#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zjq s ARG 7 N 0.00 4.32 0.99 1.64 1.70 -1.26 -3.93 118.95 122.41 2zjq s ARG 7 Ca 0.00 0.84 -0.11 0.00 -0.47 0.00 0.00 55.73 55.98 2zjq s ARG 7 Cb 0.00 -3.28 0.19 0.00 -0.57 0.00 0.00 34.95 31.29 2zjq s ARG 7 CO 0.00 0.52 1.10 -0.08 -1.08 0.00 0.00 175.30 175.77 2zjq s THR 8 N -0.78 2.13 0.01 4.99 -1.32 -1.26 -4.99 115.64 114.42 2zjq s THR 8 Ca 0.31 0.04 0.10 0.00 -1.21 0.00 0.00 61.69 60.94 2zjq s THR 8 Cb -0.20 -2.12 -0.13 0.00 -1.51 0.00 0.00 72.50 68.54 2zjq s THR 8 CO 0.20 -0.06 1.23 0.11 -2.21 0.00 0.00 174.62 173.89 2zjq h LYS 9 N -2.09 0.00 0.00 7.08 1.57 -1.98 -3.49 116.57 117.66 2zjq h LYS 9 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2zjq h LYS 9 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2zjq h LYS 9 CO 0.45 0.77 0.00 0.34 -0.57 0.00 0.00 179.45 180.44 2zjq n PHE 10 N -3.25 0.00 0.00 -1.35 7.35 -1.26 -5.19 117.46 113.75 2zjq n PHE 10 Ca -0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 2zjq n PHE 10 Cb 0.89 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.72 2zjq n PHE 10 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2zjq n ARG 11 N -0.12 0.00 -0.04 -4.13 5.12 -1.26 -5.09 116.66 111.14 2zjq n ARG 11 Ca 0.00 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.87 2zjq n ARG 11 Cb 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.28 2zjq n ARG 11 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2zjq n LYS 12 N 0.00 0.29 0.00 5.56 4.81 -1.26 -5.11 118.16 122.46 2zjq n LYS 12 Ca 0.00 0.12 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 2zjq n LYS 12 Cb 0.00 -0.98 0.00 0.00 0.02 0.00 0.00 35.03 34.07 2zjq n LYS 12 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2zjq n GLN 13 N -3.78 0.00 -0.83 1.64 7.27 -1.26 -5.16 117.38 115.27 2zjq n GLN 13 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.99 2zjq n GLN 13 Cb 0.29 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.94 2zjq n GLN 13 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 2zjq n PHE 14 N 0.00 -0.16 0.00 3.69 3.72 -1.26 -4.82 117.46 118.63 2zjq n PHE 14 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2zjq n PHE 14 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2zjq n PHE 14 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2zjq n ARG 15 N 0.00 0.00 0.00 -1.08 1.74 -1.26 -4.69 116.66 111.37 2zjq n ARG 15 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2zjq n ARG 15 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2zjq n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zjq n GLY 16 N 0.00 3.13 3.65 -0.13 0.00 -1.26 -5.16 105.19 105.42 2zjq n GLY 16 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.03 2zjq n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2zjq s ARG 17 N 4.39 0.02 -0.05 1.61 1.70 -1.26 -5.11 118.95 120.26 2zjq s ARG 17 Ca 0.00 0.04 -0.31 0.00 -0.47 0.00 0.00 55.73 54.99 2zjq s ARG 17 Cb 0.00 0.01 0.12 0.00 -0.57 0.00 0.00 34.95 34.51 2zjq s ARG 17 CO 0.00 -0.00 1.23 1.41 -1.08 0.00 0.00 175.30 176.85 2zjq s MET 18 N 0.92 0.46 0.21 3.89 1.75 -1.26 -5.21 119.30 120.06 2zjq s MET 18 Ca -0.07 -0.23 -0.21 0.00 -1.25 0.00 0.00 55.69 53.93 2zjq s MET 18 Cb -0.02 0.17 0.04 0.00 2.84 0.00 0.00 34.83 37.86 2zjq s MET 18 CO -0.10 -0.21 0.62 0.99 -0.65 0.00 0.00 175.02 175.67 2zjq s THR 19 N -2.52 0.01 0.00 10.11 2.01 -1.26 -5.14 115.64 118.85 2zjq s THR 19 Ca 0.12 -0.54 0.00 0.00 0.31 0.00 0.00 61.69 61.59 2zjq s THR 19 Cb 0.03 -1.48 0.00 0.00 0.01 0.00 0.00 72.50 71.05 2zjq s THR 19 CO -0.04 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.47 2zjq n GLY 20 N -0.40 2.24 1.87 4.40 0.00 -1.26 -5.18 105.19 106.86 2zjq n GLY 20 Ca -0.11 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 2zjq n GLY 20 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2zjq n ASP 21 N 0.00 -2.50 -4.25 1.61 5.75 -1.26 -4.89 116.55 111.01 2zjq n ASP 21 Ca 0.00 0.31 -0.38 0.00 -0.01 0.00 0.00 54.79 54.72 2zjq n ASP 21 Cb 0.00 -0.48 0.03 0.00 -1.03 0.00 0.00 41.12 39.64 2zjq n ASP 21 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2zjq n ALA 22 N -1.03 -3.20 0.04 2.12 0.00 -1.13 -4.91 120.51 112.41 2zjq n ALA 22 Ca 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2zjq n ALA 22 Cb 0.29 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2zjq n ALA 22 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2zjq n LYS 23 N 1.19 0.00 -2.20 0.00 4.81 -1.26 -4.94 118.16 115.76 2zjq n LYS 23 Ca 0.06 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.22 2zjq n LYS 23 Cb 0.50 -0.28 0.02 0.00 0.02 0.00 0.00 35.03 35.29 2zjq n LYS 23 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2zjq n GLY 24 N 2.46 6.05 3.00 3.14 0.00 -1.26 -4.92 105.19 113.68 2zjq n GLY 24 Ca 0.00 -2.67 -0.32 0.00 0.00 0.00 0.00 46.02 43.02 2zjq n GLY 24 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2zjq s GLY 25 N -3.14 2.68 0.00 -0.02 0.00 -1.26 -5.02 107.32 100.55 2zjq s GLY 25 Ca 0.50 -3.49 0.00 0.00 0.00 0.00 0.00 44.72 41.73 2zjq s GLY 25 CO -0.14 1.08 0.00 1.34 0.00 0.00 0.00 173.10 175.38 2zjq n ASP 26 N 2.83 0.00 0.00 1.64 -0.08 -1.26 -4.57 116.55 115.11 2zjq n ASP 26 Ca 0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 2zjq n ASP 26 Cb 0.35 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.81 2zjq n ASP 26 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2zjq n TYR 27 N 0.00 0.00 -1.68 -0.67 4.02 -1.26 -4.85 117.16 112.73 2zjq n TYR 27 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 2zjq n TYR 27 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.36 2zjq n TYR 27 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2zjq n VAL 28 N 0.00 3.47 0.00 -0.72 0.31 -1.26 -4.93 118.33 115.20 2zjq n VAL 28 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2zjq n VAL 28 Cb 0.00 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 2zjq n VAL 28 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2zjq n ALA 29 N -1.10 0.00 -0.61 3.52 0.00 -1.26 -4.96 120.51 116.09 2zjq n ALA 29 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2zjq n ALA 29 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2zjq n ALA 29 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2zjq n PHE 30 N -1.41 0.00 -3.50 0.00 3.72 -1.26 -4.73 117.46 110.29 2zjq n PHE 30 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2zjq n PHE 30 Cb 0.00 -1.44 0.00 0.00 -0.94 0.00 0.00 39.48 37.10 2zjq n PHE 30 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2zjq n GLY 31 N 0.49 -1.22 0.06 1.37 0.00 -1.26 -4.75 105.19 99.88 2zjq n GLY 31 Ca 0.00 -0.99 -0.07 0.00 0.00 0.00 0.00 46.02 44.95 2zjq n GLY 31 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2zjq n ASP 32 N 1.31 2.90 -4.70 1.61 9.92 -0.98 -4.98 116.55 121.63 2zjq n ASP 32 Ca 0.00 -0.05 -0.30 0.00 -0.53 0.00 0.00 54.79 53.91 2zjq n ASP 32 Cb 0.00 0.10 -0.08 0.00 -0.64 0.00 0.00 41.12 40.50 2zjq n ASP 32 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2zjq s TYR 33 N -2.24 3.02 0.15 1.24 2.02 -1.10 -4.33 117.35 116.11 2zjq s TYR 33 Ca -0.13 -0.00 -0.09 0.00 -0.37 0.00 0.00 57.07 56.47 2zjq s TYR 33 Cb 0.04 -1.56 -0.00 0.00 -0.40 0.00 0.00 41.96 40.04 2zjq s TYR 33 CO 0.32 0.48 0.28 0.20 -1.57 0.00 0.00 175.55 175.26 2zjq s GLY 34 N -2.28 0.34 -0.03 0.71 0.00 0.37 -0.05 107.32 106.38 2zjq s GLY 34 Ca 0.26 -0.77 0.07 0.00 0.00 0.00 0.00 44.72 44.28 2zjq s GLY 34 CO 0.18 -0.79 -0.25 -2.27 0.00 0.00 0.00 173.10 169.97 2zjq s LEU 35 N -2.93 2.09 -0.10 0.66 2.96 1.15 0.90 118.68 123.40 2zjq s LEU 35 Ca 0.14 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.61 2zjq s LEU 35 Cb 0.03 -1.36 0.01 0.00 0.50 0.00 0.00 46.19 45.38 2zjq s LEU 35 CO -0.03 0.31 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.51 2zjq s ILE 36 N -0.53 1.60 -0.25 6.68 1.01 0.36 -2.86 121.20 127.22 2zjq s ILE 36 Ca 0.08 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 2zjq s ILE 36 Cb -0.11 -1.44 -0.00 0.00 0.01 0.00 0.00 42.46 40.92 2zjq s ILE 36 CO -0.00 0.46 1.28 0.00 0.00 0.00 0.00 174.94 176.68 2zjq s ALA 37 N 0.80 3.49 -0.45 9.38 0.00 -0.60 -2.68 121.76 131.69 2zjq s ALA 37 Ca -0.10 0.23 0.04 0.00 0.00 0.00 0.00 51.96 52.13 2zjq s ALA 37 Cb -0.16 -3.71 0.55 0.00 0.00 0.00 0.00 23.12 19.81 2zjq s ALA 37 CO 0.01 -1.53 1.77 -1.33 0.00 0.00 0.00 175.76 174.68 2zjq n MET 38 N 7.02 2.38 -3.64 0.00 0.00 -0.94 0.58 117.12 122.52 2zjq n MET 38 Ca 0.14 -3.24 -0.07 0.00 0.00 0.00 0.00 57.70 54.53 2zjq n MET 38 Cb 0.46 -2.12 -0.07 0.00 0.00 0.00 0.00 33.22 31.49 2zjq n MET 38 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 2zjq s GLU 39 N -3.45 0.39 0.12 0.03 2.12 -1.26 -4.79 118.70 111.84 2zjq s GLU 39 Ca 0.55 0.48 -0.33 0.00 0.36 0.00 0.00 54.97 56.03 2zjq s GLU 39 Cb 0.46 0.18 -0.13 0.00 0.26 0.00 0.00 34.13 34.90 2zjq s GLU 39 CO 0.04 -0.05 1.67 -2.30 -0.54 0.00 0.00 175.26 174.08 2zjq n PRO 40 N 2.24 2.27 -3.71 4.30 -0.02 -1.26 -4.48 135.00 134.34 2zjq n PRO 40 Ca -0.13 0.82 -0.05 0.00 -2.02 0.00 0.00 63.50 62.13 2zjq n PRO 40 Cb 0.56 -2.63 0.02 0.00 -0.02 0.00 0.00 33.50 31.44 2zjq n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2zjq n ALA 41 N 4.28 -2.21 -3.97 3.55 0.00 -1.10 -5.01 120.51 116.06 2zjq n ALA 41 Ca 0.18 -1.07 -0.31 0.00 0.00 0.00 0.00 53.44 52.24 2zjq n ALA 41 Cb 0.30 0.72 -0.16 0.00 0.00 0.00 0.00 19.45 20.31 2zjq n ALA 41 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2zjq s TRP 42 N -2.37 2.51 -0.14 0.00 0.52 -1.26 -2.14 118.94 116.07 2zjq s TRP 42 Ca 0.19 -1.79 -0.26 0.00 0.02 0.00 0.00 56.10 54.26 2zjq s TRP 42 Cb -0.04 -1.64 -0.02 0.00 -1.15 0.00 0.00 33.47 30.63 2zjq s TRP 42 CO 0.08 -0.78 0.84 0.42 0.02 0.00 0.00 176.95 177.53 2zjq s ILE 43 N 1.36 4.89 0.05 2.03 -1.09 -1.24 -4.84 121.20 122.35 2zjq s ILE 43 Ca -0.05 1.68 -0.30 0.00 -2.23 0.00 0.00 60.65 59.75 2zjq s ILE 43 Cb -0.18 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.50 2zjq s ILE 43 CO -0.06 0.07 1.02 -0.54 -1.23 0.00 0.00 174.94 174.19 2zjq s LYS 44 N 1.86 4.57 0.27 2.79 3.01 -1.26 -0.39 119.74 130.59 2zjq s LYS 44 Ca 0.40 1.51 -0.04 0.00 -1.01 0.00 0.00 55.97 56.83 2zjq s LYS 44 Cb -0.17 -3.41 0.55 0.00 -1.01 0.00 0.00 37.83 33.79 2zjq s LYS 44 CO 0.15 -0.02 1.61 0.66 0.51 0.00 0.00 175.35 178.26 2zjq h SER 45 N 6.41 -0.40 0.67 2.83 4.64 -1.85 1.70 113.55 127.56 2zjq h SER 45 Ca -0.42 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2zjq h SER 45 Cb 1.22 0.40 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 2zjq h SER 45 CO 0.75 -0.24 0.00 -0.55 -0.87 0.00 0.00 176.83 175.92 2zjq h ASN 46 N 0.08 0.00 -0.02 4.97 7.08 -1.91 0.10 115.58 125.87 2zjq h ASN 46 Ca 0.48 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.70 2zjq h ASN 46 Cb 0.91 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.15 2zjq h ASN 46 CO -0.77 0.00 0.00 0.00 -2.08 0.00 0.00 177.43 174.58 2zjq n GLN 47 N -2.95 1.32 -0.13 4.14 6.02 0.58 -1.84 117.38 124.51 2zjq n GLN 47 Ca -0.00 -0.46 -0.26 0.00 -0.01 0.00 0.00 57.00 56.27 2zjq n GLN 47 Cb 0.22 -1.47 -0.10 0.00 1.02 0.00 0.00 30.24 29.91 2zjq n GLN 47 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2zjq n ILE 48 N -0.42 1.49 -0.15 5.09 5.41 -0.01 -3.84 119.36 126.93 2zjq n ILE 48 Ca 0.21 -0.44 -0.03 0.00 1.00 0.00 0.00 62.75 63.49 2zjq n ILE 48 Cb 0.22 -1.73 0.06 0.00 -0.71 0.00 0.00 39.64 37.48 2zjq n ILE 48 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2zjq h GLU 49 N -0.68 0.18 0.00 0.38 4.39 -1.47 2.15 114.58 119.53 2zjq h GLU 49 Ca -0.66 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.03 2zjq h GLU 49 Cb 1.69 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.30 2zjq h GLU 49 CO -0.32 0.12 0.23 0.00 -1.16 0.00 0.00 179.01 177.89 2zjq n ALA 50 N -2.55 0.58 -0.07 3.43 0.00 -0.77 -0.64 120.51 120.50 2zjq n ALA 50 Ca 0.05 0.03 -0.14 0.00 0.00 0.00 0.00 53.44 53.37 2zjq n ALA 50 Cb 0.24 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 2zjq n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zjq h ARG 52 N -0.55 -0.55 -0.29 0.00 1.12 0.17 -0.36 114.38 113.92 2zjq h ARG 52 Ca -0.32 0.04 0.08 0.00 -1.11 0.00 0.00 59.98 58.67 2zjq h ARG 52 Cb 1.19 0.12 -0.01 0.00 -0.01 0.00 0.00 29.97 31.26 2zjq h ARG 52 CO -0.19 -0.36 0.48 0.82 -3.11 0.00 0.00 179.97 177.61 2zjq h ILE 53 N -0.57 0.20 0.07 1.20 2.04 -1.10 0.36 117.51 119.71 2zjq h ILE 53 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2zjq h ILE 53 Cb 0.52 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 2zjq h ILE 53 CO -0.09 0.00 -0.03 0.58 0.00 0.00 0.00 178.15 178.60 2zjq h VAL 54 N 0.00 0.00 -0.89 1.67 2.07 -1.51 -3.12 116.25 114.47 2zjq h VAL 54 Ca 0.14 -0.51 0.23 0.00 0.82 0.00 0.00 66.70 67.38 2zjq h VAL 54 Cb 1.10 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.74 2zjq h VAL 54 CO -0.00 0.00 0.33 0.24 0.02 0.00 0.00 177.57 178.15 2zjq h MET 55 N -0.60 0.29 0.00 1.57 2.86 0.39 -1.86 114.93 117.58 2zjq h MET 55 Ca -0.01 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2zjq h MET 55 Cb 0.07 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2zjq h MET 55 CO 0.02 0.19 0.00 0.43 1.06 0.00 0.00 176.91 178.61 2zjq n SER 56 N -5.13 0.00 -0.07 1.22 7.64 0.11 -1.89 113.62 115.50 2zjq n SER 56 Ca 0.22 0.65 -0.02 0.00 1.01 0.00 0.00 58.87 60.73 2zjq n SER 56 Cb 0.68 -0.15 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2zjq n SER 56 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2zjq n ARG 57 N -1.38 -0.08 0.33 1.43 5.12 -0.72 0.32 116.66 121.68 2zjq n ARG 57 Ca 0.00 0.35 0.12 0.00 -1.93 0.00 0.00 57.85 56.39 2zjq n ARG 57 Cb 0.00 -0.52 0.66 0.00 -1.16 0.00 0.00 32.46 31.45 2zjq n ARG 57 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2zjq h HIS 58 N 0.00 0.00 -3.61 -1.55 2.76 -1.18 -3.31 115.15 108.26 2zjq h HIS 58 Ca 0.03 0.00 -0.69 0.00 -2.20 0.00 0.00 60.37 57.51 2zjq h HIS 58 Cb 0.07 0.00 -0.33 0.00 1.55 0.00 0.00 27.41 28.70 2zjq h HIS 58 CO -0.26 0.00 -0.61 -0.06 -1.30 0.00 0.00 177.93 175.70 2zjq s PHE 59 N -4.05 3.42 0.25 5.26 2.99 0.94 -4.96 117.98 121.83 2zjq s PHE 59 Ca -0.03 -2.04 -0.04 0.00 0.00 0.00 0.00 56.93 54.82 2zjq s PHE 59 Cb 0.07 -2.69 0.44 0.00 0.00 0.00 0.00 43.02 40.83 2zjq s PHE 59 CO 0.22 -0.87 1.78 0.00 -0.00 0.00 0.00 175.22 176.35 2zjq h ARG 60 N 8.07 0.64 0.00 0.44 -0.00 -1.76 -3.46 114.38 118.32 2zjq h ARG 60 Ca -0.18 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.26 2zjq h ARG 60 Cb 1.06 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.88 2zjq h ARG 60 CO 0.63 0.43 0.00 0.54 0.00 0.00 0.00 179.97 181.57 2zjq n ARG 61 N -4.83 0.00 0.00 0.04 1.74 -1.26 -4.97 116.66 107.38 2zjq n ARG 61 Ca 0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2zjq n ARG 61 Cb 0.34 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.78 2zjq n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zjq n GLY 62 N 0.00 2.46 4.86 -0.13 0.00 -1.26 -4.76 105.19 106.36 2zjq n GLY 62 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2zjq n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjq n GLY 63 N 0.00 0.35 1.66 -0.02 0.00 -1.26 -4.74 105.19 101.17 2zjq n GLY 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2zjq n GLY 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2zjq n LYS 64 N -0.00 0.00 -4.96 1.61 4.01 -1.26 -4.61 118.16 112.95 2zjq n LYS 64 Ca 0.00 0.00 -0.32 0.00 -0.51 0.00 0.00 58.31 57.48 2zjq n LYS 64 Cb 0.00 -0.39 -0.15 0.00 -0.51 0.00 0.00 35.03 33.98 2zjq n LYS 64 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2zjq s ILE 65 N 0.00 2.71 -0.04 -0.18 1.01 -1.26 -0.58 121.20 122.87 2zjq s ILE 65 Ca 0.00 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 59.91 2zjq s ILE 65 Cb 0.00 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 2zjq s ILE 65 CO 0.00 0.55 -0.23 -0.31 0.00 0.00 0.00 174.94 174.95 2zjq s TYR 66 N 0.08 2.17 -0.72 3.97 1.51 -1.20 -5.02 117.35 118.14 2zjq s TYR 66 Ca -0.07 -0.55 0.04 0.00 -1.01 0.00 0.00 57.07 55.47 2zjq s TYR 66 Cb -0.15 -1.42 0.17 0.00 -0.11 0.00 0.00 41.96 40.45 2zjq s TYR 66 CO 0.05 -0.14 0.51 0.42 -1.11 0.00 0.00 175.55 175.29 2zjq s ILE 67 N -0.28 3.05 -0.59 2.71 1.01 -1.26 -3.92 121.20 121.92 2zjq s ILE 67 Ca 0.01 -4.18 -0.04 0.00 0.00 0.00 0.00 60.65 56.43 2zjq s ILE 67 Cb -0.12 -2.99 0.04 0.00 0.01 0.00 0.00 42.46 39.40 2zjq s ILE 67 CO 0.02 -1.00 2.79 -2.11 0.00 0.00 0.00 174.94 174.63 2zjq n ARG 68 N 2.08 2.79 0.00 2.79 1.85 -1.17 -4.13 116.66 120.86 2zjq n ARG 68 Ca 0.19 -2.42 0.00 0.00 -1.00 0.00 0.00 57.85 54.62 2zjq n ARG 68 Cb 0.35 -2.23 0.00 0.00 -1.05 0.00 0.00 32.46 29.53 2zjq n ARG 68 CO 0.00 0.00 0.00 0.44 -0.01 0.00 0.00 177.63 178.06 2zjq n ILE 69 N 1.23 0.09 0.00 8.89 -5.35 -1.26 -4.83 119.36 118.13 2zjq n ILE 69 Ca 0.51 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.85 2zjq n ILE 69 Cb 0.53 1.39 0.00 0.00 -1.74 0.00 0.00 39.64 39.81 2zjq n ILE 69 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 2zjq n PHE 70 N -0.04 0.00 -2.53 4.28 7.35 -1.26 -4.77 117.46 120.49 2zjq n PHE 70 Ca 0.00 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.29 2zjq n PHE 70 Cb 0.32 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.12 2zjq n PHE 70 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 2zjq s PRO 71 N 0.00 3.43 -1.14 -7.13 0.02 -1.25 -4.79 135.00 124.14 2zjq s PRO 71 Ca 0.00 -0.84 -0.05 0.00 0.02 0.00 0.00 61.00 60.13 2zjq s PRO 71 Cb 0.00 -5.05 0.26 0.00 0.02 0.00 0.00 34.50 29.73 2zjq s PRO 71 CO 0.00 -2.26 1.76 -0.25 -0.33 0.00 0.00 177.00 175.92 2zjq n ASP 72 N 9.30 6.55 -3.65 2.53 8.00 -1.15 -4.44 116.55 133.69 2zjq n ASP 72 Ca 0.26 -3.38 -0.02 0.00 0.71 0.00 0.00 54.79 52.36 2zjq n ASP 72 Cb 0.50 -1.30 -0.07 0.00 -0.02 0.00 0.00 41.12 40.23 2zjq n ASP 72 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2zjq s LYS 73 N -2.26 0.24 -0.29 -1.24 2.20 -0.92 -4.92 119.74 112.54 2zjq s LYS 73 Ca 0.37 0.37 -0.07 0.00 -0.36 0.00 0.00 55.97 56.29 2zjq s LYS 73 Cb 0.11 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 2zjq s LYS 73 CO 0.01 -0.04 0.08 -1.25 -0.36 0.00 0.00 175.35 173.79 2zjq s PRO 74 N 0.91 3.19 0.21 4.03 0.04 -1.26 0.23 135.00 142.35 2zjq s PRO 74 Ca -0.05 -0.79 0.04 0.00 0.04 0.00 0.00 61.00 60.25 2zjq s PRO 74 Cb -0.04 -3.37 -0.03 0.00 0.04 0.00 0.00 34.50 31.11 2zjq s PRO 74 CO -0.12 -0.40 0.31 0.08 0.04 0.00 0.00 177.00 176.91 2zjq s VAL 75 N 1.52 5.19 0.35 -0.36 1.01 -0.82 -4.33 120.40 122.96 2zjq s VAL 75 Ca 0.03 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2zjq s VAL 75 Cb -0.17 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2zjq s VAL 75 CO 0.03 -0.24 0.08 0.35 0.00 0.00 0.00 175.10 175.31 2zjq n THR 76 N -1.06 0.00 -4.17 3.92 -2.24 -1.25 -3.48 114.28 106.00 2zjq n THR 76 Ca -0.08 -1.56 -0.17 0.00 -2.27 0.00 0.00 64.05 59.97 2zjq n THR 76 Cb 0.56 0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 2zjq n THR 76 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2zjq s LYS 77 N -3.31 1.85 -0.41 -0.78 2.47 -1.23 -4.88 119.74 113.45 2zjq s LYS 77 Ca 0.06 -1.87 -0.24 0.00 -1.56 0.00 0.00 55.97 52.36 2zjq s LYS 77 Cb -0.00 0.39 0.02 0.00 -1.46 0.00 0.00 37.83 36.78 2zjq s LYS 77 CO 0.04 -0.74 0.84 0.21 0.16 0.00 0.00 175.35 175.86 2zjq s LYS 78 N -3.20 3.61 0.00 4.03 2.20 -1.26 -4.14 119.74 120.98 2zjq s LYS 78 Ca 0.35 0.19 -0.04 0.00 -0.36 0.00 0.00 55.97 56.10 2zjq s LYS 78 Cb 0.01 -3.88 -0.20 0.00 -1.51 0.00 0.00 37.83 32.25 2zjq s LYS 78 CO 0.23 -1.04 2.96 -2.30 -0.36 0.00 0.00 175.35 174.85 2zjq n PRO 79 N 6.75 1.59 0.00 4.03 -0.02 -1.26 -4.61 135.00 141.47 2zjq n PRO 79 Ca 0.04 -0.73 0.00 0.00 -2.02 0.00 0.00 63.50 60.79 2zjq n PRO 79 Cb 0.48 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2zjq n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2zjq n ALA 80 N 2.43 0.00 0.00 3.55 0.00 -1.26 -4.85 120.51 120.38 2zjq n ALA 80 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2zjq n ALA 80 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.18 2zjq n ALA 80 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2zjq n GLU 81 N 0.00 0.00 0.00 0.00 0.00 -1.26 -5.14 120.64 114.24 2zjq n GLU 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2zjq n GLU 81 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2zjq n GLU 81 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2zjq n THR 82 N 0.00 0.00 0.00 3.84 -2.24 -1.26 -4.89 114.28 109.73 2zjq n THR 82 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2zjq n THR 82 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2zjq n THR 82 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2zjq n ARG 83 N 0.00 0.00 -3.12 -0.78 3.00 -1.26 -5.08 116.66 109.42 2zjq n ARG 83 Ca 0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 57.85 57.40 2zjq n ARG 83 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.45 2zjq n ARG 83 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 2zjq s MET 84 N 0.00 3.94 0.00 -0.14 -1.94 -1.26 -4.87 119.30 115.03 2zjq s MET 84 Ca 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 55.69 51.40 2zjq s MET 84 Cb 0.00 -4.78 0.00 0.00 2.01 0.00 0.00 34.83 32.06 2zjq s MET 84 CO 0.00 -1.53 0.00 0.41 -0.01 0.00 0.00 175.02 173.89 2zjq n GLY 85 N 3.95 0.65 0.00 -0.03 0.00 -1.26 -5.19 105.19 103.31 2zjq n GLY 85 Ca 0.26 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2zjq n GLY 85 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2zjq n LYS 86 N -0.44 3.42 -1.29 1.61 2.85 -1.26 -5.04 118.16 118.01 2zjq n LYS 86 Ca 0.00 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.86 2zjq n LYS 86 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2zjq n LYS 86 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2zjq n GLY 87 N 5.00 -2.86 3.38 2.58 0.00 -1.26 -4.98 105.19 107.05 2zjq n GLY 87 Ca 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 2zjq n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zjq s LYS 88 N -1.06 1.36 -1.19 1.61 1.02 -1.26 -5.01 119.74 115.21 2zjq s LYS 88 Ca 0.59 -1.45 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 2zjq s LYS 88 Cb -0.57 0.36 0.02 0.00 -0.52 0.00 0.00 37.83 37.13 2zjq s LYS 88 CO 0.64 -0.51 0.72 0.41 -0.92 0.00 0.00 175.35 175.70 2zjq n GLY 89 N -0.32 -0.89 0.31 -3.33 0.00 -1.26 -3.81 105.19 95.89 2zjq n GLY 89 Ca 0.00 0.38 0.19 0.00 0.00 0.00 0.00 46.02 46.60 2zjq n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zjq h ALA 90 N 1.31 1.12 -0.59 4.61 0.00 -1.89 -2.04 119.26 121.78 2zjq h ALA 90 Ca -0.70 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.00 2zjq h ALA 90 Cb 1.39 -0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.06 2zjq h ALA 90 CO 0.50 0.02 0.19 0.28 0.00 0.00 0.00 179.25 180.25 2zjq n VAL 91 N -3.28 2.76 0.24 0.00 0.31 -1.26 -4.61 118.33 112.50 2zjq n VAL 91 Ca -0.02 -1.95 -0.10 0.00 -0.01 0.00 0.00 64.34 62.26 2zjq n VAL 91 Cb 0.13 -0.34 -0.05 0.00 -0.91 0.00 0.00 33.84 32.68 2zjq n VAL 91 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2zjq h GLU 92 N 1.97 -0.60 -2.07 5.55 4.57 -1.40 -3.48 114.58 119.12 2zjq h GLU 92 Ca 0.25 0.04 0.16 0.00 -1.18 0.00 0.00 59.36 58.63 2zjq h GLU 92 Cb 2.08 0.14 -0.15 0.00 -0.16 0.00 0.00 28.75 30.66 2zjq h GLU 92 CO 0.61 -0.40 0.58 1.52 -1.18 0.00 0.00 179.01 180.14 2zjq s TYR 93 N -4.22 -0.26 -0.14 0.92 -0.00 -1.23 -5.06 117.35 107.36 2zjq s TYR 93 Ca -0.09 0.13 -0.08 0.00 -0.00 0.00 0.00 57.07 57.03 2zjq s TYR 93 Cb 0.01 0.55 -0.04 0.00 -0.00 0.00 0.00 41.96 42.47 2zjq s TYR 93 CO 0.27 -0.49 0.13 -1.58 -0.00 0.00 0.00 175.55 173.89 2zjq s TRP 94 N -2.95 3.54 0.25 -3.49 0.51 -1.26 -1.94 118.94 113.59 2zjq s TRP 94 Ca 0.07 0.47 0.12 0.00 -2.12 0.00 0.00 56.10 54.64 2zjq s TRP 94 Cb -0.01 -1.99 -0.05 0.00 -0.81 0.00 0.00 33.47 30.61 2zjq s TRP 94 CO -0.07 0.62 -0.21 0.08 -0.51 0.00 0.00 176.95 176.87 2zjq s VAL 95 N -0.68 2.39 -0.53 4.03 1.01 0.14 -2.47 120.40 124.29 2zjq s VAL 95 Ca 0.13 -2.28 0.07 0.00 0.00 0.00 0.00 61.98 59.90 2zjq s VAL 95 Cb -0.12 -2.23 0.28 0.00 0.00 0.00 0.00 36.38 34.31 2zjq s VAL 95 CO 0.02 -0.32 0.72 -0.24 0.00 0.00 0.00 175.10 175.28 2zjq n SER 96 N -0.33 2.57 -2.64 3.32 2.88 0.48 -2.17 113.62 117.72 2zjq n SER 96 Ca -0.08 -3.23 -0.38 0.00 -1.33 0.00 0.00 58.87 53.86 2zjq n SER 96 Cb 0.59 -0.64 -0.07 0.00 -0.75 0.00 0.00 64.21 63.35 2zjq n SER 96 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2zjq n VAL 97 N 0.73 0.00 -4.41 2.46 0.24 -1.26 -3.67 118.33 112.42 2zjq n VAL 97 Ca 0.27 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.24 2zjq n VAL 97 Cb 0.47 -0.30 -0.16 0.00 -1.47 0.00 0.00 33.84 32.38 2zjq n VAL 97 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2zjq s VAL 98 N 2.77 2.08 0.27 3.34 1.01 -0.91 -4.92 120.40 124.04 2zjq s VAL 98 Ca 0.67 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2zjq s VAL 98 Cb -0.89 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 2zjq s VAL 98 CO 0.43 0.54 0.42 -0.75 0.00 0.00 0.00 175.10 175.75 2zjq s LYS 99 N 1.04 3.47 0.76 2.72 2.47 -1.26 -2.70 119.74 126.24 2zjq s LYS 99 Ca -0.01 -0.56 -0.16 0.00 -1.56 0.00 0.00 55.97 53.68 2zjq s LYS 99 Cb -0.14 -2.81 -0.06 0.00 -1.46 0.00 0.00 37.83 33.36 2zjq s LYS 99 CO -0.07 0.34 0.24 -2.30 0.16 0.00 0.00 175.35 173.72 2zjq n PRO 100 N -1.40 0.14 0.00 4.03 -0.02 -1.25 -2.14 135.00 134.36 2zjq n PRO 100 Ca -0.07 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2zjq n PRO 100 Cb 0.56 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 2zjq n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zjq n GLY 101 N 1.99 2.08 3.32 -1.23 0.00 0.20 -2.86 105.19 108.69 2zjq n GLY 101 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2zjq n GLY 101 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2zjq n ARG 102 N -0.93 -0.98 -3.89 1.61 3.00 -0.91 -4.67 116.66 109.88 2zjq n ARG 102 Ca 0.00 -0.26 -0.29 0.00 -0.00 0.00 0.00 57.85 57.30 2zjq n ARG 102 Cb 0.00 -1.74 -0.16 0.00 0.00 0.00 0.00 32.46 30.56 2zjq n ARG 102 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2zjq s VAL 103 N -2.29 1.17 -0.16 5.15 1.01 -1.26 -1.56 120.40 122.46 2zjq s VAL 103 Ca 0.56 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.87 2zjq s VAL 103 Cb -0.15 -1.38 -0.23 0.00 0.00 0.00 0.00 36.38 34.61 2zjq s VAL 103 CO 0.67 0.07 0.21 0.23 0.00 0.00 0.00 175.10 176.28 2zjq n MET 104 N 4.84 0.68 -4.29 2.72 0.00 -1.13 -4.57 117.12 115.37 2zjq n MET 104 Ca -0.12 0.16 -0.16 0.00 0.00 0.00 0.00 57.70 57.58 2zjq n MET 104 Cb 0.47 -1.63 -0.10 0.00 0.00 0.00 0.00 33.22 31.96 2zjq n MET 104 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2zjq s PHE 105 N -2.54 1.42 0.00 2.03 0.08 -1.17 -3.06 117.98 114.74 2zjq s PHE 105 Ca -0.17 -0.74 0.00 0.00 0.12 0.00 0.00 56.93 56.15 2zjq s PHE 105 Cb 0.07 -0.72 0.00 0.00 -0.57 0.00 0.00 43.02 41.80 2zjq s PHE 105 CO 0.76 0.13 0.00 -0.85 -0.10 0.00 0.00 175.22 175.17 2zjq n GLU 106 N -0.28 0.00 -0.16 0.44 0.00 -1.25 0.36 120.64 119.76 2zjq n GLU 106 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.07 2zjq n GLU 106 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.05 2zjq n GLU 106 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2zjq n VAL 107 N 0.00 0.00 -3.64 3.84 0.24 0.92 -3.27 118.33 116.41 2zjq n VAL 107 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.27 2zjq n VAL 107 Cb 0.00 -1.83 -0.07 0.00 -1.47 0.00 0.00 33.84 30.47 2zjq n VAL 107 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2zjq s ALA 108 N -3.66 -2.20 0.00 2.33 0.00 0.26 -2.31 121.76 116.17 2zjq s ALA 108 Ca 0.00 2.21 0.00 0.00 0.00 0.00 0.00 51.96 54.17 2zjq s ALA 108 Cb 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2zjq s ALA 108 CO 0.00 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.83 2zjq n GLY 109 N 3.66 3.08 3.80 0.00 0.00 -1.26 -4.60 105.19 109.86 2zjq n GLY 109 Ca -0.18 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 2zjq n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2zjq s VAL 110 N -0.32 3.68 0.48 1.61 -7.23 -1.26 -5.00 120.40 112.37 2zjq s VAL 110 Ca 0.00 0.87 -0.24 0.00 -1.81 0.00 0.00 61.98 60.80 2zjq s VAL 110 Cb 0.00 -3.36 -0.07 0.00 0.56 0.00 0.00 36.38 33.51 2zjq s VAL 110 CO 0.00 -0.40 1.33 0.42 -0.31 0.00 0.00 175.10 176.14 2zjq s THR 111 N -2.28 2.35 0.00 5.32 -4.23 -1.26 -4.72 115.64 110.82 2zjq s THR 111 Ca 0.66 0.29 0.00 0.00 -1.18 0.00 0.00 61.69 61.45 2zjq s THR 111 Cb -0.17 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.51 2zjq s THR 111 CO 0.33 0.02 0.17 1.21 -0.54 0.00 0.00 174.62 175.81 2zjq n GLU 112 N -0.50 0.00 -0.26 3.99 4.07 -1.26 0.15 120.64 126.83 2zjq n GLU 112 Ca 0.07 0.17 0.04 0.00 -0.06 0.00 0.00 57.16 57.39 2zjq n GLU 112 Cb 0.44 -0.32 0.18 0.00 -0.06 0.00 0.00 31.44 31.68 2zjq n GLU 112 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 2zjq h GLU 113 N 0.00 0.53 0.00 5.31 4.57 -1.91 1.20 114.58 124.29 2zjq h GLU 113 Ca 0.00 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2zjq h GLU 113 Cb 0.00 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.47 2zjq h GLU 113 CO 0.00 0.35 0.00 1.04 -1.18 0.00 0.00 179.01 179.22 2zjq n GLN 114 N -4.92 0.00 0.00 1.92 1.13 0.41 0.53 117.38 116.45 2zjq n GLN 114 Ca 0.14 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.20 2zjq n GLN 114 Cb 0.37 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.29 2zjq n GLN 114 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2zjq n ALA 115 N -0.90 1.53 -1.55 -1.58 0.00 0.36 -4.56 120.51 113.81 2zjq n ALA 115 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 2zjq n ALA 115 Cb 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 2zjq n ALA 115 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2zjq n LYS 116 N -1.25 3.56 0.00 0.00 4.76 0.19 -3.04 118.16 122.38 2zjq n LYS 116 Ca 0.00 -2.52 0.00 0.00 -2.87 0.00 0.00 58.31 52.92 2zjq n LYS 116 Cb 0.13 -2.50 0.00 0.00 -1.84 0.00 0.00 35.03 30.82 2zjq n LYS 116 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2zjq n GLU 117 N 2.24 0.00 0.24 1.97 4.07 -1.23 -4.72 120.64 123.20 2zjq n GLU 117 Ca 0.62 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.89 2zjq n GLU 117 Cb 0.40 0.00 0.87 0.00 -0.06 0.00 0.00 31.44 32.65 2zjq n GLU 117 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2zjq h ALA 118 N 0.00 1.68 0.00 4.31 0.00 -1.78 0.34 119.26 123.81 2zjq h ALA 118 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2zjq h ALA 118 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2zjq h ALA 118 CO 0.00 -0.23 -1.11 1.19 0.00 0.00 0.00 179.25 179.11 2zjq n PHE 119 N -3.72 0.74 -0.18 0.00 0.99 -1.17 -3.51 117.46 110.62 2zjq n PHE 119 Ca 0.00 0.32 -0.05 0.00 -0.00 0.00 0.00 57.45 57.73 2zjq n PHE 119 Cb 0.27 -0.89 -0.04 0.00 -1.00 0.00 0.00 39.48 37.81 2zjq n PHE 119 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2zjq n ARG 120 N -4.48 -0.19 0.00 -1.08 0.63 -0.64 0.13 116.66 111.03 2zjq n ARG 120 Ca -0.23 1.07 0.00 0.00 -0.92 0.00 0.00 57.85 57.77 2zjq n ARG 120 Cb 0.53 -1.58 0.00 0.00 0.45 0.00 0.00 32.46 31.85 2zjq n ARG 120 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2zjq n LEU 121 N -3.98 0.00 -0.21 6.15 4.77 0.11 -1.34 117.00 122.49 2zjq n LEU 121 Ca 0.01 0.74 0.08 0.00 -0.03 0.00 0.00 56.01 56.82 2zjq n LEU 121 Cb 0.11 -0.24 0.17 0.00 -2.33 0.00 0.00 43.42 41.13 2zjq n LEU 121 CO -0.07 -0.24 0.47 0.00 -1.33 0.00 0.00 177.39 176.22 2zjq n ALA 122 N -1.73 0.29 -0.19 -1.18 0.00 0.45 0.31 120.51 118.46 2zjq n ALA 122 Ca 0.00 0.65 -0.01 0.00 0.00 0.00 0.00 53.44 54.07 2zjq n ALA 122 Cb 0.00 -0.46 0.05 0.00 0.00 0.00 0.00 19.45 19.04 2zjq n ALA 122 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2zjq h GLY 123 N 0.00 0.43 1.13 0.00 0.00 0.24 0.95 103.07 105.82 2zjq h GLY 123 Ca 0.36 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.87 2zjq h GLY 123 CO -0.57 -0.22 0.24 1.42 0.00 0.00 0.00 176.54 177.41 2zjq n HIS 124 N -5.39 0.10 -0.02 5.60 -0.00 0.93 0.13 115.22 116.58 2zjq n HIS 124 Ca 0.06 0.05 0.04 0.00 -0.00 0.00 0.00 57.72 57.88 2zjq n HIS 124 Cb 0.30 -0.37 0.09 0.00 -0.00 0.00 0.00 29.99 30.01 2zjq n HIS 124 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2zjq n LYS 125 N -1.47 2.24 -3.80 -0.41 0.00 0.32 -5.01 118.16 110.04 2zjq n LYS 125 Ca -0.00 -1.67 -0.30 0.00 -0.00 0.00 0.00 58.31 56.33 2zjq n LYS 125 Cb 0.25 -1.18 -0.04 0.00 -0.00 0.00 0.00 35.03 34.06 2zjq n LYS 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2zjq s LEU 126 N -0.92 4.30 0.28 -5.58 1.43 0.12 -4.93 118.68 113.39 2zjq s LEU 126 Ca 0.15 0.39 0.26 0.00 -1.03 0.00 0.00 54.13 53.90 2zjq s LEU 126 Cb 0.08 -3.11 0.84 0.00 0.03 0.00 0.00 46.19 44.03 2zjq s LEU 126 CO 0.11 0.08 1.75 -0.65 0.23 0.00 0.00 176.35 177.88 2zjq h PRO 127 N 2.73 0.00 -5.98 1.29 0.11 -1.93 -3.47 132.00 124.76 2zjq h PRO 127 Ca -0.46 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.10 2zjq h PRO 127 Cb 1.17 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 2zjq h PRO 127 CO 0.73 0.00 -0.43 0.96 -0.21 0.00 0.00 178.00 179.05 2zjq s ILE 128 N -3.23 2.30 -0.22 4.15 -5.25 -1.26 -5.11 121.20 112.59 2zjq s ILE 128 Ca 0.08 -1.56 -0.15 0.00 -0.99 0.00 0.00 60.65 58.03 2zjq s ILE 128 Cb 0.10 -2.86 -0.04 0.00 2.95 0.00 0.00 42.46 42.61 2zjq s ILE 128 CO 0.54 0.00 0.34 -1.10 -1.79 0.00 0.00 174.94 172.94 2zjq s GLN 129 N -4.03 4.12 0.00 0.37 -0.21 -1.26 -4.99 119.66 113.66 2zjq s GLN 129 Ca 0.42 0.07 0.00 0.00 0.02 0.00 0.00 55.36 55.87 2zjq s GLN 129 Cb 0.01 -3.56 0.00 0.00 1.00 0.00 0.00 33.01 30.46 2zjq s GLN 129 CO 0.24 -0.07 0.00 0.25 -2.12 0.00 0.00 175.29 173.59 2zjq n THR 130 N 4.49 0.00 -3.58 -0.19 -2.24 -1.26 -2.22 114.28 109.28 2zjq n THR 130 Ca -0.10 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.60 2zjq n THR 130 Cb 0.51 -0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.57 2zjq n THR 130 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2zjq s LYS 131 N -0.23 0.53 0.21 -0.78 -2.85 -1.09 -4.93 119.74 110.60 2zjq s LYS 131 Ca 0.00 0.03 -0.08 0.00 -1.00 0.00 0.00 55.97 54.92 2zjq s LYS 131 Cb 0.00 0.25 -0.07 0.00 -2.06 0.00 0.00 37.83 35.95 2zjq s LYS 131 CO 0.00 -0.19 0.50 1.41 0.10 0.00 0.00 175.35 177.18 2zjq s MET 132 N -1.57 3.74 0.05 1.78 -2.45 -1.26 -0.48 119.30 119.10 2zjq s MET 132 Ca 0.02 0.15 0.01 0.00 -1.25 0.00 0.00 55.69 54.62 2zjq s MET 132 Cb -0.01 -2.70 -0.03 0.00 1.25 0.00 0.00 34.83 33.34 2zjq s MET 132 CO -0.02 0.35 -0.06 0.14 1.05 0.00 0.00 175.02 176.49 2zjq s VAL 133 N -1.79 0.40 -0.00 10.11 -7.23 0.26 -4.95 120.40 117.20 2zjq s VAL 133 Ca 0.45 -1.31 -0.01 0.00 -1.81 0.00 0.00 61.98 59.31 2zjq s VAL 133 Cb -0.11 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 35.97 2zjq s VAL 133 CO 0.23 -0.60 -0.01 2.29 -0.31 0.00 0.00 175.10 176.69 2zjq n LYS 134 N 1.01 0.02 0.00 4.82 2.85 -1.26 0.14 118.16 125.73 2zjq n LYS 134 Ca -0.20 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.07 2zjq n LYS 134 Cb 0.57 -0.25 0.00 0.00 -0.65 0.00 0.00 35.03 34.70 2zjq n LYS 134 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2zjq n ARG 135 N -2.62 0.00 -0.88 -1.58 1.74 -1.26 -4.46 116.66 107.60 2zjq n ARG 135 Ca -0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2zjq n ARG 135 Cb 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.46 2zjq n ARG 135 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2zjq n GLU 136 N 0.00 -1.02 -2.75 5.56 4.07 -1.26 -4.86 120.64 120.37 2zjq n GLU 136 Ca 0.00 0.26 -0.43 0.00 -0.06 0.00 0.00 57.16 56.93 2zjq n GLU 136 Cb 0.00 -4.33 -0.04 0.00 -0.06 0.00 0.00 31.44 27.01 2zjq n GLU 136 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2zjq s VAL 137 N -1.41 4.33 -0.43 6.31 1.01 -1.26 -4.91 120.40 124.04 2zjq s VAL 137 Ca 0.00 0.70 0.08 0.00 0.00 0.00 0.00 61.98 62.77 2zjq s VAL 137 Cb 0.00 -4.54 0.32 0.00 0.00 0.00 0.00 36.38 32.15 2zjq s VAL 137 CO 0.00 -1.03 0.91 -1.22 0.00 0.00 0.00 175.10 173.75 2zjq n TYR 138 N 7.58 -1.65 0.00 5.22 4.01 -1.26 -4.73 117.16 126.33 2zjq n TYR 138 Ca 0.06 -2.80 0.00 0.00 -0.16 0.00 0.00 57.90 55.00 2zjq n TYR 138 Cb 0.48 0.75 0.00 0.00 -0.31 0.00 0.00 39.34 40.26 2zjq n TYR 138 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2zjq n ASP 139 N 0.56 0.00 -4.90 7.72 10.43 -1.26 -5.00 116.55 124.11 2zjq n ASP 139 Ca 0.14 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 57.18 2zjq n ASP 139 Cb 0.66 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.58 2zjq n ASP 139 CO 0.00 0.00 0.00 -1.83 -1.07 0.00 0.00 177.20 174.30 2zjq s GLU 140 N 0.38 3.62 0.00 -1.24 -1.05 -1.26 -5.29 118.70 113.87 2zjq s GLU 140 Ca 0.00 -0.08 0.00 0.00 -0.15 0.00 0.00 54.97 54.74 2zjq s GLU 140 Cb 0.00 -2.88 0.00 0.00 -0.44 0.00 0.00 34.13 30.81 2zjq s GLU 140 CO 0.00 0.49 0.00 0.00 0.95 0.00 0.00 175.26 176.70