#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3t n SER 2 N 0.00 0.20 -3.60 1.61 7.64 -1.26 -5.13 113.62 113.08 1j3t n SER 2 Ca 0.00 -1.52 -0.11 0.00 1.01 0.00 0.00 58.87 58.25 1j3t n SER 2 Cb 0.00 -0.96 -0.06 0.00 -1.01 0.00 0.00 64.21 62.18 1j3t n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1j3t s SER 3 N -5.66 -0.45 0.00 6.43 0.15 -1.26 -5.21 113.70 107.70 1j3t s SER 3 Ca 0.73 0.66 0.00 0.00 0.70 0.00 0.00 55.95 58.04 1j3t s SER 3 Cb -0.02 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.89 1j3t s SER 3 CO 0.51 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.26 1j3t n GLY 4 N 1.39 -1.53 2.39 9.45 0.00 -1.26 -5.10 105.19 110.53 1j3t n GLY 4 Ca -0.12 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 1j3t n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1j3t n SER 5 N 1.27 -0.69 -3.46 1.61 7.64 -1.26 -5.02 113.62 113.71 1j3t n SER 5 Ca 0.00 -2.52 -0.25 0.00 1.01 0.00 0.00 58.87 57.11 1j3t n SER 5 Cb 0.00 -0.29 -0.12 0.00 -1.01 0.00 0.00 64.21 62.79 1j3t n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j3t s SER 6 N -0.20 2.69 -0.61 6.43 1.04 -1.26 -4.87 113.70 116.92 1j3t s SER 6 Ca 0.33 -1.58 -0.07 0.00 0.48 0.00 0.00 55.95 55.12 1j3t s SER 6 Cb 0.07 -0.10 -0.14 0.00 0.10 0.00 0.00 66.02 65.95 1j3t s SER 6 CO -0.17 -0.36 3.22 0.61 0.98 0.00 0.00 173.24 177.53 1j3t n GLY 7 N 4.67 3.72 3.43 7.32 0.00 0.33 -4.83 105.19 119.83 1j3t n GLY 7 Ca 0.04 -1.46 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 1j3t n GLY 7 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j3t s VAL 8 N 0.66 0.04 -0.02 1.61 -7.23 -1.26 -4.53 120.40 109.67 1j3t s VAL 8 Ca 0.66 -1.23 0.12 0.00 -1.81 0.00 0.00 61.98 59.71 1j3t s VAL 8 Cb 0.28 -1.84 -0.22 0.00 0.56 0.00 0.00 36.38 35.16 1j3t s VAL 8 CO -0.06 -0.20 0.78 1.05 -0.31 0.00 0.00 175.10 176.37 1j3t h GLU 9 N 2.40 0.00 0.00 4.82 9.09 -2.00 -3.51 114.58 125.39 1j3t h GLU 9 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.11 1j3t h GLU 9 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.34 1j3t h GLU 9 CO 0.43 0.56 0.00 -1.71 0.05 0.00 0.00 179.01 178.34 1j3t n ASN 10 N -3.09 0.00 -4.77 3.06 5.15 -1.26 -5.15 115.26 109.20 1j3t n ASN 10 Ca -0.13 -0.39 -0.38 0.00 -0.60 0.00 0.00 54.58 53.07 1j3t n ASN 10 Cb 1.02 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 40.26 1j3t n ASN 10 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1j3t s LEU 11 N 0.00 4.11 0.10 1.20 2.96 -1.26 -4.94 118.68 120.85 1j3t s LEU 11 Ca 0.00 2.51 0.10 0.00 -0.22 0.00 0.00 54.13 56.52 1j3t s LEU 11 Cb 0.00 -4.07 -0.04 0.00 0.50 0.00 0.00 46.19 42.59 1j3t s LEU 11 CO 0.00 -0.92 -0.26 -0.54 -1.32 0.00 0.00 176.35 173.30 1j3t s LYS 12 N -2.46 1.56 -0.03 1.98 1.02 -1.26 -0.63 119.74 119.92 1j3t s LYS 12 Ca 0.61 -1.26 0.01 0.00 0.02 0.00 0.00 55.97 55.35 1j3t s LYS 12 Cb -0.34 -1.94 0.01 0.00 -0.52 0.00 0.00 37.83 35.04 1j3t s LYS 12 CO 0.43 0.47 -0.04 0.00 -0.92 0.00 0.00 175.35 175.29 1j3t s ALA 13 N -0.99 0.54 -0.06 5.17 0.00 -0.61 -2.96 121.76 122.85 1j3t s ALA 13 Ca 0.14 -0.08 -0.25 0.00 0.00 0.00 0.00 51.96 51.77 1j3t s ALA 13 Cb -0.10 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 1j3t s ALA 13 CO 0.05 0.03 0.78 -1.14 0.00 0.00 0.00 175.76 175.48 1j3t s GLN 14 N 0.55 4.45 0.35 0.00 0.74 -0.06 -1.54 119.66 124.15 1j3t s GLN 14 Ca -0.07 1.02 -0.28 0.00 0.05 0.00 0.00 55.36 56.08 1j3t s GLN 14 Cb -0.10 -3.47 -0.10 0.00 1.10 0.00 0.00 33.01 30.44 1j3t s GLN 14 CO -0.00 -0.01 1.31 0.00 -0.55 0.00 0.00 175.29 176.04 1j3t s ALA 15 N 1.01 3.45 -1.78 1.58 0.00 0.10 -0.88 121.76 125.24 1j3t s ALA 15 Ca 0.41 1.26 0.22 0.00 0.00 0.00 0.00 51.96 53.85 1j3t s ALA 15 Cb -0.18 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 1j3t s ALA 15 CO 0.20 -0.68 1.04 1.28 0.00 0.00 0.00 175.76 177.59 1j3t n LEU 16 N 0.65 1.78 -3.62 0.00 4.77 -0.10 -1.15 117.00 119.33 1j3t n LEU 16 Ca 0.01 -0.70 -0.10 0.00 -0.03 0.00 0.00 56.01 55.19 1j3t n LEU 16 Cb 0.42 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 1j3t n LEU 16 CO 0.58 0.35 0.30 0.00 -1.33 0.00 0.00 177.39 177.29 1j3t s SER 18 N -2.82 7.51 -0.24 0.00 1.04 -1.26 -3.91 113.70 114.02 1j3t s SER 18 Ca 0.05 2.05 -0.26 0.00 0.48 0.00 0.00 55.95 58.27 1j3t s SER 18 Cb -0.01 -2.61 0.08 0.00 0.10 0.00 0.00 66.02 63.58 1j3t s SER 18 CO -0.08 0.05 0.76 0.86 0.98 0.00 0.00 173.24 175.81 1j3t s TRP 19 N -1.10 -0.73 0.52 5.02 -0.00 0.17 -4.88 118.94 117.95 1j3t s TRP 19 Ca 0.43 1.70 -0.01 0.00 -0.00 0.00 0.00 56.10 58.22 1j3t s TRP 19 Cb -0.28 0.30 0.01 0.00 -0.00 0.00 0.00 33.47 33.51 1j3t s TRP 19 CO 0.35 -0.39 0.76 0.95 -0.00 0.00 0.00 176.95 178.62 1j3t s THR 20 N 0.12 3.51 0.84 5.86 -4.23 -1.26 -1.78 115.64 118.71 1j3t s THR 20 Ca -0.01 -0.43 -0.12 0.00 -1.18 0.00 0.00 61.69 59.95 1j3t s THR 20 Cb -0.04 -3.33 0.10 0.00 1.34 0.00 0.00 72.50 70.57 1j3t s THR 20 CO 0.01 -0.26 1.16 0.00 -0.54 0.00 0.00 174.62 174.99 1j3t s ALA 21 N -2.73 2.31 0.00 3.99 0.00 -1.26 -4.75 121.76 119.32 1j3t s ALA 21 Ca 0.52 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1j3t s ALA 21 Cb -0.10 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.02 1j3t s ALA 21 CO 0.40 -1.89 0.00 1.63 0.00 0.00 0.00 175.76 175.90 1j3t n LYS 22 N -3.48 0.00 -0.97 0.00 4.01 -1.26 -5.08 118.16 111.38 1j3t n LYS 22 Ca 0.07 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.58 1j3t n LYS 22 Cb 0.60 0.00 0.23 0.00 -0.51 0.00 0.00 35.03 35.35 1j3t n LYS 22 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1j3t s LYS 23 N -0.50 -0.88 0.00 1.97 -0.14 -1.26 -5.02 119.74 113.91 1j3t s LYS 23 Ca 0.00 0.24 0.00 0.00 -1.36 0.00 0.00 55.97 54.85 1j3t s LYS 23 Cb 0.00 -1.61 0.00 0.00 -1.68 0.00 0.00 37.83 34.54 1j3t s LYS 23 CO 0.00 -3.55 0.95 -0.25 -0.76 0.00 0.00 175.35 171.75 1j3t n ASP 24 N -4.70 0.00 -2.33 2.83 9.92 -1.26 -3.93 116.55 117.07 1j3t n ASP 24 Ca 0.09 0.95 -0.20 0.00 -0.53 0.00 0.00 54.79 55.10 1j3t n ASP 24 Cb 0.58 -0.45 -0.12 0.00 -0.64 0.00 0.00 41.12 40.49 1j3t n ASP 24 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1j3t n ASN 25 N -1.96 6.06 -4.07 -2.24 5.15 -1.26 -4.81 115.26 112.12 1j3t n ASN 25 Ca 0.00 -2.70 -0.29 0.00 -0.60 0.00 0.00 54.58 50.99 1j3t n ASN 25 Cb 0.00 -1.39 -0.17 0.00 -0.53 0.00 0.00 39.78 37.70 1j3t n ASN 25 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 1j3t s HIS 26 N 0.37 2.12 0.51 1.20 3.76 -1.25 -0.66 115.29 121.33 1j3t s HIS 26 Ca 0.65 -1.04 -0.21 0.00 -0.15 0.00 0.00 55.06 54.32 1j3t s HIS 26 Cb 0.31 -1.51 -0.07 0.00 1.11 0.00 0.00 32.58 32.42 1j3t s HIS 26 CO -0.07 -0.52 1.12 -1.17 -0.85 0.00 0.00 174.74 173.25 1j3t s LEU 27 N 1.02 3.85 0.00 0.89 1.98 -0.19 -4.66 118.68 121.57 1j3t s LEU 27 Ca -0.05 2.17 0.05 0.00 -2.89 0.00 0.00 54.13 53.41 1j3t s LEU 27 Cb -0.15 -4.47 -0.02 0.00 0.66 0.00 0.00 46.19 42.21 1j3t s LEU 27 CO -0.03 -1.04 -0.16 0.54 -1.89 0.00 0.00 176.35 173.76 1j3t s ASN 28 N -1.69 1.93 0.18 3.68 2.20 -1.26 -4.37 114.94 115.62 1j3t s ASN 28 Ca 0.69 -0.34 -0.08 0.00 -0.94 0.00 0.00 52.86 52.19 1j3t s ASN 28 Cb -0.24 -0.20 -0.02 0.00 -2.00 0.00 0.00 41.25 38.80 1j3t s ASN 28 CO 0.28 0.17 0.27 0.72 -2.94 0.00 0.00 177.10 175.60 1j3t s PHE 29 N -0.49 0.56 0.47 1.54 -0.12 -0.73 -4.90 117.98 114.30 1j3t s PHE 29 Ca 0.06 -0.90 0.08 0.00 -0.05 0.00 0.00 56.93 56.12 1j3t s PHE 29 Cb -0.07 -0.13 0.03 0.00 -0.63 0.00 0.00 43.02 42.22 1j3t s PHE 29 CO -0.00 -0.74 0.61 -1.12 -0.05 0.00 0.00 175.22 173.93 1j3t s SER 30 N -3.01 5.39 -0.08 1.98 0.01 -1.26 -0.65 113.70 116.07 1j3t s SER 30 Ca 0.22 -0.62 -0.30 0.00 1.31 0.00 0.00 55.95 56.57 1j3t s SER 30 Cb 0.04 -0.32 -0.04 0.00 0.21 0.00 0.00 66.02 65.91 1j3t s SER 30 CO 0.04 -0.94 1.51 -0.75 0.41 0.00 0.00 173.24 173.51 1j3t s LYS 31 N -4.42 4.21 -0.05 12.44 2.20 -1.25 -2.48 119.74 130.38 1j3t s LYS 31 Ca 0.56 2.02 0.00 0.00 -0.36 0.00 0.00 55.97 58.18 1j3t s LYS 31 Cb -0.08 -3.87 0.00 0.00 -1.51 0.00 0.00 37.83 32.38 1j3t s LYS 31 CO 0.34 -0.77 0.00 0.72 -0.36 0.00 0.00 175.35 175.28 1j3t n HIS 32 N 6.74 0.00 -1.25 4.03 8.25 -0.30 -4.90 115.22 127.79 1j3t n HIS 32 Ca 0.16 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.30 1j3t n HIS 32 Cb 0.43 -0.33 0.10 0.00 1.12 0.00 0.00 29.99 31.32 1j3t n HIS 32 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1j3t s ASP 33 N -2.22 4.13 -0.15 0.41 1.11 -1.04 -4.75 116.67 114.17 1j3t s ASP 33 Ca 0.00 2.08 -0.01 0.00 0.18 0.00 0.00 52.55 54.80 1j3t s ASP 33 Cb 0.00 -2.55 -0.01 0.00 1.07 0.00 0.00 42.92 41.42 1j3t s ASP 33 CO 0.00 -2.30 -0.11 -0.63 1.18 0.00 0.00 175.17 173.31 1j3t s ILE 34 N -2.52 3.13 -0.03 0.77 -1.09 -1.26 -0.72 121.20 119.47 1j3t s ILE 34 Ca 0.67 -0.62 0.07 0.00 -2.23 0.00 0.00 60.65 58.54 1j3t s ILE 34 Cb -0.22 -2.34 -0.01 0.00 -1.58 0.00 0.00 42.46 38.30 1j3t s ILE 34 CO 0.51 0.50 -0.24 -0.63 -1.23 0.00 0.00 174.94 173.86 1j3t s ILE 35 N 0.60 1.91 -0.26 2.92 1.09 -0.59 -4.84 121.20 122.04 1j3t s ILE 35 Ca -0.07 -1.01 -0.29 0.00 -1.10 0.00 0.00 60.65 58.18 1j3t s ILE 35 Cb -0.15 -1.60 -0.02 0.00 -1.06 0.00 0.00 42.46 39.63 1j3t s ILE 35 CO 0.03 0.54 1.57 -0.89 -0.10 0.00 0.00 174.94 176.09 1j3t s THR 36 N -0.38 3.75 0.28 2.92 2.01 -0.25 -1.57 115.64 122.40 1j3t s THR 36 Ca 0.04 0.84 -0.22 0.00 0.31 0.00 0.00 61.69 62.65 1j3t s THR 36 Cb -0.11 -3.80 -0.09 0.00 0.01 0.00 0.00 72.50 68.51 1j3t s THR 36 CO 0.01 -0.36 0.83 -0.69 -0.69 0.00 0.00 174.62 173.72 1j3t s VAL 37 N 5.25 4.41 0.00 3.82 1.01 0.20 -0.54 120.40 134.55 1j3t s VAL 37 Ca 0.69 1.51 0.00 0.00 0.00 0.00 0.00 61.98 64.19 1j3t s VAL 37 Cb -0.23 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1j3t s VAL 37 CO 0.29 0.12 0.00 0.18 0.00 0.00 0.00 175.10 175.69 1j3t n LEU 38 N 0.51 0.23 -3.93 3.92 4.77 0.14 -4.11 117.00 118.53 1j3t n LEU 38 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.89 1j3t n LEU 38 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 1j3t n LEU 38 CO 0.43 -0.19 -0.23 -0.70 -1.33 0.00 0.00 177.39 175.37 1j3t s GLU 39 N -1.90 0.52 -0.17 3.23 2.56 -1.03 -4.96 118.70 116.95 1j3t s GLU 39 Ca 0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 54.97 54.27 1j3t s GLU 39 Cb 0.00 0.21 0.06 0.00 2.00 0.00 0.00 34.13 36.39 1j3t s GLU 39 CO 0.00 -0.12 0.07 -0.65 -0.56 0.00 0.00 175.26 174.00 1j3t s GLN 40 N -2.18 0.23 0.00 4.30 -0.21 -1.26 -0.44 119.66 120.10 1j3t s GLN 40 Ca -0.09 -0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.13 1j3t s GLN 40 Cb -0.04 -1.86 0.00 0.00 1.00 0.00 0.00 33.01 32.12 1j3t s GLN 40 CO -0.03 -0.65 0.00 1.04 -2.12 0.00 0.00 175.29 173.54 1j3t n GLN 41 N 5.21 1.20 -0.35 2.91 6.02 0.15 -4.95 117.38 127.57 1j3t n GLN 41 Ca -0.07 0.00 0.32 0.00 -0.01 0.00 0.00 57.00 57.24 1j3t n GLN 41 Cb 0.49 0.00 0.57 0.00 1.02 0.00 0.00 30.24 32.31 1j3t n GLN 41 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1j3t n GLU 42 N -0.19 -0.04 0.00 -1.09 0.28 -1.26 -4.41 120.64 113.93 1j3t n GLU 42 Ca 0.00 1.20 0.00 0.00 -0.16 0.00 0.00 57.16 58.20 1j3t n GLU 42 Cb 0.00 -2.24 0.00 0.00 1.43 0.00 0.00 31.44 30.63 1j3t n GLU 42 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1j3t n ASN 43 N -4.81 0.00 -4.74 -1.84 3.02 -1.26 -5.11 115.26 100.52 1j3t n ASN 43 Ca 0.35 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.50 1j3t n ASN 43 Cb 1.28 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 40.40 1j3t n ASN 43 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1j3t s TRP 44 N -0.30 3.86 0.03 3.10 0.52 -1.26 -0.83 118.94 124.06 1j3t s TRP 44 Ca 0.00 1.83 0.07 0.00 0.02 0.00 0.00 56.10 58.02 1j3t s TRP 44 Cb 0.00 -3.04 -0.03 0.00 -1.15 0.00 0.00 33.47 29.25 1j3t s TRP 44 CO 0.00 0.25 -0.18 -1.58 0.02 0.00 0.00 176.95 175.46 1j3t s TRP 45 N -0.47 2.57 0.17 -1.98 0.51 0.11 -0.68 118.94 119.17 1j3t s TRP 45 Ca 0.45 -0.25 -0.22 0.00 -2.12 0.00 0.00 56.10 53.96 1j3t s TRP 45 Cb -0.25 -1.48 -0.08 0.00 -0.81 0.00 0.00 33.47 30.85 1j3t s TRP 45 CO 0.31 0.24 0.71 0.12 -0.51 0.00 0.00 176.95 177.82 1j3t s PHE 46 N -0.90 3.78 0.39 -1.98 5.36 0.41 -0.70 117.98 124.33 1j3t s PHE 46 Ca 0.14 1.45 -0.16 0.00 -0.96 0.00 0.00 56.93 57.41 1j3t s PHE 46 Cb -0.10 -2.64 0.06 0.00 -0.34 0.00 0.00 43.02 39.99 1j3t s PHE 46 CO 0.05 0.46 0.80 0.20 -1.46 0.00 0.00 175.22 175.27 1j3t s GLY 47 N -1.35 0.38 -0.06 13.12 0.00 -0.54 -0.68 107.32 118.19 1j3t s GLY 47 Ca 0.37 -0.76 -0.02 0.00 0.00 0.00 0.00 44.72 44.31 1j3t s GLY 47 CO 0.22 -0.24 0.13 1.85 0.00 0.00 0.00 173.10 175.06 1j3t s GLU 48 N -2.22 0.06 -0.03 2.90 2.12 0.30 -1.66 118.70 120.16 1j3t s GLU 48 Ca 0.16 0.37 -0.13 0.00 0.36 0.00 0.00 54.97 55.73 1j3t s GLU 48 Cb -0.05 -0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.15 1j3t s GLU 48 CO 0.11 -0.19 0.28 0.54 -0.54 0.00 0.00 175.26 175.46 1j3t s VAL 49 N 1.35 0.05 -1.61 3.70 0.11 -1.26 -1.10 120.40 121.64 1j3t s VAL 49 Ca -0.07 -0.40 -0.17 0.00 -2.93 0.00 0.00 61.98 58.40 1j3t s VAL 49 Cb -0.12 -0.54 0.15 0.00 -1.53 0.00 0.00 36.38 34.33 1j3t s VAL 49 CO -0.05 -0.22 0.74 1.41 -3.33 0.00 0.00 175.10 173.64 1j3t n HIS 50 N 1.67 -1.75 -1.04 1.54 8.25 -1.26 -1.38 115.22 121.23 1j3t n HIS 50 Ca -0.20 0.73 -0.01 0.00 -0.26 0.00 0.00 57.72 57.98 1j3t n HIS 50 Cb 0.56 -2.89 -0.01 0.00 1.12 0.00 0.00 29.99 28.78 1j3t n HIS 50 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j3t n GLY 51 N -1.33 0.27 0.20 -1.41 0.00 -1.26 -4.90 105.19 96.75 1j3t n GLY 51 Ca 0.07 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1j3t n GLY 51 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1j3t h GLY 52 N 0.00 -0.52 -3.67 -0.02 0.00 -1.59 -3.51 103.07 93.76 1j3t h GLY 52 Ca -0.03 0.19 0.12 0.00 0.00 0.00 0.00 47.33 47.62 1j3t h GLY 52 CO 0.04 -0.19 -1.07 0.54 0.00 0.00 0.00 176.54 175.87 1j3t n ARG 53 N -3.55 -3.78 0.00 4.80 1.74 -1.26 -4.99 116.66 109.62 1j3t n ARG 53 Ca -0.06 2.99 0.00 0.00 -0.77 0.00 0.00 57.85 60.01 1j3t n ARG 53 Cb 0.20 -3.93 0.00 0.00 -1.02 0.00 0.00 32.46 27.71 1j3t n ARG 53 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1j3t n GLY 54 N -3.25 1.99 3.88 -0.13 0.00 -0.66 -4.29 105.19 102.73 1j3t n GLY 54 Ca -0.03 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 1j3t n GLY 54 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1j3t s TRP 55 N -1.98 3.47 -0.13 1.61 0.52 0.17 -1.46 118.94 121.14 1j3t s TRP 55 Ca 0.00 0.95 -0.26 0.00 0.02 0.00 0.00 56.10 56.81 1j3t s TRP 55 Cb 0.00 -2.36 0.06 0.00 -1.15 0.00 0.00 33.47 30.02 1j3t s TRP 55 CO 0.00 -0.05 0.64 -0.59 0.02 0.00 0.00 176.95 176.97 1j3t s PHE 56 N -2.31 -0.64 0.13 -1.98 -0.71 0.12 -1.02 117.98 111.58 1j3t s PHE 56 Ca 0.49 1.31 -0.31 0.00 -1.04 0.00 0.00 56.93 57.38 1j3t s PHE 56 Cb -0.10 0.31 -0.09 0.00 -1.21 0.00 0.00 43.02 41.93 1j3t s PHE 56 CO 0.31 -0.48 1.46 -2.14 -1.34 0.00 0.00 175.22 173.03 1j3t s PRO 57 N -0.57 4.28 0.46 1.99 0.02 -1.26 -0.71 135.00 139.20 1j3t s PRO 57 Ca -0.07 2.18 0.31 0.00 0.02 0.00 0.00 61.00 63.44 1j3t s PRO 57 Cb -0.02 -3.22 1.35 0.00 0.02 0.00 0.00 34.50 32.63 1j3t s PRO 57 CO 0.06 -0.50 1.92 1.57 -0.33 0.00 0.00 177.00 179.72 1j3t h LYS 58 N 6.81 0.00 0.00 5.54 2.10 -1.33 -2.75 116.57 126.95 1j3t h LYS 58 Ca -0.42 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.21 1j3t h LYS 58 Cb 1.21 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1j3t h LYS 58 CO 0.88 0.00 -0.08 0.66 -2.00 0.00 0.00 179.45 178.91 1j3t h SER 59 N 0.00 0.00 0.70 7.07 4.64 -1.91 -1.03 113.55 123.03 1j3t h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j3t h SER 59 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1j3t h SER 59 CO 0.00 0.08 0.00 1.88 -0.87 0.00 0.00 176.83 177.92 1j3t h TYR 60 N 0.00 0.00 -1.62 4.77 -1.99 -1.89 -3.47 116.97 112.77 1j3t h TYR 60 Ca -0.00 0.00 -0.62 0.00 2.00 0.00 0.00 58.73 60.11 1j3t h TYR 60 Cb 0.32 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 38.92 1j3t h TYR 60 CO 0.00 0.00 -0.51 0.14 -0.00 0.00 0.00 178.16 177.79 1j3t s VAL 61 N -3.70 0.78 0.01 -2.88 -7.23 -0.39 -0.92 120.40 106.07 1j3t s VAL 61 Ca 0.00 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 1j3t s VAL 61 Cb 0.10 -2.22 -0.01 0.00 0.56 0.00 0.00 36.38 34.81 1j3t s VAL 61 CO 0.47 0.00 -0.05 -1.59 -0.31 0.00 0.00 175.10 173.62 1j3t s LYS 62 N -3.77 0.36 0.69 4.82 -2.85 -0.05 -4.86 119.74 114.08 1j3t s LYS 62 Ca 0.15 -0.28 -0.16 0.00 -1.00 0.00 0.00 55.97 54.68 1j3t s LYS 62 Cb 0.01 -0.29 0.02 0.00 -2.06 0.00 0.00 37.83 35.51 1j3t s LYS 62 CO 0.09 0.07 1.20 0.42 0.10 0.00 0.00 175.35 177.24 1j3t s ILE 63 N -0.39 2.45 -0.02 3.79 1.01 -1.26 -0.88 121.20 125.89 1j3t s ILE 63 Ca -0.01 0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.91 1j3t s ILE 63 Cb -0.03 -2.86 -0.01 0.00 0.01 0.00 0.00 42.46 39.57 1j3t s ILE 63 CO -0.00 -0.11 -0.13 -0.63 0.00 0.00 0.00 174.94 174.07 1j3t s ILE 64 N -1.91 1.08 -0.04 2.92 1.01 -1.15 -4.83 121.20 118.27 1j3t s ILE 64 Ca 0.75 -0.56 0.12 0.00 0.00 0.00 0.00 60.65 60.96 1j3t s ILE 64 Cb -0.29 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1j3t s ILE 64 CO 0.42 0.31 1.39 1.55 0.00 0.00 0.00 174.94 178.61 1j3t h PRO 65 N 6.02 0.00 -5.99 2.79 0.13 -1.97 -3.44 132.00 129.54 1j3t h PRO 65 Ca -0.34 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.18 1j3t h PRO 65 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1j3t h PRO 65 CO 0.49 0.69 1.47 0.41 -0.23 0.00 0.00 178.00 180.83 1j3t n GLY 66 N 1.25 0.86 0.49 1.56 0.00 -1.26 -4.75 105.19 103.34 1j3t n GLY 66 Ca 0.01 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.86 1j3t n GLY 66 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1j3t n SER 67 N 11.06 0.00 -4.86 1.61 7.64 -1.26 -4.97 113.62 122.84 1j3t n SER 67 Ca 0.34 -1.64 -0.31 0.00 1.01 0.00 0.00 58.87 58.27 1j3t n SER 67 Cb 0.38 -0.13 -0.01 0.00 -1.01 0.00 0.00 64.21 63.44 1j3t n SER 67 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1j3t s GLU 68 N 0.00 3.74 0.02 1.43 0.41 -1.26 -0.51 118.70 122.53 1j3t s GLU 68 Ca 0.00 0.81 -0.29 0.00 -0.41 0.00 0.00 54.97 55.09 1j3t s GLU 68 Cb 0.00 -2.11 -0.16 0.00 -1.78 0.00 0.00 34.13 30.08 1j3t s GLU 68 CO 0.00 -0.43 1.19 1.03 -0.49 0.00 0.00 175.26 176.56 1j3t h SER 69 N 0.21 -0.85 0.00 -0.19 0.87 -1.89 -3.35 113.55 108.35 1j3t h SER 69 Ca -0.45 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 1j3t h SER 69 Cb 1.19 0.22 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 1j3t h SER 69 CO 0.62 -0.48 0.00 0.61 -0.53 0.00 0.00 176.83 177.04 1j3t n GLY 70 N -0.82 0.51 2.57 5.77 0.00 -1.26 -4.84 105.19 107.13 1j3t n GLY 70 Ca -0.13 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 1j3t n GLY 70 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1j3t n PRO 71 N 0.00 2.86 -0.94 1.61 -0.04 -1.26 -4.95 135.00 132.28 1j3t n PRO 71 Ca 0.00 -2.06 -0.32 0.00 -0.04 0.00 0.00 63.50 61.08 1j3t n PRO 71 Cb 0.00 -2.83 0.14 0.00 -0.04 0.00 0.00 33.50 30.77 1j3t n PRO 71 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1j3t s SER 72 N 3.04 3.37 0.30 3.54 0.15 -1.26 -4.91 113.70 117.92 1j3t s SER 72 Ca 0.56 2.23 0.00 0.00 0.70 0.00 0.00 55.95 59.44 1j3t s SER 72 Cb 0.15 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1j3t s SER 72 CO -0.04 -2.81 0.00 -1.54 1.20 0.00 0.00 173.24 170.05 1j3t n SER 73 N -3.75 -2.54 0.00 5.45 3.41 -1.26 -5.27 113.62 109.66 1j3t n SER 73 Ca 0.12 0.57 0.07 0.00 -0.26 0.00 0.00 58.87 59.37 1j3t n SER 73 Cb 0.51 2.54 0.43 0.00 -0.26 0.00 0.00 64.21 67.43 1j3t n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49