#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 0.00 -4.14 1.61 3.41 -1.26 -5.17 113.62 108.07 1j3t n SER 2 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1j3t n SER 2 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1j3t n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1j3t s SER 3 N -3.97 1.04 0.00 4.04 1.04 -1.26 -4.92 113.70 109.67 1j3t s SER 3 Ca 0.00 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.55 1j3t s SER 3 Cb 0.00 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1j3t s SER 3 CO 0.00 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.43 1j3t n GLY 4 N 0.37 2.97 3.59 7.32 0.00 -1.26 -4.68 105.19 113.50 1j3t n GLY 4 Ca -0.15 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 0.10 -3.03 -4.37 1.61 7.64 -1.26 -4.97 113.62 109.35 1j3t n SER 5 Ca 0.00 -0.52 -0.19 0.00 1.01 0.00 0.00 58.87 59.17 1j3t n SER 5 Cb 0.00 -2.54 -0.10 0.00 -1.01 0.00 0.00 64.21 60.56 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 -2.81 2.05 0.00 6.43 1.04 -1.26 -5.08 113.70 114.07 1j3t s SER 6 Ca 0.48 -1.25 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1j3t s SER 6 Cb -0.26 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 65.83 1j3t s SER 6 CO 0.59 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.91 1j3t n GLY 7 N -0.50 0.42 3.55 7.32 0.00 -1.26 -5.12 105.19 109.60 1j3t n GLY 7 Ca -0.04 0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 1.93 0.26 1.61 -7.23 -1.26 -5.09 120.40 110.62 1j3t s VAL 8 Ca 0.00 0.00 -0.04 0.00 -1.81 0.00 0.00 61.98 60.13 1j3t s VAL 8 Cb 0.00 -2.25 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 1j3t s VAL 8 CO 0.00 0.00 0.33 -0.70 -0.31 0.00 0.00 175.10 174.42 1j3t s GLU 9 N -4.75 1.53 1.13 4.82 2.12 -1.26 -5.16 118.70 117.14 1j3t s GLU 9 Ca 0.68 -1.58 -0.17 0.00 0.36 0.00 0.00 54.97 54.25 1j3t s GLU 9 Cb -0.21 0.38 0.14 0.00 0.26 0.00 0.00 34.13 34.70 1j3t s GLU 9 CO 0.61 -0.59 0.22 0.09 -0.54 0.00 0.00 175.26 175.05 1j3t n ASN 10 N -0.70 -2.24 -4.75 -1.70 3.02 -1.26 -5.01 115.26 102.62 1j3t n ASN 10 Ca 0.01 -0.12 -0.36 0.00 -0.03 0.00 0.00 54.58 54.08 1j3t n ASN 10 Cb 0.63 -1.02 0.04 0.00 -0.61 0.00 0.00 39.78 38.82 1j3t n ASN 10 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1j3t s LEU 11 N -2.50 3.60 0.12 3.41 2.96 -1.24 -4.91 118.68 120.12 1j3t s LEU 11 Ca 0.59 2.37 0.09 0.00 -0.22 0.00 0.00 54.13 56.96 1j3t s LEU 11 Cb -0.15 -4.60 -0.04 0.00 0.50 0.00 0.00 46.19 41.91 1j3t s LEU 11 CO 0.66 -1.69 -0.23 -0.54 -1.32 0.00 0.00 176.35 173.22 1j3t s LYS 12 N -3.45 1.24 -0.03 1.98 1.02 -1.26 -0.52 119.74 118.71 1j3t s LYS 12 Ca 0.77 -1.25 0.01 0.00 0.02 0.00 0.00 55.97 55.52 1j3t s LYS 12 Cb -0.30 -1.58 0.02 0.00 -0.52 0.00 0.00 37.83 35.45 1j3t s LYS 12 CO 0.35 0.37 -0.02 0.00 -0.92 0.00 0.00 175.35 175.13 1j3t s ALA 13 N -1.17 0.47 -0.02 5.17 0.00 -0.14 -2.98 121.76 123.09 1j3t s ALA 13 Ca 0.10 0.03 -0.25 0.00 0.00 0.00 0.00 51.96 51.84 1j3t s ALA 13 Cb -0.10 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 1j3t s ALA 13 CO 0.05 -0.02 0.79 -1.14 0.00 0.00 0.00 175.76 175.44 1j3t s GLN 14 N 0.82 4.48 0.43 0.00 0.74 -0.12 -1.61 119.66 124.39 1j3t s GLN 14 Ca -0.09 1.06 -0.25 0.00 0.05 0.00 0.00 55.36 56.12 1j3t s GLN 14 Cb -0.13 -3.43 -0.08 0.00 1.10 0.00 0.00 33.01 30.47 1j3t s GLN 14 CO -0.01 0.09 1.27 0.00 -0.55 0.00 0.00 175.29 176.09 1j3t s ALA 15 N 0.66 3.16 -0.28 1.58 0.00 0.47 -0.74 121.76 126.60 1j3t s ALA 15 Ca 0.41 1.16 0.20 0.00 0.00 0.00 0.00 51.96 53.74 1j3t s ALA 15 Cb -0.19 -3.46 -0.29 0.00 0.00 0.00 0.00 23.12 19.17 1j3t s ALA 15 CO 0.22 -0.81 0.56 1.28 0.00 0.00 0.00 175.76 177.01 1j3t n LEU 16 N -0.09 0.26 -4.19 0.00 4.77 0.22 -1.48 117.00 116.48 1j3t n LEU 16 Ca 0.05 -0.14 -0.12 0.00 -0.03 0.00 0.00 56.01 55.77 1j3t n LEU 16 Cb 0.45 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 1j3t n LEU 16 CO 0.54 0.07 -0.21 0.00 -1.33 0.00 0.00 177.39 176.46 1j3t s SER 18 N -3.17 6.23 -0.16 0.00 1.04 -1.26 -2.91 113.70 113.47 1j3t s SER 18 Ca 0.38 1.41 -0.21 0.00 0.48 0.00 0.00 55.95 58.01 1j3t s SER 18 Cb 0.06 -2.46 0.05 0.00 0.10 0.00 0.00 66.02 63.78 1j3t s SER 18 CO 0.13 -0.87 0.56 0.86 0.98 0.00 0.00 173.24 174.90 1j3t s TRP 19 N -3.17 -0.58 -0.47 5.02 -0.00 0.43 -4.90 118.94 115.27 1j3t s TRP 19 Ca 0.55 1.32 0.04 0.00 -0.00 0.00 0.00 56.10 58.00 1j3t s TRP 19 Cb -0.11 0.23 0.63 0.00 -0.00 0.00 0.00 33.47 34.22 1j3t s TRP 19 CO 0.54 -0.36 1.90 0.25 -0.00 0.00 0.00 176.95 179.28 1j3t n THR 20 N 2.30 3.22 0.00 5.86 -2.24 -1.26 -2.09 114.28 120.06 1j3t n THR 20 Ca -0.15 -2.12 0.00 0.00 -2.27 0.00 0.00 64.05 59.51 1j3t n THR 20 Cb 0.56 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1j3t n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j3t n ALA 21 N -1.12 0.00 0.00 6.98 0.00 -1.23 -4.90 120.51 120.25 1j3t n ALA 21 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.03 1j3t n ALA 21 Cb 1.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.95 1j3t n ALA 21 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j3t n LYS 22 N 0.00 0.00 -1.24 0.00 5.02 -1.26 -4.91 118.16 115.77 1j3t n LYS 22 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 1j3t n LYS 22 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.15 1j3t n LYS 22 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1j3t s LYS 23 N 0.00 1.21 0.15 1.97 -0.14 -1.26 -4.96 119.74 116.71 1j3t s LYS 23 Ca 0.00 0.75 -0.24 0.00 -1.36 0.00 0.00 55.97 55.12 1j3t s LYS 23 Cb 0.00 -1.81 0.02 0.00 -1.68 0.00 0.00 37.83 34.36 1j3t s LYS 23 CO 0.00 -2.25 1.61 0.22 -0.76 0.00 0.00 175.35 174.17 1j3t h ASP 24 N -1.56 -0.97 -0.68 2.83 3.58 -2.03 -2.89 116.42 114.71 1j3t h ASP 24 Ca -0.50 0.16 -0.23 0.00 0.42 0.00 0.00 57.03 56.88 1j3t h ASP 24 Cb 1.29 0.44 -0.14 0.00 1.72 0.00 0.00 39.33 42.64 1j3t h ASP 24 CO 0.56 -0.33 0.25 -3.20 -2.88 0.00 0.00 179.24 173.64 1j3t n ASN 25 N -5.40 4.29 -4.76 2.28 5.15 -1.26 -4.94 115.26 110.62 1j3t n ASN 25 Ca -0.01 -3.33 -0.39 0.00 -0.60 0.00 0.00 54.58 50.25 1j3t n ASN 25 Cb 0.32 -0.72 -0.05 0.00 -0.53 0.00 0.00 39.78 38.79 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 -3.06 3.73 0.74 1.20 3.76 -1.09 -0.26 115.29 120.31 1j3t s HIS 26 Ca 0.53 1.80 -0.11 0.00 -0.15 0.00 0.00 55.06 57.13 1j3t s HIS 26 Cb 0.43 -3.05 0.04 0.00 1.11 0.00 0.00 32.58 31.11 1j3t s HIS 26 CO 0.11 0.03 1.09 -1.17 -0.85 0.00 0.00 174.74 173.95 1j3t s LEU 27 N -1.64 3.11 -0.03 0.89 1.98 0.16 -4.66 118.68 118.49 1j3t s LEU 27 Ca 0.46 1.84 0.01 0.00 -2.89 0.00 0.00 54.13 53.55 1j3t s LEU 27 Cb -0.25 -4.52 0.01 0.00 0.66 0.00 0.00 46.19 42.09 1j3t s LEU 27 CO 0.31 -1.91 -0.04 0.54 -1.89 0.00 0.00 176.35 173.36 1j3t s ASN 28 N -3.27 0.75 0.28 3.68 2.20 -1.26 -3.48 114.94 113.84 1j3t s ASN 28 Ca 0.62 -0.10 -0.02 0.00 -0.94 0.00 0.00 52.86 52.42 1j3t s ASN 28 Cb -0.17 -0.27 -0.02 0.00 -2.00 0.00 0.00 41.25 38.79 1j3t s ASN 28 CO 0.53 -0.01 0.33 0.72 -2.94 0.00 0.00 177.10 175.73 1j3t s PHE 29 N 0.50 1.11 0.38 1.54 -0.12 -0.89 -4.96 117.98 115.54 1j3t s PHE 29 Ca -0.06 -1.30 0.08 0.00 -0.05 0.00 0.00 56.93 55.60 1j3t s PHE 29 Cb -0.10 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 41.94 1j3t s PHE 29 CO -0.00 -0.90 0.21 -1.12 -0.05 0.00 0.00 175.22 173.36 1j3t s SER 30 N -3.20 4.72 0.21 1.98 0.01 -1.26 -0.43 113.70 115.72 1j3t s SER 30 Ca 0.34 -0.84 -0.32 0.00 1.31 0.00 0.00 55.95 56.44 1j3t s SER 30 Cb 0.02 -0.64 -0.14 0.00 0.21 0.00 0.00 66.02 65.48 1j3t s SER 30 CO 0.17 -0.45 1.39 1.17 0.41 0.00 0.00 173.24 175.94 1j3t n LYS 31 N -1.27 1.87 -0.87 12.44 4.81 -1.14 -2.10 118.16 131.89 1j3t n LYS 31 Ca -0.01 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 1j3t n LYS 31 Cb 0.62 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.36 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 2.09 0.00 -1.77 5.64 8.25 -0.55 -4.95 115.22 123.93 1j3t n HIS 32 Ca 0.13 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.22 1j3t n HIS 32 Cb 0.29 -0.53 0.06 0.00 1.12 0.00 0.00 29.99 30.93 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 -2.52 4.91 -0.28 0.41 1.11 -0.89 -4.64 116.67 114.77 1j3t s ASP 33 Ca 0.00 2.68 -0.08 0.00 0.18 0.00 0.00 52.55 55.33 1j3t s ASP 33 Cb 0.00 -2.63 -0.01 0.00 1.07 0.00 0.00 42.92 41.35 1j3t s ASP 33 CO 0.00 -1.80 0.10 -0.63 1.18 0.00 0.00 175.17 174.02 1j3t s ILE 34 N -1.36 4.36 -0.09 0.77 -1.09 -1.26 -0.39 121.20 122.14 1j3t s ILE 34 Ca 0.78 -0.37 0.03 0.00 -2.23 0.00 0.00 60.65 58.85 1j3t s ILE 34 Cb -0.39 -3.15 -0.02 0.00 -1.58 0.00 0.00 42.46 37.32 1j3t s ILE 34 CO 0.43 0.18 -0.17 -0.63 -1.23 0.00 0.00 174.94 173.52 1j3t s ILE 35 N 1.59 2.77 -0.28 2.92 1.09 -0.63 -4.78 121.20 123.88 1j3t s ILE 35 Ca 0.05 -0.79 -0.29 0.00 -1.10 0.00 0.00 60.65 58.52 1j3t s ILE 35 Cb -0.16 -2.11 -0.02 0.00 -1.06 0.00 0.00 42.46 39.11 1j3t s ILE 35 CO 0.04 0.56 1.61 -0.89 -0.10 0.00 0.00 174.94 176.16 1j3t s THR 36 N -0.06 3.70 0.42 2.92 2.01 0.12 -0.96 115.64 123.79 1j3t s THR 36 Ca -0.04 0.76 -0.23 0.00 0.31 0.00 0.00 61.69 62.49 1j3t s THR 36 Cb -0.14 -3.80 -0.09 0.00 0.01 0.00 0.00 72.50 68.49 1j3t s THR 36 CO 0.04 -0.41 1.08 -0.69 -0.69 0.00 0.00 174.62 173.95 1j3t s VAL 37 N 5.60 3.57 0.00 3.82 1.01 0.32 -0.22 120.40 134.50 1j3t s VAL 37 Ca 0.71 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.86 1j3t s VAL 37 Cb -0.22 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1j3t s VAL 37 CO 0.30 -0.02 0.00 0.18 0.00 0.00 0.00 175.10 175.57 1j3t n LEU 38 N -0.25 0.00 -4.74 3.92 4.77 0.01 -3.68 117.00 117.03 1j3t n LEU 38 Ca 0.06 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.75 1j3t n LEU 38 Cb 0.49 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 1j3t n LEU 38 CO 0.45 -0.42 -0.29 -0.70 -1.33 0.00 0.00 177.39 175.11 1j3t s GLU 39 N -0.84 2.71 -0.27 3.23 2.12 -1.09 -4.95 118.70 119.61 1j3t s GLU 39 Ca 0.00 -0.83 -0.04 0.00 0.36 0.00 0.00 54.97 54.46 1j3t s GLU 39 Cb 0.00 -2.60 0.10 0.00 0.26 0.00 0.00 34.13 31.89 1j3t s GLU 39 CO 0.00 0.53 0.15 -0.65 -0.54 0.00 0.00 175.26 174.74 1j3t s GLN 40 N -2.58 0.19 1.21 4.30 -0.21 -1.26 -0.32 119.66 120.98 1j3t s GLN 40 Ca 0.28 -0.38 -0.19 0.00 0.02 0.00 0.00 55.36 55.09 1j3t s GLN 40 Cb -0.11 -1.21 0.29 0.00 1.00 0.00 0.00 33.01 32.98 1j3t s GLN 40 CO 0.21 -0.95 1.10 -0.65 -2.12 0.00 0.00 175.29 172.87 1j3t s GLN 41 N 2.15 -1.28 0.18 2.91 -1.52 0.29 -4.97 119.66 117.41 1j3t s GLN 41 Ca 0.08 -0.02 -0.26 0.00 -1.95 0.00 0.00 55.36 53.21 1j3t s GLN 41 Cb -0.16 -1.59 0.03 0.00 -0.22 0.00 0.00 33.01 31.08 1j3t s GLN 41 CO -0.31 -3.76 1.55 1.05 -0.25 0.00 0.00 175.29 173.57 1j3t h GLU 42 N -2.62 -0.12 0.00 2.91 4.11 -2.02 -3.33 114.58 113.51 1j3t h GLU 42 Ca -0.45 0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1j3t h GLU 42 Cb 1.30 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1j3t h GLU 42 CO 0.35 -0.08 0.00 0.09 0.07 0.00 0.00 179.01 179.44 1j3t n ASN 43 N -5.37 0.27 -4.32 3.06 3.02 -1.26 -5.03 115.26 105.63 1j3t n ASN 43 Ca 0.03 -0.70 -0.32 0.00 -0.03 0.00 0.00 54.58 53.56 1j3t n ASN 43 Cb 0.33 0.16 -0.15 0.00 -0.61 0.00 0.00 39.78 39.51 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 -0.16 2.54 -0.04 3.10 0.52 -1.25 -0.38 118.94 123.26 1j3t s TRP 44 Ca 0.00 -0.59 0.06 0.00 0.02 0.00 0.00 56.10 55.59 1j3t s TRP 44 Cb 0.00 -1.64 -0.01 0.00 -1.15 0.00 0.00 33.47 30.67 1j3t s TRP 44 CO 0.00 -0.13 -0.23 -1.58 0.02 0.00 0.00 176.95 175.03 1j3t s TRP 45 N -0.22 2.14 0.17 -1.98 0.51 0.16 -0.55 118.94 119.18 1j3t s TRP 45 Ca -0.01 -0.52 -0.27 0.00 -2.12 0.00 0.00 56.10 53.18 1j3t s TRP 45 Cb -0.13 -1.40 -0.08 0.00 -0.81 0.00 0.00 33.47 31.05 1j3t s TRP 45 CO 0.03 -0.12 0.82 0.12 -0.51 0.00 0.00 176.95 177.29 1j3t s PHE 46 N -0.32 3.92 0.15 -1.98 5.36 0.57 -0.49 117.98 125.19 1j3t s PHE 46 Ca 0.02 1.70 -0.25 0.00 -0.96 0.00 0.00 56.93 57.45 1j3t s PHE 46 Cb -0.11 -2.83 0.07 0.00 -0.34 0.00 0.00 43.02 39.81 1j3t s PHE 46 CO 0.01 0.48 1.00 0.20 -1.46 0.00 0.00 175.22 175.45 1j3t s GLY 47 N -1.06 -0.16 -0.09 13.12 0.00 0.14 -0.81 107.32 118.45 1j3t s GLY 47 Ca 0.37 0.06 0.01 0.00 0.00 0.00 0.00 44.72 45.16 1j3t s GLY 47 CO 0.28 0.50 -0.11 1.85 0.00 0.00 0.00 173.10 175.61 1j3t s GLU 48 N -2.97 1.71 -0.07 2.90 2.12 0.70 -1.02 118.70 122.06 1j3t s GLU 48 Ca 0.14 -0.37 -0.12 0.00 0.36 0.00 0.00 54.97 54.98 1j3t s GLU 48 Cb -0.01 -1.55 0.03 0.00 0.26 0.00 0.00 34.13 32.85 1j3t s GLU 48 CO 0.03 -0.10 0.29 0.54 -0.54 0.00 0.00 175.26 175.48 1j3t s VAL 49 N 1.12 0.03 -0.76 3.70 0.11 -1.26 -0.70 120.40 122.64 1j3t s VAL 49 Ca -0.06 -0.23 -0.15 0.00 -2.93 0.00 0.00 61.98 58.62 1j3t s VAL 49 Cb -0.14 -0.50 0.02 0.00 -1.53 0.00 0.00 36.38 34.23 1j3t s VAL 49 CO -0.02 -0.12 0.28 0.00 -3.33 0.00 0.00 175.10 171.91 1j3t n HIS 50 N 2.22 -0.77 -0.75 1.54 1.44 -1.26 -0.94 115.22 116.70 1j3t n HIS 50 Ca -0.17 0.11 0.00 0.00 -2.01 0.00 0.00 57.72 55.66 1j3t n HIS 50 Cb 0.57 -1.59 0.00 0.00 0.12 0.00 0.00 29.99 29.09 1j3t n HIS 50 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1j3t n GLY 51 N -1.70 0.85 0.00 -1.39 0.00 -1.26 -4.99 105.19 96.70 1j3t n GLY 51 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1j3t n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j3t n GLY 52 N -2.07 -2.43 3.03 -0.02 0.00 -0.11 -5.01 105.19 98.57 1j3t n GLY 52 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1j3t n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j3t n ARG 53 N -0.17 -2.29 -3.89 1.61 1.74 -1.07 -4.97 116.66 107.63 1j3t n ARG 53 Ca 0.00 1.95 -0.09 0.00 -0.77 0.00 0.00 57.85 58.94 1j3t n ARG 53 Cb 0.00 -4.33 -0.06 0.00 -1.02 0.00 0.00 32.46 27.05 1j3t n ARG 53 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1j3t s GLY 54 N -2.03 0.29 0.39 -0.13 0.00 -0.19 -4.90 107.32 100.76 1j3t s GLY 54 Ca 0.23 -0.66 -0.19 0.00 0.00 0.00 0.00 44.72 44.09 1j3t s GLY 54 CO 0.74 -0.63 0.88 -0.98 0.00 0.00 0.00 173.10 173.12 1j3t s TRP 55 N -3.94 3.34 0.01 1.90 0.52 0.64 -0.69 118.94 120.73 1j3t s TRP 55 Ca 0.15 1.50 -0.17 0.00 0.02 0.00 0.00 56.10 57.60 1j3t s TRP 55 Cb 0.02 -2.76 0.03 0.00 -1.15 0.00 0.00 33.47 29.61 1j3t s TRP 55 CO -0.00 -0.03 0.36 -0.59 0.02 0.00 0.00 176.95 176.70 1j3t s PHE 56 N -2.10 -0.22 -0.04 -1.98 -0.12 0.36 -0.67 117.98 113.22 1j3t s PHE 56 Ca 0.59 0.25 -0.30 0.00 -0.05 0.00 0.00 56.93 57.42 1j3t s PHE 56 Cb -0.10 0.15 -0.05 0.00 -0.63 0.00 0.00 43.02 42.39 1j3t s PHE 56 CO 0.15 -0.48 1.44 -1.25 -0.05 0.00 0.00 175.22 175.04 1j3t s PRO 57 N -1.87 4.25 0.61 1.99 0.04 -1.26 -0.67 135.00 138.08 1j3t s PRO 57 Ca -0.09 1.97 0.33 0.00 0.04 0.00 0.00 61.00 63.25 1j3t s PRO 57 Cb -0.03 -3.71 1.96 0.00 0.04 0.00 0.00 34.50 32.76 1j3t s PRO 57 CO 0.01 -0.67 2.28 1.57 0.04 0.00 0.00 177.00 180.23 1j3t h LYS 58 N 8.34 0.00 0.00 4.56 2.10 -1.05 -1.75 116.57 128.76 1j3t h LYS 58 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 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 0.93 0.01 0.00 1.03 -2.00 0.00 0.00 179.45 179.42 1j3t h SER 59 N 0.00 0.00 0.22 7.07 0.87 -1.91 -1.97 113.55 117.84 1j3t h SER 59 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1j3t h SER 59 Cb 0.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1j3t h SER 59 CO 0.00 0.00 -0.06 -1.22 -0.53 0.00 0.00 176.83 175.02 1j3t n TYR 60 N -2.77 0.00 -4.47 2.24 4.02 -0.66 -4.88 117.16 110.64 1j3t n TYR 60 Ca -0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.65 1j3t n TYR 60 Cb 0.20 -0.11 -0.07 0.00 -0.02 0.00 0.00 39.34 39.34 1j3t n TYR 60 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 1j3t n VAL 61 N -0.81 0.00 -3.90 -0.72 0.24 -0.74 -0.61 118.33 111.79 1j3t n VAL 61 Ca 0.18 -2.20 -0.11 0.00 -2.04 0.00 0.00 64.34 60.17 1j3t n VAL 61 Cb 0.25 0.78 -0.13 0.00 -1.47 0.00 0.00 33.84 33.27 1j3t n VAL 61 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1j3t s LYS 62 N -3.44 0.14 0.70 7.34 -2.85 0.08 -4.78 119.74 116.93 1j3t s LYS 62 Ca 0.18 -0.19 -0.16 0.00 -1.00 0.00 0.00 55.97 54.80 1j3t s LYS 62 Cb 0.01 0.05 0.02 0.00 -2.06 0.00 0.00 37.83 35.86 1j3t s LYS 62 CO 0.13 -0.02 1.21 0.42 0.10 0.00 0.00 175.35 177.19 1j3t s ILE 63 N -0.53 2.38 0.04 3.79 1.01 -1.26 -0.95 121.20 125.69 1j3t s ILE 63 Ca -0.06 0.20 0.09 0.00 0.00 0.00 0.00 60.65 60.88 1j3t s ILE 63 Cb -0.04 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 1j3t s ILE 63 CO -0.00 -0.09 -0.26 -0.63 0.00 0.00 0.00 174.94 173.95 1j3t s ILE 64 N -1.90 2.13 -0.92 2.92 1.01 -1.16 -4.81 121.20 118.47 1j3t s ILE 64 Ca 0.75 -1.39 0.22 0.00 0.00 0.00 0.00 60.65 60.24 1j3t s ILE 64 Cb -0.30 -1.82 0.20 0.00 0.01 0.00 0.00 42.46 40.55 1j3t s ILE 64 CO 0.43 0.36 1.70 -0.81 0.00 0.00 0.00 174.94 176.62 1j3t n PRO 65 N 1.78 0.05 -0.33 2.79 -0.04 -1.26 -4.86 135.00 133.13 1j3t n PRO 65 Ca -0.17 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1j3t n PRO 65 Cb 0.52 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1j3t n PRO 65 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1j3t n GLY 66 N 0.70 0.88 1.69 0.55 0.00 -1.26 -5.05 105.19 102.71 1j3t n GLY 66 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.20 -3.51 1.61 7.64 -1.26 -5.13 113.62 113.17 1j3t n SER 67 Ca 0.00 -1.29 0.00 0.00 1.01 0.00 0.00 58.87 58.59 1j3t n SER 67 Cb 0.00 -0.40 -0.05 0.00 -1.01 0.00 0.00 64.21 62.75 1j3t n SER 67 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1j3t s GLU 68 N -4.08 0.29 -0.33 1.43 2.56 -1.26 -5.15 118.70 112.16 1j3t s GLU 68 Ca 0.32 0.61 0.00 0.00 0.00 0.00 0.00 54.97 55.90 1j3t s GLU 68 Cb -0.01 0.24 0.14 0.00 2.00 0.00 0.00 34.13 36.49 1j3t s GLU 68 CO 0.22 -0.08 0.26 -1.12 -0.56 0.00 0.00 175.26 173.98 1j3t s SER 69 N 1.87 2.27 0.09 -1.70 0.01 -1.26 -4.94 113.70 110.04 1j3t s SER 69 Ca -0.05 -1.52 0.00 0.00 1.31 0.00 0.00 55.95 55.69 1j3t s SER 69 Cb -0.04 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.28 1j3t s SER 69 CO -0.16 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1j3t n GLY 70 N 4.62 -1.85 3.56 3.44 0.00 -1.26 -5.03 105.19 108.67 1j3t n GLY 70 Ca 0.05 0.57 -0.29 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.39 2.68 -0.42 1.61 0.04 -1.26 -4.93 135.00 131.33 1j3t s PRO 71 Ca 0.00 -0.55 -0.16 0.00 0.04 0.00 0.00 61.00 60.33 1j3t s PRO 71 Cb 0.00 -5.13 0.03 0.00 0.04 0.00 0.00 34.50 29.43 1j3t s PRO 71 CO 0.00 -3.33 0.36 0.45 0.04 0.00 0.00 177.00 174.52 1j3t s SER 72 N 7.40 6.14 0.00 6.66 0.15 -1.26 -4.94 113.70 127.85 1j3t s SER 72 Ca 0.67 -0.87 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1j3t s SER 72 Cb -0.05 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 1j3t s SER 72 CO 0.01 -0.53 0.00 -1.54 1.20 0.00 0.00 173.24 172.38 1j3t n SER 73 N 5.33 0.00 0.00 5.45 3.41 -1.26 -5.27 113.62 121.28 1j3t n SER 73 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1j3t n SER 73 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1j3t n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49