -1.24 -1.11 -3.42 115.58 111.06 1gjs h ASN 46 Ca 0.54 0.00 -0.28 0.00 0.71 0.00 0.00 56.30 57.27 1gjs h ASN 46 Cb 1.44 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 40.43 1gjs h ASN 46 CO -0.22 0.41 1.35 0.00 -1.29 0.00 0.00 177.43 177.68 1gjs n ALA 47 N -2.38 0.74 -0.21 1.57 0.00 0.35 -4.72 120.51 115.86 1gjs n ALA 47 Ca -0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 53.44 52.41 1gjs n ALA 47 Cb 0.48 -2.73 0.03 0.00 0.00 0.00 0.00 19.45 17.23 1gjs n ALA 47 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1gjs h LYS 48 N 12.52 1.07 -5.83 0.00 3.64 -1.84 -3.43 116.57 122.69 1gjs h LYS 48 Ca -0.01 -0.35 -0.65 0.00 -1.27 0.00 0.00 60.65 58.36 1gjs h LYS 48 Cb 1.13 -0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.80 1gjs h LYS 48 CO 1.36 1.06 -0.51 -0.08 -2.27 0.00 0.00 179.45 179.01 1gjs s THR 49 N -4.98 5.27 0.20 1.00 -1.32 -1.26 -5.01 115.64 109.53 1gjs s THR 49 Ca -0.12 -0.17 -0.08 0.00 -1.21 0.00 0.00 61.69 60.11 1gjs s THR 49 Cb 0.13 -3.42 0.11 0.00 -1.51 0.00 0.00 72.50 67.81 1gjs s THR 49 CO 0.86 0.37 1.71 0.58 -2.21 0.00 0.00 174.62 175.93 1gjs h VAL 50 N 3.08 1.26 -0.17 5.08 2.07 -1.96 -2.37 116.25 123.24 1gjs h VAL 50 Ca -0.50 -1.01 0.05 0.00 0.82 0.00 0.00 66.70 66.07 1gjs h VAL 50 Cb 1.19 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1gjs h VAL 50 CO 0.66 0.38 0.14 1.05 0.02 0.00 0.00 177.57 179.83 1gjs h GLU 51 N 1.08 0.00 0.00 1.57 4.11 -1.97 0.35 114.58 119.72 1gjs h GLU 51 Ca 0.22 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.62 1gjs h GLU 51 Cb 0.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1gjs h GLU 51 CO 0.01 0.00 -0.15 0.78 0.07 0.00 0.00 179.01 179.71 1gjs h GLY 52 N 0.00 0.00 0.57 1.06 0.00 -1.82 -2.50 103.07 100.38 1gjs h GLY 52 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1gjs h GLY 52 CO -0.00 0.00 -0.17 -2.08 0.00 0.00 0.00 176.54 174.29 1gjs h VAL 53 N 0.00 0.51 -0.37 4.60 2.07 -0.21 -2.37 116.25 120.48 1gjs h VAL 53 Ca -0.00 -0.66 -0.17 0.00 0.82 0.00 0.00 66.70 66.69 1gjs h VAL 53 Cb 0.95 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1gjs h VAL 53 CO 0.02 0.10 -0.42 0.11 0.02 0.00 0.00 177.57 177.40 1gjs h LYS 54 N -0.92 0.93 -1.00 1.57 1.57 -1.63 -2.94 116.57 114.15 1gjs h LYS 54 Ca -0.05 -0.51 0.01 0.00 -1.87 0.00 0.00 60.65 58.23 1gjs h LYS 54 Cb 0.53 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.82 1gjs h LYS 54 CO 0.08 1.17 0.66 0.00 -0.57 0.00 0.00 179.45 180.79 1gjs h ALA 55 N 0.76 1.28 -0.49 3.86 0.00 -1.53 0.39 119.26 123.52 1gjs h ALA 55 Ca 0.05 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1gjs h ALA 55 Cb 1.02 -0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1gjs h ALA 55 CO 0.10 0.67 -0.21 1.25 0.00 0.00 0.00 179.25 181.06 1gjs h LEU 56 N 1.36 1.04 -0.71 0.00 5.85 -1.39 -2.70 115.31 118.76 1gjs h LEU 56 Ca 0.37 -0.39 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 1gjs h LEU 56 Cb -0.15 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.57 1gjs h LEU 56 CO -0.08 1.20 -0.56 0.40 -0.34 0.00 0.00 178.44 179.06 1gjs h ILE 57 N 0.87 1.23 -0.97 4.05 2.04 -1.24 -2.81 117.51 120.68 1gjs h ILE 57 Ca 0.11 -2.04 0.01 0.00 1.00 0.00 0.00 64.86 63.95 1gjs h ILE 57 Cb 0.79 2.15 -0.05 0.00 -0.74 0.00 0.00 36.82 38.98 1gjs h ILE 57 CO 0.07 0.55 0.65 -0.78 0.00 0.00 0.00 178.15 178.63 1gjs h ASP 58 N 0.00 1.11 -0.35 1.72 1.82 0.09 0.93 116.42 121.73 1gjs h ASP 58 Ca -0.01 -0.03 -0.16 0.00 -0.39 0.00 0.00 57.03 56.44 1gjs h ASP 58 Cb 1.11 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.83 1gjs h ASP 58 CO 0.07 0.80 -0.41 -0.33 -1.61 0.00 0.00 179.24 177.77 1gjs h GLU 59 N 1.31 0.92 -0.38 0.28 4.39 -1.35 -0.49 114.58 119.26 1gjs h GLU 59 Ca 0.36 -0.49 -0.14 0.00 0.34 0.00 0.00 59.36 59.42 1gjs h GLU 59 Cb -0.14 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 1gjs h GLU 59 CO -0.08 1.14 -0.32 0.82 -1.16 0.00 0.00 179.01 179.41 1gjs h ILE 60 N 0.74 1.28 0.00 3.13 2.04 -0.99 -2.89 117.51 120.83 1gjs h ILE 60 Ca 0.06 -1.49 -0.10 0.00 1.00 0.00 0.00 64.86 64.32 1gjs h ILE 60 Cb 1.00 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 1gjs h ILE 60 CO 0.10 0.50 -0.49 -0.07 0.00 0.00 0.00 178.15 178.18 1gjs h LEU 61 N 0.69 0.00 -1.02 1.44 3.38 0.90 -2.92 115.31 117.77 1gjs h LEU 61 Ca 0.07 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1gjs h LEU 61 Cb 0.91 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 1gjs h LEU 61 CO 0.08 0.49 0.66 0.00 0.09 0.00 0.00 178.44 179.76 1gjs h ALA 62 N 1.51 1.29 0.00 1.53 0.00 -0.87 0.16 119.26 122.87 1gjs h ALA 62 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1gjs h ALA 62 Cb 0.88 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1gjs h ALA 62 CO 0.06 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.97 1gjs n ALA 63 N -2.38 1.77 -3.56 0.00 0.00 -1.10 -3.71 120.51 111.52 1gjs n ALA 63 Ca 0.12 -0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 1gjs n ALA 63 Cb 0.01 -1.19 -0.10 0.00 0.00 0.00 0.00 19.45 18.17 1gjs n ALA 63 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gjs n LEU 64 N -1.20 1.45 0.00 0.00 4.77 0.55 -5.14 117.00 117.42 1gjs n LEU 64 Ca 0.07 -4.86 0.00 0.00 -0.03 0.00 0.00 56.01 51.18 1gjs n LEU 64 Cb 0.08 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1gjs n LEU 64 CO 0.08 1.87 0.22 -2.65 -1.33 0.00 0.00 177.39 175.59