#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 0.95 -5.97 2.12 1.57 -2.12 -3.44 116.57 109.68 1gjs h LYS 2 Ca 0.00 -0.06 -0.55 0.00 -1.87 0.00 0.00 60.65 58.18 1gjs h LYS 2 Cb 0.00 -0.21 0.24 0.00 0.08 0.00 0.00 32.23 32.33 1gjs h LYS 2 CO 0.00 0.63 -1.86 0.00 -0.57 0.00 0.00 179.45 177.65 1gjs n ALA 3 N -2.43 -5.50 -1.92 3.86 0.00 -1.26 -4.88 120.51 108.39 1gjs n ALA 3 Ca 0.08 -0.68 -0.38 0.00 0.00 0.00 0.00 53.44 52.45 1gjs n ALA 3 Cb 0.04 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 1gjs n ALA 3 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gjs s ILE 4 N -1.99 4.32 0.45 0.00 1.01 -1.26 -5.01 121.20 118.72 1gjs s ILE 4 Ca 0.40 1.71 -0.25 0.00 0.00 0.00 0.00 60.65 62.50 1gjs s ILE 4 Cb -0.18 -4.07 -0.08 0.00 0.01 0.00 0.00 42.46 38.13 1gjs s ILE 4 CO 0.83 0.35 1.44 0.49 0.00 0.00 0.00 174.94 178.05 1gjs n PHE 5 N 1.11 2.74 0.00 3.97 3.72 -1.26 -5.00 117.46 122.74 1gjs n PHE 5 Ca -0.02 0.44 0.00 0.00 -0.05 0.00 0.00 57.45 57.81 1gjs n PHE 5 Cb 0.49 -2.47 0.00 0.00 -0.94 0.00 0.00 39.48 36.57 1gjs n PHE 5 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 1gjs n VAL 6 N -0.20 0.00 -1.75 -4.37 3.14 -1.26 -4.84 118.33 109.05 1gjs n VAL 6 Ca 0.05 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.01 1gjs n VAL 6 Cb 0.41 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.18 1gjs n VAL 6 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1gjs n LEU 7 N 0.00 4.42 -4.27 6.55 -0.00 -1.26 -5.00 117.00 117.44 1gjs n LEU 7 Ca 0.00 1.16 -0.19 0.00 -0.00 0.00 0.00 56.01 56.98 1gjs n LEU 7 Cb 0.00 -1.60 -0.11 0.00 -0.00 0.00 0.00 43.42 41.71 1gjs n LEU 7 CO 0.00 0.15 -0.46 0.20 -0.00 0.00 0.00 177.39 177.28 1gjs s ASN 8 N 0.39 2.22 -0.04 1.96 0.02 -1.26 -5.02 114.94 113.21 1gjs s ASN 8 Ca 0.62 -0.85 0.08 0.00 -1.02 0.00 0.00 52.86 51.69 1gjs s ASN 8 Cb -0.49 -0.10 0.29 0.00 0.02 0.00 0.00 41.25 40.97 1gjs s ASN 8 CO 0.51 -0.12 1.13 0.00 0.02 0.00 0.00 177.10 178.64 1gjs n ALA 9 N 0.38 2.69 -0.38 0.60 0.00 -1.26 -4.17 120.51 118.38 1gjs n ALA 9 Ca -0.14 -0.61 -0.02 0.00 0.00 0.00 0.00 53.44 52.67 1gjs n ALA 9 Cb 0.57 -1.01 0.11 0.00 0.00 0.00 0.00 19.45 19.13 1gjs n ALA 9 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1gjs h GLN 10 N 1.67 1.32 -0.01 0.00 1.08 -2.00 -3.14 115.11 114.02 1gjs h GLN 10 Ca 0.00 -0.08 0.01 0.00 -1.45 0.00 0.00 58.65 57.13 1gjs h GLN 10 Cb 0.67 -0.30 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 1gjs h GLN 10 CO 0.08 0.87 -0.15 1.25 -0.95 0.00 0.00 178.83 179.93 1gjs h HIS 11 N 1.36 -0.43 -3.02 2.96 2.76 -2.04 -3.47 115.15 113.27 1gjs h HIS 11 Ca 0.37 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.57 1gjs h HIS 11 Cb -0.15 0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.98 1gjs h HIS 11 CO -0.00 -0.15 0.25 -0.51 -1.30 0.00 0.00 177.93 176.21 1gjs s ASP 12 N -3.14 -0.11 -0.07 3.26 1.01 -1.19 -5.00 116.67 111.43 1gjs s ASP 12 Ca -0.04 -0.91 0.01 0.00 0.71 0.00 0.00 52.55 52.32 1gjs s ASP 12 Cb 0.02 0.79 0.13 0.00 1.01 0.00 0.00 42.92 44.87 1gjs s ASP 12 CO 0.17 -1.53 1.07 -0.62 0.21 0.00 0.00 175.17 174.47 1gjs n GLU 13 N -0.50 1.32 0.22 8.23 1.02 -1.26 -4.37 120.64 125.30 1gjs n GLU 13 Ca -0.06 -0.54 0.08 0.00 -0.02 0.00 0.00 57.16 56.61 1gjs n GLU 13 Cb 0.60 -1.30 0.41 0.00 -0.02 0.00 0.00 31.44 31.13 1gjs n GLU 13 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gjs h ALA 14 N 1.93 1.33 -1.98 0.62 0.00 -1.94 -3.35 119.26 115.87 1gjs h ALA 14 Ca 0.09 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.36 1gjs h ALA 14 Cb 1.22 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 1gjs h ALA 14 CO 0.18 -0.33 0.30 0.08 0.00 0.00 0.00 179.25 179.48 1gjs s VAL 15 N -3.54 4.64 -0.17 0.00 1.01 -1.26 -4.88 120.40 116.21 1gjs s VAL 15 Ca -0.02 -0.01 0.16 0.00 0.00 0.00 0.00 61.98 62.12 1gjs s VAL 15 Cb 0.04 -4.39 0.01 0.00 0.00 0.00 0.00 36.38 32.04 1gjs s VAL 15 CO 0.14 -0.90 1.23 -0.78 0.00 0.00 0.00 175.10 174.79 1gjs h ASP 16 N 9.11 0.00 -0.52 3.32 1.82 -2.00 -3.33 116.42 124.82 1gjs h ASP 16 Ca -0.26 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.38 1gjs h ASP 16 Cb 1.09 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.07 1gjs h ASP 16 CO 1.01 0.47 0.34 0.00 -1.61 0.00 0.00 179.24 179.44 1gjs h ALA 17 N 1.53 0.66 -0.81 -0.78 0.00 -1.94 -0.15 119.26 117.76 1gjs h ALA 17 Ca -0.05 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1gjs h ALA 17 Cb 1.40 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1gjs h ALA 17 CO 0.05 0.09 0.54 -0.97 0.00 0.00 0.00 179.25 178.96 1gjs h ASN 18 N 0.70 0.94 -0.48 0.00 -0.73 -1.98 -1.55 115.58 112.47 1gjs h ASN 18 Ca 0.19 -0.03 -0.11 0.00 1.87 0.00 0.00 56.30 58.23 1gjs h ASN 18 Cb -0.07 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.27 1gjs h ASN 18 CO -0.04 0.68 -0.11 0.77 -0.37 0.00 0.00 177.43 178.35 1gjs h SER 19 N 1.10 0.93 -0.21 1.15 4.64 -1.55 -1.73 113.55 117.88 1gjs h SER 19 Ca 0.30 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1gjs h SER 19 Cb -0.13 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.70 1gjs h SER 19 CO -0.06 1.07 0.13 -0.07 -0.87 0.00 0.00 176.83 177.03 1gjs h LEU 20 N 0.77 0.24 -0.04 5.97 3.38 -0.62 0.16 115.31 125.17 1gjs h LEU 20 Ca 0.12 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1gjs h LEU 20 Cb 0.67 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1gjs h LEU 20 CO 0.05 0.20 0.03 0.00 0.09 0.00 0.00 178.44 178.81 1gjs h ALA 21 N 1.05 0.05 -0.75 1.53 0.00 -1.20 -1.42 119.26 118.52 1gjs h ALA 21 Ca 0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1gjs h ALA 21 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1gjs h ALA 21 CO -0.01 -0.43 0.35 1.49 0.00 0.00 0.00 179.25 180.65 1gjs h GLU 22 N 0.02 1.09 -0.71 0.00 4.81 -1.11 0.13 114.58 118.81 1gjs h GLU 22 Ca 0.02 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.08 1gjs h GLU 22 Cb 0.03 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 1gjs h GLU 22 CO -0.00 0.86 0.47 0.00 -0.73 0.00 0.00 179.01 179.61 1gjs h ALA 23 N 1.18 0.90 -0.38 2.92 0.00 -0.43 0.40 119.26 123.84 1gjs h ALA 23 Ca 0.26 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 1gjs h ALA 23 Cb 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1gjs h ALA 23 CO -0.03 0.32 -0.40 0.87 0.00 0.00 0.00 179.25 180.01 1gjs h LYS 24 N 0.96 0.94 -0.29 0.00 1.57 -0.81 -1.28 116.57 117.66 1gjs h LYS 24 Ca 0.26 -0.51 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1gjs h LYS 24 Cb -0.11 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1gjs h LYS 24 CO -0.06 1.16 0.04 0.28 -0.57 0.00 0.00 179.45 180.31 1gjs h VAL 25 N 0.76 1.24 -0.71 0.50 2.07 -0.18 -0.16 116.25 119.77 1gjs h VAL 25 Ca 0.06 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 1gjs h VAL 25 Cb 1.00 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1gjs h VAL 25 CO 0.10 0.27 0.16 -0.07 0.02 0.00 0.00 177.57 178.05 1gjs h LEU 26 N 0.30 1.09 -0.54 2.57 3.38 -0.20 -2.32 115.31 119.59 1gjs h LEU 26 Ca 0.09 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 1gjs h LEU 26 Cb 0.36 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1gjs h LEU 26 CO 0.01 1.05 -0.16 0.00 0.09 0.00 0.00 178.44 179.42 1gjs h ALA 27 N 1.08 0.74 -0.89 1.53 0.00 -1.08 -2.84 119.26 117.81 1gjs h ALA 27 Ca 0.22 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1gjs h ALA 27 Cb 0.39 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1gjs h ALA 27 CO 0.00 0.67 0.59 -0.97 0.00 0.00 0.00 179.25 179.54 1gjs h ASN 28 N 0.88 1.02 -0.99 0.00 -0.73 -0.75 -2.08 115.58 112.92 1gjs h ASN 28 Ca 0.13 -0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.28 1gjs h ASN 28 Cb 0.73 -0.25 -0.05 0.00 0.27 0.00 0.00 38.32 39.02 1gjs h ASN 28 CO 0.06 0.73 0.66 0.03 -0.37 0.00 0.00 177.43 178.54 1gjs h ARG 29 N 1.20 1.30 -1.01 6.67 2.47 -1.18 -1.39 114.38 122.44 1gjs h ARG 29 Ca 0.33 -0.08 0.01 0.00 -1.26 0.00 0.00 59.98 58.98 1gjs h ARG 29 Cb -0.14 -0.29 -0.05 0.00 -1.65 0.00 0.00 29.97 27.84 1gjs h ARG 29 CO -0.07 0.86 0.67 0.93 0.56 0.00 0.00 179.97 182.92 1gjs h GLU 30 N 1.34 1.33 -0.42 0.04 5.08 -1.30 -0.23 114.58 120.42 1gjs h GLU 30 Ca 0.37 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.55 1gjs h GLU 30 Cb -0.15 -0.30 -0.01 0.00 0.50 0.00 0.00 28.75 28.79 1gjs h GLU 30 CO -0.08 0.88 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.64 1gjs h LEU 31 N 1.37 0.81 -0.69 1.33 3.38 -1.26 -2.25 115.31 117.99 1gjs h LEU 31 Ca 0.37 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1gjs h LEU 31 Cb -0.16 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.34 1gjs h LEU 31 CO -0.08 0.98 0.45 -0.78 0.09 0.00 0.00 178.44 179.10 1gjs h ASP 32 N 0.62 0.79 -0.59 -0.43 1.82 -0.52 0.33 116.42 118.44 1gjs h ASP 32 Ca 0.11 -0.02 -0.10 0.00 -0.39 0.00 0.00 57.03 56.62 1gjs h ASP 32 Cb 0.62 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.41 1gjs h ASP 32 CO 0.04 0.58 -0.03 0.11 -1.61 0.00 0.00 179.24 178.33 1gjs h LYS 33 N 0.93 1.07 -0.31 0.28 1.57 -0.92 -2.85 116.57 116.34 1gjs h LYS 33 Ca 0.25 -0.35 -0.16 0.00 -1.87 0.00 0.00 60.65 58.52 1gjs h LYS 33 Cb -0.10 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1gjs h LYS 33 CO -0.05 1.06 -0.44 1.88 -0.57 0.00 0.00 179.45 181.32 1gjs h TYR 34 N 0.97 0.95 -0.11 -1.35 0.05 -0.96 -3.47 116.97 113.05 1gjs h TYR 34 Ca 0.17 -0.30 0.00 0.00 0.05 0.00 0.00 58.73 58.65 1gjs h TYR 34 Cb 0.59 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1gjs h TYR 34 CO 0.04 1.08 0.00 0.41 -1.05 0.00 0.00 178.16 178.64 1gjs n GLY 35 N 0.15 1.33 3.75 3.88 0.00 0.11 -5.09 105.19 109.32 1gjs n GLY 35 Ca -0.03 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.11 1.76 0.55 1.61 1.01 -1.07 -4.99 120.40 117.16 1gjs s VAL 36 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 61.98 61.79 1gjs s VAL 36 Cb 0.00 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 1gjs s VAL 36 CO 0.00 0.00 1.12 -0.55 0.00 0.00 0.00 175.10 175.67 1gjs s SER 37 N -4.43 5.69 0.49 3.32 0.15 -1.26 -4.89 113.70 112.77 1gjs s SER 37 Ca 0.74 2.15 0.33 0.00 0.70 0.00 0.00 55.95 59.86 1gjs s SER 37 Cb -0.06 -2.58 1.61 0.00 -1.71 0.00 0.00 66.02 63.29 1gjs s SER 37 CO 0.55 -1.24 1.99 -0.78 1.20 0.00 0.00 173.24 174.96 1gjs h ASP 38 N 1.10 0.00 -0.36 5.45 1.82 -1.99 -2.85 116.42 119.59 1gjs h ASP 38 Ca -0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 1gjs h ASP 38 Cb 1.26 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.25 1gjs h ASP 38 CO 0.57 0.00 0.24 0.22 -1.61 0.00 0.00 179.24 178.65 1gjs h TYR 39 N 0.00 0.45 -0.97 0.28 5.03 -1.99 -0.93 116.97 118.84 1gjs h TYR 39 Ca 0.00 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.33 1gjs h TYR 39 Cb 0.20 -0.15 -0.05 0.00 1.55 0.00 0.00 36.73 38.28 1gjs h TYR 39 CO 0.00 0.28 0.64 1.88 -1.32 0.00 0.00 178.16 179.64 1gjs h TYR 40 N 0.48 1.22 -0.52 -3.82 0.05 -1.89 0.17 116.97 112.66 1gjs h TYR 40 Ca 0.13 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.92 1gjs h TYR 40 Cb -0.05 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 37.25 1gjs h TYR 40 CO -0.05 0.76 0.24 0.87 -1.05 0.00 0.00 178.16 178.93 1gjs h LYS 41 N 1.31 0.75 -0.98 4.88 1.57 -1.56 -1.21 116.57 121.33 1gjs h LYS 41 Ca 0.36 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1gjs h LYS 41 Cb -0.14 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 31.99 1gjs h LYS 41 CO -0.08 0.63 0.63 -0.91 -0.57 0.00 0.00 179.45 179.15 1gjs h ASN 42 N 0.69 1.15 -0.99 0.86 -0.26 -0.24 -1.35 115.58 115.45 1gjs h ASN 42 Ca 0.18 -0.04 0.01 0.00 -0.56 0.00 0.00 56.30 55.88 1gjs h ASN 42 Cb 0.13 -0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 37.05 1gjs h ASN 42 CO -0.02 0.85 0.65 0.25 -1.06 0.00 0.00 177.43 178.10 1gjs h LEU 43 N 1.34 1.13 -1.01 1.61 5.85 0.32 -1.28 115.31 123.27 1gjs h LEU 43 Ca 0.36 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.06 1gjs h LEU 43 Cb -0.12 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.58 1gjs h LEU 43 CO -0.07 0.82 0.67 0.40 -0.34 0.00 0.00 178.44 179.92 1gjs h ILE 44 N 1.34 1.26 -0.58 4.05 1.08 -0.14 -0.37 117.51 124.15 1gjs h ILE 44 Ca 0.36 -0.47 0.15 0.00 -0.39 0.00 0.00 64.86 64.51 1gjs h ILE 44 Cb -0.15 -0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 33.35 1gjs h ILE 44 CO -0.08 0.25 0.41 -1.13 -0.69 0.00 0.00 178.15 176.91 1gjs h ASN 45 N 1.36 0.10 -0.12 1.72 -1.24 -0.80 0.30 115.58 116.91 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 -0.15 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 38.88 1gjs h ASN 45 CO -0.08 0.05 0.00 -3.20 -1.29 0.00 0.00 177.43 172.91 1gjs n ASN 46 N -4.40 1.97 -4.66 1.15 5.15 -0.18 -4.91 115.26 109.38 1gjs n ASN 46 Ca 0.11 -1.70 -0.46 0.00 -0.60 0.00 0.00 54.58 51.93 1gjs n ASN 46 Cb 0.58 -0.07 -0.04 0.00 -0.53 0.00 0.00 39.78 39.72 1gjs n ASN 46 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gjs n ALA 47 N 0.53 1.23 -0.13 5.20 0.00 0.11 -4.85 120.51 122.60 1gjs n ALA 47 Ca 0.17 0.19 -0.12 0.00 0.00 0.00 0.00 53.44 53.68 1gjs n ALA 47 Cb 0.40 -2.61 -0.01 0.00 0.00 0.00 0.00 19.45 17.24 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 10.45 0.94 -4.40 0.00 3.64 -1.90 -3.46 116.57 121.84 1gjs h LYS 48 Ca -0.47 -0.47 -0.17 0.00 -1.27 0.00 0.00 60.65 58.27 1gjs h LYS 48 Cb 1.26 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.93 1gjs h LYS 48 CO 0.95 1.13 -0.67 -0.08 -2.27 0.00 0.00 179.45 178.50 1gjs s THR 49 N -4.47 0.29 0.23 1.00 -1.32 -1.26 -5.05 115.64 105.06 1gjs s THR 49 Ca -0.11 -1.87 -0.07 0.00 -1.21 0.00 0.00 61.69 58.43 1gjs s THR 49 Cb 0.12 -1.75 0.21 0.00 -1.51 0.00 0.00 72.50 69.56 1gjs s THR 49 CO 0.88 -0.78 1.85 0.58 -2.21 0.00 0.00 174.62 174.94 1gjs h VAL 50 N 3.00 1.26 -1.00 5.08 2.07 -1.96 -2.17 116.25 122.53 1gjs h VAL 50 Ca -0.35 -0.66 0.17 0.00 0.82 0.00 0.00 66.70 66.69 1gjs h VAL 50 Cb 1.17 0.06 -0.10 0.00 -1.52 0.00 0.00 31.29 30.89 1gjs h VAL 50 CO 0.63 0.30 0.61 -0.08 0.02 0.00 0.00 177.57 179.06 1gjs h GLU 51 N 1.26 0.79 -0.08 1.57 4.81 -2.00 0.53 114.58 121.46 1gjs h GLU 51 Ca 0.31 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.36 1gjs h GLU 51 Cb 0.04 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1gjs h GLU 51 CO -0.05 0.52 -0.58 0.78 -0.73 0.00 0.00 179.01 178.96 1gjs h GLY 52 N 0.81 0.27 0.84 1.92 0.00 -1.83 -2.14 103.07 102.94 1gjs h GLY 52 Ca 0.56 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 1gjs h GLY 52 CO -0.36 0.29 -0.00 -2.08 0.00 0.00 0.00 176.54 174.39 1gjs h VAL 53 N 0.19 1.13 -0.36 4.60 2.07 0.45 0.16 116.25 124.48 1gjs h VAL 53 Ca -0.00 -0.38 -0.17 0.00 0.82 0.00 0.00 66.70 66.97 1gjs h VAL 53 Cb 1.07 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1gjs h VAL 53 CO 0.09 0.10 -0.42 0.07 0.02 0.00 0.00 177.57 177.42 1gjs h LYS 54 N -0.17 0.93 -0.32 1.57 2.10 -1.25 -2.09 116.57 117.34 1gjs h LYS 54 Ca -0.00 -0.51 -0.11 0.00 -2.00 0.00 0.00 60.65 58.02 1gjs h LYS 54 Cb 0.17 0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.51 1gjs h LYS 54 CO 0.00 1.17 -0.27 0.00 -2.00 0.00 0.00 179.45 178.35 1gjs h ALA 55 N 0.75 0.93 -0.43 0.07 0.00 -1.34 0.31 119.26 119.56 1gjs h ALA 55 Ca 0.05 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.43 1gjs h ALA 55 Cb 1.03 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1gjs h ALA 55 CO 0.10 0.61 -0.32 1.25 0.00 0.00 0.00 179.25 180.90 1gjs h LEU 56 N 0.56 1.02 -0.26 0.00 5.85 -0.62 0.25 115.31 122.11 1gjs h LEU 56 Ca 0.07 -0.43 -0.20 0.00 0.84 0.00 0.00 57.88 58.16 1gjs h LEU 56 Cb 0.75 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1gjs h LEU 56 CO 0.06 1.24 -0.61 0.40 -0.34 0.00 0.00 178.44 179.19 1gjs h ILE 57 N 0.81 1.27 -0.55 4.05 1.08 -1.19 -1.74 117.51 121.24 1gjs h ILE 57 Ca 0.08 -1.79 -0.08 0.00 -0.39 0.00 0.00 64.86 62.68 1gjs h ILE 57 Cb 0.91 1.71 -0.02 0.00 -3.07 0.00 0.00 36.82 36.35 1gjs h ILE 57 CO 0.08 0.58 0.02 -0.78 -0.69 0.00 0.00 178.15 177.37 1gjs h ASP 58 N 0.64 0.93 -0.23 1.72 1.82 -0.18 0.56 116.42 121.69 1gjs h ASP 58 Ca -0.00 -0.30 -0.15 0.00 -0.39 0.00 0.00 57.03 56.19 1gjs h ASP 58 Cb 1.22 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 40.97 1gjs h ASP 58 CO 0.13 1.00 -0.42 1.05 -1.61 0.00 0.00 179.24 179.40 1gjs h GLU 59 N 0.84 0.78 -0.34 0.28 4.11 -0.50 0.24 114.58 120.00 1gjs h GLU 59 Ca 0.16 -0.42 -0.15 0.00 0.07 0.00 0.00 59.36 59.02 1gjs h GLU 59 Cb 0.51 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1gjs h GLU 59 CO 0.02 1.05 -0.37 0.82 0.07 0.00 0.00 179.01 180.61 1gjs h ILE 60 N 0.63 1.28 -0.53 -1.06 2.04 -1.08 0.99 117.51 119.80 1gjs h ILE 60 Ca 0.05 -1.54 -0.12 0.00 1.00 0.00 0.00 64.86 64.24 1gjs h ILE 60 Cb 0.98 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1gjs h ILE 60 CO 0.09 0.51 -0.15 -0.07 0.00 0.00 0.00 178.15 178.53 1gjs h LEU 61 N 0.63 1.04 -0.95 1.44 3.38 0.27 -2.70 115.31 118.41 1gjs h LEU 61 Ca 0.05 -0.37 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1gjs h LEU 61 Cb 0.95 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1gjs h LEU 61 CO 0.09 1.17 -0.48 0.00 0.09 0.00 0.00 178.44 179.31 1gjs h ALA 62 N 0.91 1.12 -1.01 1.53 0.00 -0.40 -2.97 119.26 118.44 1gjs h ALA 62 Ca 0.13 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1gjs h ALA 62 Cb 0.73 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1gjs h ALA 62 CO 0.06 0.62 0.67 0.00 0.00 0.00 0.00 179.25 180.59 1gjs h ALA 63 N 1.43 1.28 -2.78 0.00 0.00 -0.47 -3.42 119.26 115.30 1gjs h ALA 63 Ca 0.00 -0.07 -0.52 0.00 0.00 0.00 0.00 54.91 54.32 1gjs h ALA 63 Cb 0.88 -0.41 0.09 0.00 0.00 0.00 0.00 17.79 18.35 1gjs h ALA 63 CO 0.07 0.66 0.49 -0.51 0.00 0.00 0.00 179.25 179.97 1gjs s LEU 64 N -10.12 3.83 0.00 0.00 1.43 -1.12 -5.10 118.68 107.60 1gjs s LEU 64 Ca -0.13 2.39 0.02 0.00 -1.03 0.00 0.00 54.13 55.39 1gjs s LEU 64 Cb 0.18 -4.41 0.15 0.00 0.03 0.00 0.00 46.19 42.14 1gjs s LEU 64 CO 0.82 -1.29 0.63 -0.81 0.23 0.00 0.00 176.35 175.93