#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 3.46 0.00 1.61 3.41 -1.26 -4.18 113.62 116.66 1j3t n SER 2 Ca 0.00 1.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.79 1j3t n SER 2 Cb 0.00 -1.55 0.00 0.00 -0.26 0.00 0.00 64.21 62.40 1j3t n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1j3t n SER 3 N 1.47 0.00 0.00 4.04 7.64 -1.26 -4.90 113.62 120.62 1j3t n SER 3 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1j3t n SER 3 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1j3t n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j3t n GLY 4 N 0.00 0.82 3.68 0.23 0.00 -1.26 -5.11 105.19 103.56 1j3t n GLY 4 Ca 0.00 -2.01 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 1j3t n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j3t n SER 5 N 0.52 1.93 -4.34 1.61 3.41 -1.26 -4.90 113.62 110.58 1j3t n SER 5 Ca 0.00 0.96 -0.43 0.00 -0.26 0.00 0.00 58.87 59.15 1j3t n SER 5 Cb 0.00 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 62.47 1j3t n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1j3t n SER 6 N -0.48 4.77 -3.53 4.04 7.64 -1.26 -4.77 113.62 120.03 1j3t n SER 6 Ca 0.10 -2.92 -0.11 0.00 1.01 0.00 0.00 58.87 56.95 1j3t n SER 6 Cb 0.44 -1.69 -0.10 0.00 -1.01 0.00 0.00 64.21 61.85 1j3t n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1j3t s GLY 7 N 3.59 -0.29 0.22 0.23 0.00 -1.26 -4.99 107.32 104.82 1j3t s GLY 7 Ca 0.50 1.05 0.00 0.00 0.00 0.00 0.00 44.72 46.26 1j3t s GLY 7 CO 0.03 2.38 0.13 -1.34 0.00 0.00 0.00 173.10 174.30 1j3t s VAL 8 N 2.52 0.14 0.35 1.40 -7.23 -1.26 -5.13 120.40 111.18 1j3t s VAL 8 Ca 0.05 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 1j3t s VAL 8 Cb -0.14 -2.53 -0.06 0.00 0.56 0.00 0.00 36.38 34.21 1j3t s VAL 8 CO -0.13 0.00 -0.07 -1.83 -0.31 0.00 0.00 175.10 172.76 1j3t s GLU 9 N -4.08 1.87 0.53 4.82 -1.05 -1.26 -5.08 118.70 114.44 1j3t s GLU 9 Ca 0.39 -1.93 0.00 0.00 -0.15 0.00 0.00 54.97 53.28 1j3t s GLU 9 Cb 0.07 -1.73 0.00 0.00 -0.44 0.00 0.00 34.13 32.03 1j3t s GLU 9 CO 0.13 0.12 0.00 0.09 0.95 0.00 0.00 175.26 176.55 1j3t n ASN 10 N -0.83 -8.71 -4.75 0.83 4.13 -1.26 -4.88 115.26 99.79 1j3t n ASN 10 Ca -0.05 1.15 -0.36 0.00 1.68 0.00 0.00 54.58 57.01 1j3t n ASN 10 Cb 0.64 -4.85 0.04 0.00 -1.54 0.00 0.00 39.78 34.06 1j3t n ASN 10 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1j3t s LEU 11 N -7.31 3.64 0.13 3.41 2.96 -1.25 -4.92 118.68 115.34 1j3t s LEU 11 Ca 0.00 2.37 0.09 0.00 -0.22 0.00 0.00 54.13 56.37 1j3t s LEU 11 Cb 0.00 -4.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.06 1j3t s LEU 11 CO 0.00 -1.62 -0.22 -0.54 -1.32 0.00 0.00 176.35 172.65 1j3t s LYS 12 N -3.39 1.24 0.02 1.98 1.02 -1.26 -0.38 119.74 118.97 1j3t s LYS 12 Ca 0.77 -1.28 0.05 0.00 0.02 0.00 0.00 55.97 55.52 1j3t s LYS 12 Cb -0.30 -1.50 -0.02 0.00 -0.52 0.00 0.00 37.83 35.50 1j3t s LYS 12 CO 0.34 0.34 -0.14 0.00 -0.92 0.00 0.00 175.35 174.97 1j3t s ALA 13 N -1.39 1.14 -0.12 5.17 0.00 -0.56 -2.85 121.76 123.15 1j3t s ALA 13 Ca 0.11 -0.71 -0.18 0.00 0.00 0.00 0.00 51.96 51.17 1j3t s ALA 13 Cb -0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 1j3t s ALA 13 CO 0.06 0.24 0.48 -1.14 0.00 0.00 0.00 175.76 175.40 1j3t s GLN 14 N -0.77 4.34 0.17 0.00 0.74 -0.38 -1.11 119.66 122.64 1j3t s GLN 14 Ca 0.03 0.45 -0.31 0.00 0.05 0.00 0.00 55.36 55.58 1j3t s GLN 14 Cb -0.07 -3.44 -0.09 0.00 1.10 0.00 0.00 33.01 30.51 1j3t s GLN 14 CO 0.00 0.15 1.45 0.00 -0.55 0.00 0.00 175.29 176.35 1j3t s ALA 15 N 0.64 3.65 -1.11 1.58 0.00 0.09 -1.09 121.76 125.52 1j3t s ALA 15 Ca 0.26 1.24 0.24 0.00 0.00 0.00 0.00 51.96 53.70 1j3t s ALA 15 Cb -0.15 -3.56 0.30 0.00 0.00 0.00 0.00 23.12 19.71 1j3t s ALA 15 CO 0.10 -0.68 1.27 1.28 0.00 0.00 0.00 175.76 177.73 1j3t n LEU 16 N 3.49 0.75 -3.64 0.00 4.77 -0.35 -0.77 117.00 121.26 1j3t n LEU 16 Ca 0.11 -0.20 -0.10 0.00 -0.03 0.00 0.00 56.01 55.79 1j3t n LEU 16 Cb 0.41 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.29 1j3t n LEU 16 CO 0.60 0.18 0.16 0.00 -1.33 0.00 0.00 177.39 177.00 1j3t s SER 18 N -2.81 5.74 0.19 0.00 0.01 -1.26 -3.41 113.70 112.17 1j3t s SER 18 Ca 0.04 1.66 -0.05 0.00 1.31 0.00 0.00 55.95 58.91 1j3t s SER 18 Cb 0.02 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.76 1j3t s SER 18 CO -0.11 -1.19 0.34 1.87 0.41 0.00 0.00 173.24 174.55 1j3t n TRP 19 N -2.53 -1.40 -4.22 2.43 -0.00 -0.94 -4.85 117.44 105.93 1j3t n TRP 19 Ca 0.08 -1.04 -0.13 0.00 -0.00 0.00 0.00 57.50 56.41 1j3t n TRP 19 Cb 0.53 0.39 -0.10 0.00 -0.00 0.00 0.00 31.31 32.14 1j3t n TRP 19 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 177.69 178.64 1j3t s THR 20 N -2.58 0.97 0.64 5.87 -4.23 -1.26 -4.23 115.64 110.82 1j3t s THR 20 Ca 0.11 -2.01 -0.15 0.00 -1.18 0.00 0.00 61.69 58.46 1j3t s THR 20 Cb -0.02 -1.80 -0.01 0.00 1.34 0.00 0.00 72.50 72.01 1j3t s THR 20 CO 0.08 -0.79 1.09 0.00 -0.54 0.00 0.00 174.62 174.47 1j3t s ALA 21 N -3.45 2.56 0.00 3.99 0.00 -1.18 -4.81 121.76 118.87 1j3t s ALA 21 Ca 0.15 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1j3t s ALA 21 Cb 0.04 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1j3t s ALA 21 CO -0.01 -1.12 0.00 1.63 0.00 0.00 0.00 175.76 176.25 1j3t n LYS 22 N -2.31 3.13 -4.44 0.00 4.76 -1.26 -5.04 118.16 112.99 1j3t n LYS 22 Ca 0.10 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.32 1j3t n LYS 22 Cb 0.52 -0.29 -0.10 0.00 -1.84 0.00 0.00 35.03 33.32 1j3t n LYS 22 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1j3t s LYS 23 N -0.10 1.59 0.00 1.97 -0.14 -1.26 -5.01 119.74 116.78 1j3t s LYS 23 Ca 0.00 -1.80 0.12 0.00 -1.36 0.00 0.00 55.97 52.93 1j3t s LYS 23 Cb 0.00 -1.26 0.65 0.00 -1.68 0.00 0.00 37.83 35.54 1j3t s LYS 23 CO 0.00 0.07 1.25 -3.47 -0.76 0.00 0.00 175.35 172.44 1j3t n ASP 24 N -0.61 0.00 -0.19 2.83 2.03 -1.26 -1.21 116.55 118.13 1j3t n ASP 24 Ca -0.05 -0.06 0.02 0.00 0.52 0.00 0.00 54.79 55.22 1j3t n ASP 24 Cb 0.63 -0.18 0.06 0.00 -0.72 0.00 0.00 41.12 40.91 1j3t n ASP 24 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1j3t n ASN 25 N -1.18 2.32 -4.91 1.67 6.94 -1.26 -5.03 115.26 113.80 1j3t n ASN 25 Ca 0.07 -2.12 -0.27 0.00 -0.02 0.00 0.00 54.58 52.24 1j3t n ASN 25 Cb 0.08 -0.11 0.02 0.00 -2.36 0.00 0.00 39.78 37.41 1j3t n ASN 25 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1j3t s HIS 26 N -1.22 3.36 0.20 -2.53 3.76 -0.35 -0.23 115.29 118.28 1j3t s HIS 26 Ca 0.10 0.72 0.02 0.00 -0.15 0.00 0.00 55.06 55.74 1j3t s HIS 26 Cb 0.06 -2.62 -0.04 0.00 1.11 0.00 0.00 32.58 31.10 1j3t s HIS 26 CO 0.04 -0.67 0.36 -1.17 -0.85 0.00 0.00 174.74 172.45 1j3t s LEU 27 N -4.93 4.27 -0.21 0.89 1.98 -0.09 -4.49 118.68 116.09 1j3t s LEU 27 Ca 0.52 0.26 -0.01 0.00 -2.89 0.00 0.00 54.13 52.02 1j3t s LEU 27 Cb -0.10 -3.03 0.06 0.00 0.66 0.00 0.00 46.19 43.77 1j3t s LEU 27 CO 0.45 -0.03 -0.02 0.54 -1.89 0.00 0.00 176.35 175.40 1j3t s ASN 28 N -3.40 3.40 0.43 3.68 6.03 -1.26 -3.09 114.94 120.72 1j3t s ASN 28 Ca 0.36 -0.99 0.03 0.00 -1.03 0.00 0.00 52.86 51.24 1j3t s ASN 28 Cb -0.11 -0.95 -0.04 0.00 -3.03 0.00 0.00 41.25 37.13 1j3t s ASN 28 CO 0.29 -0.25 0.05 0.72 -2.03 0.00 0.00 177.10 175.88 1j3t s PHE 29 N 1.58 1.97 0.43 1.54 -0.12 -1.26 -4.96 117.98 117.16 1j3t s PHE 29 Ca -0.03 -1.00 0.06 0.00 -0.05 0.00 0.00 56.93 55.91 1j3t s PHE 29 Cb -0.18 -1.46 -0.06 0.00 -0.63 0.00 0.00 43.02 40.70 1j3t s PHE 29 CO -0.07 0.08 0.08 0.45 -0.05 0.00 0.00 175.22 175.71 1j3t s SER 30 N -3.70 4.10 0.04 1.98 0.15 -1.26 -2.22 113.70 112.80 1j3t s SER 30 Ca 0.21 -1.30 -0.32 0.00 0.70 0.00 0.00 55.95 55.24 1j3t s SER 30 Cb 0.05 -0.30 -0.11 0.00 -1.71 0.00 0.00 66.02 63.94 1j3t s SER 30 CO 0.11 -0.54 1.85 1.17 1.20 0.00 0.00 173.24 177.03 1j3t n LYS 31 N -1.11 2.54 -0.68 5.44 4.81 -1.22 -2.41 118.16 125.53 1j3t n LYS 31 Ca -0.05 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1j3t n LYS 31 Cb 0.66 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.91 1j3t n LYS 31 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1j3t n HIS 32 N 6.06 0.00 -1.33 5.64 8.25 0.05 -4.89 115.22 129.00 1j3t n HIS 32 Ca 0.20 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.33 1j3t n HIS 32 Cb 0.35 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.55 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 -3.05 4.16 -0.16 0.41 1.01 -1.01 -4.67 116.67 113.35 1j3t s ASP 33 Ca 0.00 2.19 -0.02 0.00 0.71 0.00 0.00 52.55 55.42 1j3t s ASP 33 Cb 0.00 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.34 1j3t s ASP 33 CO 0.00 -2.28 -0.07 -0.63 0.21 0.00 0.00 175.17 172.40 1j3t s ILE 34 N -2.30 3.46 -0.09 0.77 -1.09 -1.26 -0.73 121.20 119.96 1j3t s ILE 34 Ca 0.70 -0.50 0.04 0.00 -2.23 0.00 0.00 60.65 58.66 1j3t s ILE 34 Cb -0.25 -2.51 -0.00 0.00 -1.58 0.00 0.00 42.46 38.12 1j3t s ILE 34 CO 0.48 0.49 -0.23 -0.63 -1.23 0.00 0.00 174.94 173.82 1j3t s ILE 35 N 0.62 1.98 -0.33 2.92 1.09 -0.27 -4.81 121.20 122.40 1j3t s ILE 35 Ca -0.04 -0.99 -0.29 0.00 -1.10 0.00 0.00 60.65 58.23 1j3t s ILE 35 Cb -0.15 -1.70 -0.01 0.00 -1.06 0.00 0.00 42.46 39.54 1j3t s ILE 35 CO 0.03 0.54 1.63 -0.89 -0.10 0.00 0.00 174.94 176.15 1j3t s THR 36 N 0.24 3.66 0.37 2.92 2.01 -0.30 -1.50 115.64 123.04 1j3t s THR 36 Ca -0.15 0.69 -0.24 0.00 0.31 0.00 0.00 61.69 62.30 1j3t s THR 36 Cb -0.17 -3.84 -0.10 0.00 0.01 0.00 0.00 72.50 68.41 1j3t s THR 36 CO 0.07 -0.49 0.97 -0.69 -0.69 0.00 0.00 174.62 173.79 1j3t s VAL 37 N 6.04 4.11 0.00 3.82 1.01 0.49 -0.44 120.40 135.44 1j3t s VAL 37 Ca 0.72 1.61 0.00 0.00 0.00 0.00 0.00 61.98 64.31 1j3t s VAL 37 Cb -0.20 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1j3t s VAL 37 CO 0.32 0.01 0.00 0.18 0.00 0.00 0.00 175.10 175.61 1j3t n LEU 38 N 0.13 0.00 -4.66 3.92 4.77 -0.01 -3.80 117.00 117.35 1j3t n LEU 38 Ca 0.04 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.74 1j3t n LEU 38 Cb 0.51 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.52 1j3t n LEU 38 CO 0.43 -0.36 -0.35 -0.70 -1.33 0.00 0.00 177.39 175.08 1j3t s GLU 39 N -0.72 2.40 -0.27 3.23 2.56 -0.97 -4.95 118.70 119.97 1j3t s GLU 39 Ca 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 54.97 53.91 1j3t s GLU 39 Cb 0.00 -2.40 0.10 0.00 2.00 0.00 0.00 34.13 33.83 1j3t s GLU 39 CO 0.00 0.49 0.15 -0.65 -0.56 0.00 0.00 175.26 174.68 1j3t s GLN 40 N -2.65 0.19 0.00 4.30 -0.21 -1.26 -0.58 119.66 119.45 1j3t s GLN 40 Ca 0.26 -0.40 0.00 0.00 0.02 0.00 0.00 55.36 55.24 1j3t s GLN 40 Cb -0.10 -1.20 0.00 0.00 1.00 0.00 0.00 33.01 32.70 1j3t s GLN 40 CO 0.18 -0.96 0.00 1.04 -2.12 0.00 0.00 175.29 173.43 1j3t n GLN 41 N 5.26 -0.09 -0.32 2.91 1.13 -0.18 -4.98 117.38 121.11 1j3t n GLN 41 Ca -0.06 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.92 1j3t n GLN 41 Cb 0.44 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.71 1j3t n GLN 41 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 1j3t n GLU 42 N -1.03 -0.34 0.00 -1.09 0.28 -1.26 -4.19 120.64 113.00 1j3t n GLU 42 Ca 0.00 1.28 0.00 0.00 -0.16 0.00 0.00 57.16 58.28 1j3t n GLU 42 Cb 0.00 -1.88 0.00 0.00 1.43 0.00 0.00 31.44 30.99 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 -4.27 -1.84 3.02 -1.26 -5.07 115.26 101.03 1j3t n ASN 43 Ca 0.02 -0.96 -0.29 0.00 -0.03 0.00 0.00 54.58 53.31 1j3t n ASN 43 Cb 0.20 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.21 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 0.00 2.15 0.08 3.10 0.52 -1.26 -0.17 118.94 123.35 1j3t s TRP 44 Ca 0.00 -0.42 0.10 0.00 0.02 0.00 0.00 56.10 55.79 1j3t s TRP 44 Cb 0.00 -1.38 -0.03 0.00 -1.15 0.00 0.00 33.47 30.90 1j3t s TRP 44 CO 0.00 -0.05 -0.26 -1.58 0.02 0.00 0.00 176.95 175.08 1j3t s TRP 45 N -0.53 2.26 -0.25 -1.98 0.51 0.10 -1.01 118.94 118.04 1j3t s TRP 45 Ca 0.08 -0.40 -0.19 0.00 -2.12 0.00 0.00 56.10 53.48 1j3t s TRP 45 Cb -0.09 -1.31 -0.03 0.00 -0.81 0.00 0.00 33.47 31.23 1j3t s TRP 45 CO -0.01 0.20 0.54 0.12 -0.51 0.00 0.00 176.95 177.29 1j3t s PHE 46 N -0.90 3.29 0.27 -1.98 5.36 0.26 -0.64 117.98 123.64 1j3t s PHE 46 Ca 0.12 0.71 -0.14 0.00 -0.96 0.00 0.00 56.93 56.66 1j3t s PHE 46 Cb -0.10 -2.74 0.01 0.00 -0.34 0.00 0.00 43.02 39.85 1j3t s PHE 46 CO 0.03 -0.26 0.55 0.20 -1.46 0.00 0.00 175.22 174.29 1j3t s GLY 47 N 1.45 0.48 -0.06 13.12 0.00 0.03 -0.83 107.32 121.51 1j3t s GLY 47 Ca 0.23 -0.81 -0.01 0.00 0.00 0.00 0.00 44.72 44.14 1j3t s GLY 47 CO 0.09 -0.52 -0.01 1.85 0.00 0.00 0.00 173.10 174.51 1j3t s GLU 48 N -3.78 0.60 0.06 2.90 2.12 0.42 -2.04 118.70 118.98 1j3t s GLU 48 Ca 0.20 0.07 -0.13 0.00 0.36 0.00 0.00 54.97 55.47 1j3t s GLU 48 Cb -0.02 -0.88 0.02 0.00 0.26 0.00 0.00 34.13 33.51 1j3t s GLU 48 CO 0.10 -0.24 0.29 0.54 -0.54 0.00 0.00 175.26 175.41 1j3t s VAL 49 N 1.66 0.09 0.00 3.70 0.11 -0.43 -1.15 120.40 124.38 1j3t s VAL 49 Ca 0.00 -0.75 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 1j3t s VAL 49 Cb -0.13 -1.03 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 1j3t s VAL 49 CO -0.04 -0.42 0.00 1.41 -3.33 0.00 0.00 175.10 172.73 1j3t n HIS 50 N 0.37 0.00 0.00 1.54 8.25 -1.26 -1.73 115.22 122.39 1j3t n HIS 50 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 1j3t n HIS 50 Cb 0.60 -1.26 0.00 0.00 1.12 0.00 0.00 29.99 30.45 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 -1.84 1.08 3.14 -1.41 0.00 -1.26 -5.12 105.19 99.78 1j3t n GLY 51 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1j3t n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j3t s GLY 52 N -1.31 0.08 0.74 -0.02 0.00 -0.70 -5.18 107.32 100.94 1j3t s GLY 52 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 44.72 44.33 1j3t s GLY 52 CO 0.00 -0.48 1.05 0.50 0.00 0.00 0.00 173.10 174.17 1j3t s ARG 53 N -2.23 1.85 0.00 2.90 0.52 -1.26 -1.32 118.95 119.41 1j3t s ARG 53 Ca -0.08 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 54.66 1j3t s ARG 53 Cb -0.03 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 33.28 1j3t s ARG 53 CO -0.02 -1.45 0.00 0.41 0.02 0.00 0.00 175.30 174.25 1j3t n GLY 54 N -3.02 1.50 3.90 -3.53 0.00 -0.87 -4.56 105.19 98.62 1j3t n GLY 54 Ca 0.11 -1.08 -0.28 0.00 0.00 0.00 0.00 46.02 44.77 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 -2.00 3.48 0.02 1.61 0.52 0.68 -0.79 118.94 122.48 1j3t s TRP 55 Ca 0.00 0.73 -0.26 0.00 0.02 0.00 0.00 56.10 56.58 1j3t s TRP 55 Cb 0.00 -2.18 0.06 0.00 -1.15 0.00 0.00 33.47 30.20 1j3t s TRP 55 CO 0.00 0.06 0.60 -0.59 0.02 0.00 0.00 176.95 177.04 1j3t s PHE 56 N -2.23 -0.55 -0.31 -1.98 -0.12 0.19 -0.92 117.98 112.06 1j3t s PHE 56 Ca 0.46 0.73 -0.28 0.00 -0.05 0.00 0.00 56.93 57.78 1j3t s PHE 56 Cb -0.10 0.41 -0.02 0.00 -0.63 0.00 0.00 43.02 42.68 1j3t s PHE 56 CO 0.32 -0.66 1.76 -1.25 -0.05 0.00 0.00 175.22 175.34 1j3t s PRO 57 N -2.11 3.42 0.58 1.99 0.05 -1.26 -0.72 135.00 136.94 1j3t s PRO 57 Ca -0.07 1.46 0.27 0.00 0.05 0.00 0.00 61.00 62.71 1j3t s PRO 57 Cb -0.01 -4.17 1.59 0.00 0.05 0.00 0.00 34.50 31.96 1j3t s PRO 57 CO 0.01 -1.76 2.08 1.57 0.05 0.00 0.00 177.00 178.96 1j3t h LYS 58 N 12.47 0.00 0.00 4.56 2.10 -0.89 -2.56 116.57 132.24 1j3t h LYS 58 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1j3t h LYS 58 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1j3t h LYS 58 CO 1.03 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 179.14 1j3t h SER 59 N 0.00 0.00 1.09 7.07 4.64 -1.90 -0.72 113.55 123.73 1j3t h SER 59 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1j3t h SER 59 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1j3t h SER 59 CO -0.00 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.74 1j3t n TYR 60 N -2.54 0.57 -4.55 4.77 4.02 -0.97 -4.90 117.16 113.57 1j3t n TYR 60 Ca 0.01 0.18 -0.27 0.00 -0.01 0.00 0.00 57.90 57.82 1j3t n TYR 60 Cb 0.23 -0.80 -0.10 0.00 -0.02 0.00 0.00 39.34 38.64 1j3t n TYR 60 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1j3t s VAL 61 N -3.11 2.13 -0.01 -0.72 -7.23 -0.28 -1.21 120.40 109.98 1j3t s VAL 61 Ca 0.10 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.30 1j3t s VAL 61 Cb 0.13 -2.89 -0.02 0.00 0.56 0.00 0.00 36.38 34.16 1j3t s VAL 61 CO 0.50 -0.07 -0.23 -1.59 -0.31 0.00 0.00 175.10 173.40 1j3t s LYS 62 N -3.70 1.80 0.54 4.82 -2.85 -0.25 -4.86 119.74 115.24 1j3t s LYS 62 Ca 0.35 -0.86 -0.21 0.00 -1.00 0.00 0.00 55.97 54.25 1j3t s LYS 62 Cb 0.07 -1.78 -0.05 0.00 -2.06 0.00 0.00 37.83 34.01 1j3t s LYS 62 CO 0.18 0.48 1.29 0.42 0.10 0.00 0.00 175.35 177.82 1j3t s ILE 63 N -0.59 2.40 -0.01 3.79 1.01 -1.26 -1.25 121.20 125.29 1j3t s ILE 63 Ca 0.09 0.29 0.05 0.00 0.00 0.00 0.00 60.65 61.08 1j3t s ILE 63 Cb -0.09 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 1j3t s ILE 63 CO -0.00 -0.01 -0.15 -0.63 0.00 0.00 0.00 174.94 174.14 1j3t s ILE 64 N -1.40 2.99 -0.03 2.92 1.01 -1.13 -4.83 121.20 120.72 1j3t s ILE 64 Ca 0.71 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 60.41 1j3t s ILE 64 Cb -0.36 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.87 1j3t s ILE 64 CO 0.42 0.49 0.33 1.55 0.00 0.00 0.00 174.94 177.73 1j3t h PRO 65 N 5.00 -0.18 -3.80 2.79 0.13 -1.96 -3.44 132.00 130.53 1j3t h PRO 65 Ca -0.47 0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 64.54 1j3t h PRO 65 Cb 1.15 0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 1j3t h PRO 65 CO 0.50 -0.12 -0.13 0.20 -0.23 0.00 0.00 178.00 178.21 1j3t s GLY 66 N -2.52 0.88 -0.30 1.56 0.00 -1.26 -5.05 107.32 100.63 1j3t s GLY 66 Ca -0.03 -1.12 0.06 0.00 0.00 0.00 0.00 44.72 43.63 1j3t s GLY 66 CO 0.08 -0.76 0.59 -0.45 0.00 0.00 0.00 173.10 172.56 1j3t s SER 67 N -3.10 -1.57 0.00 1.64 0.15 -1.26 -5.16 113.70 104.40 1j3t s SER 67 Ca 0.25 0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.96 1j3t s SER 67 Cb -0.01 2.00 0.00 0.00 -1.71 0.00 0.00 66.02 66.31 1j3t s SER 67 CO 0.13 -0.29 0.00 -1.84 1.20 0.00 0.00 173.24 172.44 1j3t n GLU 68 N 5.30 0.00 -4.08 5.44 0.28 -1.26 -4.97 120.64 121.35 1j3t n GLU 68 Ca 0.06 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.94 1j3t n GLU 68 Cb 0.54 0.00 -0.11 0.00 1.43 0.00 0.00 31.44 33.30 1j3t n GLU 68 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1j3t s SER 69 N -0.24 0.86 0.00 -1.84 0.01 -1.26 -5.14 113.70 106.09 1j3t s SER 69 Ca 0.00 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.59 1j3t s SER 69 Cb 0.00 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1j3t s SER 69 CO 0.00 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 173.97 1j3t n GLY 70 N 1.06 -0.42 3.55 3.44 0.00 -1.26 -5.04 105.19 106.52 1j3t n GLY 70 Ca -0.20 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 1j3t n GLY 70 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1j3t s PRO 71 N -1.53 3.16 0.59 1.61 0.04 -1.26 -5.01 135.00 132.62 1j3t s PRO 71 Ca 0.00 -0.15 -0.19 0.00 0.04 0.00 0.00 61.00 60.70 1j3t s PRO 71 Cb 0.00 -4.19 -0.05 0.00 0.04 0.00 0.00 34.50 30.31 1j3t s PRO 71 CO 0.00 -2.17 1.05 -1.13 0.04 0.00 0.00 177.00 174.79 1j3t n SER 72 N 9.60 1.15 0.00 6.66 3.41 -1.26 -4.96 113.62 128.22 1j3t n SER 72 Ca 0.05 0.84 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 1j3t n SER 72 Cb 0.49 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 1j3t n SER 72 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1j3t n SER 73 N -0.89 0.00 0.00 4.04 3.41 -1.26 -5.29 113.62 113.63 1j3t n SER 73 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1j3t n SER 73 Cb 0.47 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1j3t n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49