#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zjr n HIS 3 N 0.00 0.00 -2.62 0.00 -0.00 -1.26 -5.04 115.22 106.30 2zjr n HIS 3 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.69 2zjr n HIS 3 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.01 2zjr n HIS 3 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2zjr n LYS 4 N 0.00 0.41 0.00 -1.40 2.85 -1.26 -5.15 118.16 113.61 2zjr n LYS 4 Ca 0.00 -0.73 0.00 0.00 -1.05 0.00 0.00 58.31 56.53 2zjr n LYS 4 Cb 0.00 0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.43 2zjr n LYS 4 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2zjr n LYS 5 N -0.52 1.75 -2.47 -1.58 4.01 -1.26 -5.17 118.16 112.92 2zjr n LYS 5 Ca -0.16 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.40 2zjr n LYS 5 Cb 0.66 0.00 0.05 0.00 -0.51 0.00 0.00 35.03 35.23 2zjr n LYS 5 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2zjr s GLY 6 N 0.00 1.74 0.00 0.72 0.00 -1.26 -5.06 107.32 103.46 2zjr s GLY 6 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 43.61 2zjr s GLY 6 CO 0.00 -0.78 0.26 -0.62 0.00 0.00 0.00 173.10 171.96 2zjr n VAL 7 N -2.57 0.00 -3.98 1.40 0.31 -1.26 -4.89 118.33 107.35 2zjr n VAL 7 Ca 0.07 0.54 -0.30 0.00 -0.01 0.00 0.00 64.34 64.65 2zjr n VAL 7 Cb 0.60 -1.11 -0.05 0.00 -0.91 0.00 0.00 33.84 32.37 2zjr n VAL 7 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2zjr s GLY 8 N -0.86 2.05 -0.12 2.92 0.00 -1.26 -5.05 107.32 104.99 2zjr s GLY 8 Ca 0.00 -0.95 -0.29 0.00 0.00 0.00 0.00 44.72 43.48 2zjr s GLY 8 CO 0.00 -0.93 1.80 -0.56 0.00 0.00 0.00 173.10 173.41 2zjr s SER 9 N -2.59 6.32 0.96 1.64 0.01 -1.26 -4.98 113.70 113.80 2zjr s SER 9 Ca 0.33 2.05 -0.11 0.00 1.31 0.00 0.00 55.95 59.53 2zjr s SER 9 Cb -0.12 -2.53 0.17 0.00 0.21 0.00 0.00 66.02 63.75 2zjr s SER 9 CO 0.26 -1.24 1.10 -0.44 0.41 0.00 0.00 173.24 173.33 2zjr s SER 10 N 4.71 2.62 -0.40 2.44 0.01 -1.26 -4.46 113.70 117.36 2zjr s SER 10 Ca 0.80 1.89 -0.01 0.00 1.31 0.00 0.00 55.95 59.94 2zjr s SER 10 Cb -0.32 -2.45 -0.02 0.00 0.21 0.00 0.00 66.02 63.45 2zjr s SER 10 CO 0.33 -3.24 0.36 0.29 0.41 0.00 0.00 173.24 171.39 2zjr n LYS 11 N -4.31 -0.80 -0.09 12.44 5.02 -1.26 -5.08 118.16 124.09 2zjr n LYS 11 Ca 0.09 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 57.03 2zjr n LYS 11 Cb 0.53 -3.41 0.00 0.00 -0.02 0.00 0.00 35.03 32.13 2zjr n LYS 11 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2zjr n ASN 12 N -1.82 0.56 0.00 4.39 3.02 -1.26 -5.07 115.26 115.08 2zjr n ASN 12 Ca -0.02 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 2zjr n ASN 12 Cb 0.53 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 2zjr n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2zjr n GLY 13 N 5.00 0.58 3.76 7.41 0.00 -1.26 -5.13 105.19 115.55 2zjr n GLY 13 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2zjr n GLY 13 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2zjr s ARG 14 N 0.00 3.18 0.18 1.61 6.06 -1.26 -4.87 118.95 123.85 2zjr s ARG 14 Ca 0.00 1.95 0.00 0.00 -2.50 0.00 0.00 55.73 55.18 2zjr s ARG 14 Cb 0.00 -2.13 0.00 0.00 0.06 0.00 0.00 34.95 32.88 2zjr s ARG 14 CO 0.00 -1.07 0.00 -0.25 -2.50 0.00 0.00 175.30 171.48 2zjr n ASP 15 N -1.18 -2.32 0.00 -2.12 10.43 -1.26 -5.12 116.55 114.98 2zjr n ASP 15 Ca 0.11 0.47 0.00 0.00 2.57 0.00 0.00 54.79 57.94 2zjr n ASP 15 Cb 0.48 -1.17 0.00 0.00 1.84 0.00 0.00 41.12 42.27 2zjr n ASP 15 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 2zjr n SER 16 N -2.34 0.83 -3.89 -2.24 2.88 -1.26 -5.19 113.62 102.41 2zjr n SER 16 Ca -0.02 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.41 2zjr n SER 16 Cb 0.18 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.52 2zjr n SER 16 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2zjr s ASN 17 N 2.00 0.04 0.15 -3.46 0.01 -1.26 -5.06 114.94 107.36 2zjr s ASN 17 Ca 0.00 -0.15 -0.19 0.00 -0.71 0.00 0.00 52.86 51.80 2zjr s ASN 17 Cb 0.00 0.18 0.05 0.00 0.41 0.00 0.00 41.25 41.89 2zjr s ASN 17 CO 0.00 -0.24 1.66 -0.65 -1.51 0.00 0.00 177.10 176.36 2zjr h PRO 18 N 4.94 -0.09 -2.12 -0.60 0.11 -2.09 -3.48 132.00 128.68 2zjr h PRO 18 Ca -0.29 0.01 0.12 0.00 0.11 0.00 0.00 66.00 65.94 2zjr h PRO 18 Cb 1.20 0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 2zjr h PRO 18 CO 0.42 -0.06 -0.50 0.36 -0.21 0.00 0.00 178.00 178.01 2zjr n LYS 19 N -5.31 -1.39 0.00 1.05 2.85 -1.26 -5.11 118.16 108.99 2zjr n LYS 19 Ca 0.00 1.13 0.00 0.00 -1.05 0.00 0.00 58.31 58.39 2zjr n LYS 19 Cb 0.23 -1.88 0.00 0.00 -0.65 0.00 0.00 35.03 32.73 2zjr n LYS 19 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2zjr n TYR 20 N -3.36 0.00 0.00 5.58 4.01 -1.26 -5.19 117.16 116.94 2zjr n TYR 20 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2zjr n TYR 20 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 2zjr n TYR 20 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2zjr n LEU 21 N 0.00 0.00 0.00 7.72 4.77 -1.26 -5.12 117.00 123.11 2zjr n LEU 21 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2zjr n LEU 21 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2zjr n LEU 21 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2zjr n GLY 22 N -1.30 -0.24 3.26 -0.72 0.00 -0.55 -5.00 105.19 100.64 2zjr n GLY 22 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 2zjr n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zjr s VAL 23 N 0.00 -0.79 -0.01 1.61 1.01 -1.26 -3.81 120.40 117.15 2zjr s VAL 23 Ca 0.00 0.05 0.10 0.00 0.00 0.00 0.00 61.98 62.13 2zjr s VAL 23 Cb 0.00 -0.84 -0.23 0.00 0.00 0.00 0.00 36.38 35.31 2zjr s VAL 23 CO 0.00 -0.00 0.78 0.11 0.00 0.00 0.00 175.10 175.99 2zjr h LYS 24 N 8.10 0.03 -3.77 2.72 1.79 -0.66 -3.45 116.57 121.32 2zjr h LYS 24 Ca -0.18 -0.04 -0.51 0.00 -2.18 0.00 0.00 60.65 57.73 2zjr h LYS 24 Cb 1.13 0.02 -0.39 0.00 -1.58 0.00 0.00 32.23 31.40 2zjr h LYS 24 CO 0.17 0.66 -0.77 0.15 -1.08 0.00 0.00 179.45 178.58 2zjr s LYS 25 N -2.62 0.89 0.61 3.15 -0.14 -0.26 -4.88 119.74 116.48 2zjr s LYS 25 Ca -0.05 -0.37 -0.02 0.00 -1.36 0.00 0.00 55.97 54.17 2zjr s LYS 25 Cb 0.08 -1.89 0.04 0.00 -1.68 0.00 0.00 37.83 34.39 2zjr s LYS 25 CO 0.82 -0.52 0.87 -0.06 -0.76 0.00 0.00 175.35 175.70 2zjr s PHE 26 N 1.80 2.92 -0.09 3.18 0.40 -1.26 -4.84 117.98 120.10 2zjr s PHE 26 Ca 0.00 0.22 -0.34 0.00 -0.60 0.00 0.00 56.93 56.21 2zjr s PHE 26 Cb -0.16 -2.91 -0.12 0.00 0.51 0.00 0.00 43.02 40.35 2zjr s PHE 26 CO -0.07 -1.06 1.89 0.41 0.70 0.00 0.00 175.22 177.09 2zjr n GLY 27 N -2.57 1.48 0.00 4.36 0.00 -1.26 -2.50 105.19 104.69 2zjr n GLY 27 Ca 0.07 0.87 0.00 0.00 0.00 0.00 0.00 46.02 46.96 2zjr n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjr n GLY 28 N 4.43 0.50 3.71 -0.02 0.00 -0.43 -4.98 105.19 108.41 2zjr n GLY 28 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2zjr n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zjr s GLU 29 N -0.76 4.54 -0.89 1.61 2.02 -1.04 -4.65 118.70 119.52 2zjr s GLU 29 Ca 0.00 1.48 -0.25 0.00 0.02 0.00 0.00 54.97 56.22 2zjr s GLU 29 Cb 0.00 -3.44 -0.09 0.00 0.10 0.00 0.00 34.13 30.70 2zjr s GLU 29 CO 0.00 -0.08 2.13 0.08 0.02 0.00 0.00 175.26 177.41 2zjr s VAL 30 N 1.00 3.27 0.00 2.63 1.01 -1.26 -0.78 120.40 126.28 2zjr s VAL 30 Ca 0.53 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2zjr s VAL 30 Cb -0.22 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2zjr s VAL 30 CO 0.28 -0.55 0.00 1.33 0.00 0.00 0.00 175.10 176.16 2zjr n VAL 31 N 8.28 0.00 -3.87 2.92 0.24 0.42 -4.89 118.33 121.43 2zjr n VAL 31 Ca 0.43 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.65 2zjr n VAL 31 Cb 0.45 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 2zjr n VAL 31 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2zjr s LYS 32 N -2.40 1.82 0.04 7.34 2.20 -1.26 -3.99 119.74 123.49 2zjr s LYS 32 Ca 0.00 -1.09 -0.30 0.00 -0.36 0.00 0.00 55.97 54.22 2zjr s LYS 32 Cb 0.00 0.59 -0.06 0.00 -1.51 0.00 0.00 37.83 36.85 2zjr s LYS 32 CO 0.00 -0.83 1.42 0.00 -0.36 0.00 0.00 175.35 175.58 2zjr s ALA 33 N -3.71 3.59 0.00 3.13 0.00 -0.97 -2.95 121.76 120.85 2zjr s ALA 33 Ca 0.13 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2zjr s ALA 33 Cb -0.05 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2zjr s ALA 33 CO 0.08 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.40 2zjr n GLY 34 N 3.64 2.83 3.58 0.00 0.00 -0.96 -5.00 105.19 109.28 2zjr n GLY 34 Ca 0.13 -0.27 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 2zjr n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2zjr n ASN 35 N 0.57 1.17 -4.79 1.61 3.02 -1.15 -4.65 115.26 111.03 2zjr n ASN 35 Ca 0.00 1.15 -0.37 0.00 -0.03 0.00 0.00 54.58 55.34 2zjr n ASN 35 Cb 0.00 -1.28 -0.07 0.00 -0.61 0.00 0.00 39.78 37.82 2zjr n ASN 35 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2zjr s ILE 36 N -1.10 5.34 -0.04 2.41 1.01 -1.26 -2.12 121.20 125.44 2zjr s ILE 36 Ca 0.59 0.42 0.06 0.00 0.00 0.00 0.00 60.65 61.73 2zjr s ILE 36 Cb -0.68 -3.54 -0.10 0.00 0.01 0.00 0.00 42.46 38.15 2zjr s ILE 36 CO 0.60 0.50 0.09 0.18 0.00 0.00 0.00 174.94 176.30 2zjr n LEU 37 N 2.80 0.00 -3.67 2.97 4.32 -0.67 -4.02 117.00 118.73 2zjr n LEU 37 Ca -0.15 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.75 2zjr n LEU 37 Cb 0.53 0.08 -0.09 0.00 -1.62 0.00 0.00 43.42 42.32 2zjr n LEU 37 CO 0.36 0.08 0.09 -0.69 -1.22 0.00 0.00 177.39 176.01 2zjr s VAL 38 N -2.32 -0.42 -0.22 4.08 1.01 -1.22 0.01 120.40 121.33 2zjr s VAL 38 Ca -0.03 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 2zjr s VAL 38 Cb 0.03 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 2zjr s VAL 38 CO 0.28 0.05 0.01 -0.13 0.00 0.00 0.00 175.10 175.31 2zjr s ARG 39 N 2.16 3.60 0.21 2.72 0.52 -1.25 -1.22 118.95 125.70 2zjr s ARG 39 Ca -0.05 -0.52 -0.10 0.00 -0.52 0.00 0.00 55.73 54.54 2zjr s ARG 39 Cb -0.10 -3.14 -0.01 0.00 0.52 0.00 0.00 34.95 32.22 2zjr s ARG 39 CO -0.14 -0.06 0.37 1.14 0.02 0.00 0.00 175.30 176.62 2zjr s GLN 40 N 1.22 1.37 -0.12 3.54 -2.07 -1.26 -1.49 119.66 120.84 2zjr s GLN 40 Ca 0.03 -1.26 -0.07 0.00 -1.82 0.00 0.00 55.36 52.24 2zjr s GLN 40 Cb -0.15 0.41 -0.02 0.00 -1.09 0.00 0.00 33.01 32.16 2zjr s GLN 40 CO 0.02 -0.53 -0.14 0.00 -1.32 0.00 0.00 175.29 173.31 2zjr h ARG 41 N 2.40 0.00 0.00 9.60 2.47 -1.89 -3.41 114.38 123.55 2zjr h ARG 41 Ca -0.29 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2zjr h ARG 41 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.56 2zjr h ARG 41 CO 0.42 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.36 2zjr n GLY 42 N 1.65 1.16 2.49 0.04 0.00 -1.26 -4.71 105.19 104.56 2zjr n GLY 42 Ca -0.06 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.66 2zjr n GLY 42 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2zjr n THR 43 N 0.00 2.89 -0.30 2.61 -1.04 -1.26 -4.79 114.28 112.39 2zjr n THR 43 Ca 0.00 -4.37 -0.12 0.00 -2.04 0.00 0.00 64.05 57.52 2zjr n THR 43 Cb 0.00 -1.22 -0.10 0.00 -1.82 0.00 0.00 70.33 67.19 2zjr n THR 43 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2zjr h LYS 44 N 2.54 -0.14 -5.20 -2.82 3.64 -1.93 -3.35 116.57 109.31 2zjr h LYS 44 Ca 0.42 0.01 -0.65 0.00 -1.27 0.00 0.00 60.65 59.16 2zjr h LYS 44 Cb 0.79 0.03 -0.26 0.00 -0.41 0.00 0.00 32.23 32.39 2zjr h LYS 44 CO 1.08 -0.09 -0.72 -0.06 -2.27 0.00 0.00 179.45 177.39 2zjr s PHE 45 N -5.43 2.92 -0.07 1.91 0.40 -1.26 -3.81 117.98 112.64 2zjr s PHE 45 Ca -0.12 -0.65 -0.17 0.00 -0.60 0.00 0.00 56.93 55.38 2zjr s PHE 45 Cb 0.10 -1.97 -0.05 0.00 0.51 0.00 0.00 43.02 41.61 2zjr s PHE 45 CO 0.59 -0.28 0.47 0.15 0.70 0.00 0.00 175.22 176.85 2zjr s LYS 46 N 0.75 4.22 -0.87 0.44 1.02 0.27 -4.92 119.74 120.65 2zjr s LYS 46 Ca -0.03 0.47 -0.21 0.00 0.02 0.00 0.00 55.97 56.22 2zjr s LYS 46 Cb -0.15 -3.36 -0.22 0.00 -0.52 0.00 0.00 37.83 33.58 2zjr s LYS 46 CO 0.02 0.34 2.39 0.00 -0.92 0.00 0.00 175.35 177.18 2zjr n ALA 47 N 2.99 0.68 -1.00 5.17 0.00 -1.26 -3.22 120.51 123.87 2zjr n ALA 47 Ca -0.09 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.50 2zjr n ALA 47 Cb 0.52 -2.71 0.00 0.00 0.00 0.00 0.00 19.45 17.25 2zjr n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zjr n GLY 48 N 6.14 -2.92 3.40 0.00 0.00 0.12 -4.81 105.19 107.13 2zjr n GLY 48 Ca 0.58 -0.71 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 2zjr n GLY 48 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2zjr s GLN 49 N 0.00 3.06 0.00 1.61 0.74 -1.19 -4.12 119.66 119.76 2zjr s GLN 49 Ca 0.00 -1.17 0.00 0.00 0.05 0.00 0.00 55.36 54.24 2zjr s GLN 49 Cb 0.00 -4.16 0.00 0.00 1.10 0.00 0.00 33.01 29.95 2zjr s GLN 49 CO 0.00 -1.25 0.00 0.41 -0.55 0.00 0.00 175.29 173.90 2zjr n GLY 50 N 5.21 1.00 3.49 2.59 0.00 -1.26 -1.86 105.19 114.36 2zjr n GLY 50 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2zjr n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zjr s VAL 51 N -2.00 3.61 0.00 1.61 1.01 -1.26 -2.34 120.40 121.03 2zjr s VAL 51 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2zjr s VAL 51 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.85 2zjr s VAL 51 CO 0.00 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2zjr n GLY 52 N 3.09 -0.04 3.07 4.51 0.00 0.23 -4.68 105.19 111.37 2zjr n GLY 52 Ca -0.18 -1.79 -0.00 0.00 0.00 0.00 0.00 46.02 44.05 2zjr n GLY 52 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2zjr s MET 53 N -0.79 0.51 1.04 1.61 0.00 -1.26 -3.50 119.30 116.90 2zjr s MET 53 Ca 0.00 0.54 -0.18 0.00 0.00 0.00 0.00 55.69 56.05 2zjr s MET 53 Cb 0.00 0.11 0.02 0.00 0.00 0.00 0.00 34.83 34.96 2zjr s MET 53 CO 0.00 -0.92 -0.16 0.41 0.00 0.00 0.00 175.02 174.35 2zjr n GLY 54 N 5.40 -2.65 0.27 2.11 0.00 -0.53 -4.78 105.19 105.01 2zjr n GLY 54 Ca 0.02 -0.69 0.15 0.00 0.00 0.00 0.00 46.02 45.50 2zjr n GLY 54 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2zjr h ARG 55 N -1.65 0.00 -1.78 1.61 2.43 -2.01 -2.71 114.38 110.27 2zjr h ARG 55 Ca -0.47 0.00 -0.75 0.00 -0.81 0.00 0.00 59.98 57.95 2zjr h ARG 55 Cb 1.33 0.00 -0.27 0.00 -0.42 0.00 0.00 29.97 30.61 2zjr h ARG 55 CO 0.33 0.10 1.02 -0.40 -1.51 0.00 0.00 179.97 179.51 2zjr n ASP 56 N -3.39 7.57 -0.97 -3.80 5.75 -1.26 -4.83 116.55 115.61 2zjr n ASP 56 Ca -0.01 -3.83 -0.06 0.00 -0.01 0.00 0.00 54.79 50.88 2zjr n ASP 56 Cb 0.27 -1.05 -0.03 0.00 -1.03 0.00 0.00 41.12 39.28 2zjr n ASP 56 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2zjr n HIS 57 N -0.62 -0.50 -1.54 2.11 8.25 -1.02 -4.39 115.22 117.50 2zjr n HIS 57 Ca 0.56 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.72 2zjr n HIS 57 Cb 0.33 -1.74 0.20 0.00 1.12 0.00 0.00 29.99 29.89 2zjr n HIS 57 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2zjr s THR 58 N -1.39 1.85 0.02 1.59 2.01 -1.24 -4.25 115.64 114.23 2zjr s THR 58 Ca 0.00 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.01 2zjr s THR 58 Cb 0.00 -2.76 -0.01 0.00 0.01 0.00 0.00 72.50 69.73 2zjr s THR 58 CO 0.00 0.00 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.13 2zjr s LEU 59 N -6.31 2.15 0.24 4.42 1.43 -0.35 -1.45 118.68 118.80 2zjr s LEU 59 Ca 0.71 -0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 53.38 2zjr s LEU 59 Cb -0.08 -0.04 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 2zjr s LEU 59 CO 0.54 -0.15 0.40 0.72 0.23 0.00 0.00 176.35 178.09 2zjr s PHE 60 N -0.89 0.55 0.04 0.29 -0.71 -1.23 -1.67 117.98 114.36 2zjr s PHE 60 Ca -0.08 -0.88 -0.15 0.00 -1.04 0.00 0.00 56.93 54.79 2zjr s PHE 60 Cb -0.06 0.02 -0.06 0.00 -1.21 0.00 0.00 43.02 41.70 2zjr s PHE 60 CO -0.00 -0.91 0.45 0.00 -1.34 0.00 0.00 175.22 173.41 2zjr s ALA 61 N -4.05 3.67 -0.16 1.99 0.00 -0.90 0.78 121.76 123.09 2zjr s ALA 61 Ca 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 51.96 52.00 2zjr s ALA 61 Cb 0.01 -2.42 -0.23 0.00 0.00 0.00 0.00 23.12 20.48 2zjr s ALA 61 CO 0.10 0.48 0.20 1.28 0.00 0.00 0.00 175.76 177.82 2zjr n LEU 62 N 1.54 2.60 0.00 0.00 7.99 -0.99 -2.27 117.00 125.88 2zjr n LEU 62 Ca -0.12 0.11 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2zjr n LEU 62 Cb 0.52 -0.97 0.00 0.00 -0.11 0.00 0.00 43.42 42.86 2zjr n LEU 62 CO 0.39 0.85 0.00 -1.54 -1.51 0.00 0.00 177.39 175.58 2zjr n SER 63 N -3.38 1.87 -0.90 -1.43 3.41 -1.26 -4.66 113.62 107.25 2zjr n SER 63 Ca -0.35 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.15 2zjr n SER 63 Cb 1.03 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 2zjr n SER 63 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2zjr n ASP 64 N -0.12 0.01 0.00 4.04 9.92 -1.26 -2.30 116.55 126.84 2zjr n ASP 64 Ca 0.00 -0.45 0.00 0.00 -0.53 0.00 0.00 54.79 53.81 2zjr n ASP 64 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2zjr n ASP 64 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2zjr n GLY 65 N 5.00 0.29 3.48 0.44 0.00 -1.26 -4.62 105.19 108.52 2zjr n GLY 65 Ca 0.00 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.41 2zjr n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2zjr s LYS 66 N 0.00 3.65 0.42 1.61 2.20 -1.26 -0.43 119.74 125.93 2zjr s LYS 66 Ca 0.00 -0.52 -0.26 0.00 -0.36 0.00 0.00 55.97 54.83 2zjr s LYS 66 Cb 0.00 -2.99 -0.09 0.00 -1.51 0.00 0.00 37.83 33.24 2zjr s LYS 66 CO 0.00 0.14 1.45 0.28 -0.36 0.00 0.00 175.35 176.86 2zjr n VAL 67 N 3.84 2.47 -3.77 4.02 0.31 0.04 -1.01 118.33 124.23 2zjr n VAL 67 Ca -0.17 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.53 2zjr n VAL 67 Cb 0.52 -1.89 -0.12 0.00 -0.91 0.00 0.00 33.84 31.44 2zjr n VAL 67 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2zjr s VAL 68 N -1.16 -0.02 -0.02 2.52 1.01 0.39 -1.31 120.40 121.82 2zjr s VAL 68 Ca 0.58 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.66 2zjr s VAL 68 Cb -0.46 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2zjr s VAL 68 CO 0.60 0.02 -0.13 -0.36 0.00 0.00 0.00 175.10 175.23 2zjr s PHE 69 N 0.52 2.72 -0.05 5.22 0.40 -1.26 0.14 117.98 125.67 2zjr s PHE 69 Ca -0.03 -0.14 -0.02 0.00 -0.60 0.00 0.00 56.93 56.13 2zjr s PHE 69 Cb -0.05 -1.59 0.03 0.00 0.51 0.00 0.00 43.02 41.93 2zjr s PHE 69 CO -0.03 0.25 0.07 0.42 0.70 0.00 0.00 175.22 176.63 2zjr s ILE 70 N -0.85 -0.11 -0.32 0.64 1.01 0.20 -4.97 121.20 116.80 2zjr s ILE 70 Ca 0.14 0.37 -0.01 0.00 0.00 0.00 0.00 60.65 61.15 2zjr s ILE 70 Cb -0.11 -0.20 0.07 0.00 0.01 0.00 0.00 42.46 42.23 2zjr s ILE 70 CO 0.03 0.13 0.02 0.21 0.00 0.00 0.00 174.94 175.34 2zjr s ASN 71 N 2.17 4.88 -0.50 3.58 3.84 -1.26 0.35 114.94 128.00 2zjr s ASN 71 Ca 0.05 -1.50 -0.20 0.00 0.21 0.00 0.00 52.86 51.42 2zjr s ASN 71 Cb -0.12 -1.70 0.05 0.00 -0.55 0.00 0.00 41.25 38.92 2zjr s ASN 71 CO -0.04 -0.31 0.67 -0.54 -2.79 0.00 0.00 177.10 174.10 2zjr s LYS 72 N 1.18 3.19 -0.53 0.43 1.02 -1.09 -4.47 119.74 119.46 2zjr s LYS 72 Ca -0.02 -0.67 -0.07 0.00 0.02 0.00 0.00 55.97 55.23 2zjr s LYS 72 Cb -0.20 -4.05 0.07 0.00 -0.52 0.00 0.00 37.83 33.12 2zjr s LYS 72 CO -0.03 -1.21 0.17 0.41 -0.92 0.00 0.00 175.35 173.77 2zjr n GLY 73 N 5.13 -0.35 7.00 -3.33 0.00 -1.26 -4.17 105.19 108.21 2zjr n GLY 73 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2zjr n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2zjr n LYS 74 N -2.38 0.00 0.00 1.61 4.76 -1.26 -4.79 118.16 116.10 2zjr n LYS 74 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 2zjr n LYS 74 Cb 0.37 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.56 2zjr n LYS 74 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2zjr n GLY 75 N 0.00 0.00 2.91 0.72 0.00 -1.26 -4.27 105.19 103.29 2zjr n GLY 75 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2zjr n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zjr s ALA 76 N 0.00 1.02 0.19 4.61 0.00 -1.26 -4.98 121.76 121.34 2zjr s ALA 76 Ca 0.00 -0.30 0.10 0.00 0.00 0.00 0.00 51.96 51.76 2zjr s ALA 76 Cb 0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 2zjr s ALA 76 CO 0.00 -0.17 -0.20 1.03 0.00 0.00 0.00 175.76 176.42 2zjr s ARG 77 N 1.25 1.41 -0.11 0.00 1.81 -1.25 -2.69 118.95 119.37 2zjr s ARG 77 Ca -0.05 -1.51 -0.07 0.00 -1.72 0.00 0.00 55.73 52.38 2zjr s ARG 77 Cb -0.14 -1.54 0.04 0.00 -0.45 0.00 0.00 34.95 32.87 2zjr s ARG 77 CO -0.02 0.31 0.28 -0.06 -0.68 0.00 0.00 175.30 175.13 2zjr s PHE 78 N -2.06 -0.36 -0.14 -0.53 0.40 0.15 0.96 117.98 116.40 2zjr s PHE 78 Ca 0.20 0.85 -0.04 0.00 -0.60 0.00 0.00 56.93 57.33 2zjr s PHE 78 Cb -0.06 0.10 -0.03 0.00 0.51 0.00 0.00 43.02 43.53 2zjr s PHE 78 CO 0.09 -0.23 0.00 0.42 0.70 0.00 0.00 175.22 176.21 2zjr s ILE 79 N 0.98 4.29 0.43 0.64 1.01 -1.20 0.59 121.20 127.95 2zjr s ILE 79 Ca -0.07 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.38 2zjr s ILE 79 Cb -0.08 -2.88 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 2zjr s ILE 79 CO -0.07 0.51 0.10 -1.20 0.00 0.00 0.00 174.94 174.29 2zjr n SER 80 N 3.15 1.89 -3.55 3.58 7.64 0.37 -0.70 113.62 126.00 2zjr n SER 80 Ca -0.17 -3.15 -0.29 0.00 1.01 0.00 0.00 58.87 56.26 2zjr n SER 80 Cb 0.53 0.81 -0.14 0.00 -1.01 0.00 0.00 64.21 64.39 2zjr n SER 80 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2zjr s ILE 81 N -2.98 0.15 -1.26 0.44 1.01 -0.78 -0.46 121.20 117.33 2zjr s ILE 81 Ca 0.14 -1.15 -0.07 0.00 0.00 0.00 0.00 60.65 59.58 2zjr s ILE 81 Cb 0.01 -1.13 0.17 0.00 0.01 0.00 0.00 42.46 41.51 2zjr s ILE 81 CO 0.10 -0.80 2.04 -0.62 0.00 0.00 0.00 174.94 175.66 2zjr n GLU 82 N 4.83 4.21 -0.47 2.79 1.02 -0.18 -4.75 120.64 128.09 2zjr n GLU 82 Ca -0.00 -3.67 -0.16 0.00 -0.02 0.00 0.00 57.16 53.31 2zjr n GLU 82 Cb 0.40 -2.74 0.01 0.00 -0.02 0.00 0.00 31.44 29.10 2zjr n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2zjr n ALA 83 N 2.50 -2.87 -0.44 0.62 0.00 -1.26 -3.99 120.51 115.07 2zjr n ALA 83 Ca 0.48 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2zjr n ALA 83 Cb 0.31 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.22 2zjr n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjr n ALA 84 N -0.81 0.00 -0.13 0.00 0.00 -1.26 -4.72 120.51 113.58 2zjr n ALA 84 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2zjr n ALA 84 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 2zjr n ALA 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54