#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jaz s LEU 3 N 0.00 3.29 0.00 -1.84 1.43 -1.26 -4.96 118.68 115.34 2jaz s LEU 3 Ca 0.00 -0.83 -0.16 0.00 -1.03 0.00 0.00 54.13 52.10 2jaz s LEU 3 Cb 0.00 -2.56 0.25 0.00 0.03 0.00 0.00 46.19 43.91 2jaz s LEU 3 CO 0.00 -2.26 0.80 0.29 0.23 0.00 0.00 176.35 175.41 2jaz n LYS 4 N 8.92 -3.00 -0.03 1.70 4.76 -1.26 -5.00 118.16 124.26 2jaz n LYS 4 Ca 0.34 -1.29 0.06 0.00 -2.87 0.00 0.00 58.31 54.56 2jaz n LYS 4 Cb 0.49 -1.30 -0.15 0.00 -1.84 0.00 0.00 35.03 32.23 2jaz n LYS 4 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2jaz n ASN 5 N -4.60 0.40 -4.00 4.39 3.02 -1.26 -5.02 115.26 108.19 2jaz n ASN 5 Ca 0.11 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.57 2jaz n ASN 5 Cb 0.45 1.73 -0.08 0.00 -0.61 0.00 0.00 39.78 41.27 2jaz n ASN 5 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2jaz s SER 6 N -4.52 0.15 0.41 6.41 1.04 -1.26 -4.68 113.70 111.26 2jaz s SER 6 Ca -0.08 -0.93 0.09 0.00 0.48 0.00 0.00 55.95 55.51 2jaz s SER 6 Cb 0.11 0.37 0.90 0.00 0.10 0.00 0.00 66.02 67.50 2jaz s SER 6 CO 0.82 -0.81 2.02 0.40 0.98 0.00 0.00 173.24 176.65 2jaz h ILE 7 N 2.70 1.02 0.00 -1.02 1.08 -1.91 -1.80 117.51 117.58 2jaz h ILE 7 Ca -0.33 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 2jaz h ILE 7 Cb 1.21 0.43 0.00 0.00 -3.07 0.00 0.00 36.82 35.39 2jaz h ILE 7 CO 0.53 0.10 0.00 -1.54 -0.69 0.00 0.00 178.15 176.55 2jaz n SER 8 N -4.47 0.55 0.00 1.72 3.41 -1.24 -1.16 113.62 112.43 2jaz n SER 8 Ca 0.07 0.71 0.11 0.00 -0.26 0.00 0.00 58.87 59.50 2jaz n SER 8 Cb 0.19 -0.80 0.13 0.00 -0.26 0.00 0.00 64.21 63.46 2jaz n SER 8 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2jaz n ASP 9 N -2.20 0.65 -4.59 4.04 8.00 -0.68 -3.72 116.55 118.06 2jaz n ASP 9 Ca -0.00 -0.43 -0.34 0.00 0.71 0.00 0.00 54.79 54.72 2jaz n ASP 9 Cb 0.10 0.51 -0.11 0.00 -0.02 0.00 0.00 41.12 41.60 2jaz n ASP 9 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2jaz s TYR 10 N -3.03 3.18 0.69 1.24 2.02 -0.31 -4.86 117.35 116.28 2jaz s TYR 10 Ca 0.09 -0.06 -0.10 0.00 -0.37 0.00 0.00 57.07 56.63 2jaz s TYR 10 Cb 0.17 -2.06 0.02 0.00 -0.40 0.00 0.00 41.96 39.69 2jaz s TYR 10 CO 0.76 0.07 1.06 0.95 -1.57 0.00 0.00 175.55 176.82 2jaz s THR 11 N 0.46 3.36 0.22 -0.71 -4.23 -1.26 -0.67 115.64 112.80 2jaz s THR 11 Ca 0.01 0.32 -0.08 0.00 -1.18 0.00 0.00 61.69 60.76 2jaz s THR 11 Cb -0.13 -3.42 0.16 0.00 1.34 0.00 0.00 72.50 70.46 2jaz s THR 11 CO 0.01 -0.52 1.77 -0.33 -0.54 0.00 0.00 174.62 175.01 2jaz h GLU 12 N -0.59 0.54 -0.71 3.99 5.08 -1.93 -1.55 114.58 119.41 2jaz h GLU 12 Ca -0.45 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2jaz h GLU 12 Cb 1.26 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 2jaz h GLU 12 CO 0.63 0.36 0.45 0.00 -1.00 0.00 0.00 179.01 179.46 2jaz h ALA 13 N 1.41 0.90 -0.48 3.43 0.00 -1.96 -1.72 119.26 120.85 2jaz h ALA 13 Ca 0.33 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 2jaz h ALA 13 Cb 0.35 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2jaz h ALA 13 CO -0.27 0.35 0.10 0.93 0.00 0.00 0.00 179.25 180.37 2jaz h GLU 14 N 0.97 0.72 -0.45 0.00 5.08 -1.73 -1.78 114.58 117.40 2jaz h GLU 14 Ca 0.26 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 2jaz h GLU 14 Cb -0.08 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 2jaz h GLU 14 CO -0.05 0.67 -0.17 0.35 -1.00 0.00 0.00 179.01 178.80 2jaz h PHE 15 N 0.70 0.96 -0.83 4.33 3.57 -0.67 -1.86 116.94 123.14 2jaz h PHE 15 Ca 0.16 -0.21 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 2jaz h PHE 15 Cb 0.28 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 2jaz h PHE 15 CO 0.01 0.96 0.49 0.28 -2.23 0.00 0.00 178.31 177.82 2jaz h VAL 16 N 0.76 1.23 -0.55 1.41 2.07 -0.78 -0.70 116.25 119.69 2jaz h VAL 16 Ca 0.11 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 2jaz h VAL 16 Cb 0.69 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2jaz h VAL 16 CO 0.05 0.24 0.14 1.56 0.02 0.00 0.00 177.57 179.59 2jaz h GLN 17 N 1.14 0.84 -0.33 1.57 4.20 -0.77 -0.55 115.11 121.20 2jaz h GLN 17 Ca 0.30 -0.17 -0.09 0.00 0.06 0.00 0.00 58.65 58.75 2jaz h GLN 17 Cb -0.04 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 2jaz h GLN 17 CO -0.05 0.75 -0.17 1.25 -0.67 0.00 0.00 178.83 179.93 2jaz h LEU 18 N 0.81 0.60 -0.75 1.46 5.85 -0.46 -2.08 115.31 120.73 2jaz h LEU 18 Ca 0.18 -0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 2jaz h LEU 18 Cb 0.28 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2jaz h LEU 18 CO -0.00 0.78 -0.36 -0.07 -0.34 0.00 0.00 178.44 178.45 2jaz h LEU 19 N 0.54 0.55 -0.79 2.25 3.38 -0.28 -2.37 115.31 118.59 2jaz h LEU 19 Ca 0.09 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 2jaz h LEU 19 Cb 0.61 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2jaz h LEU 19 CO 0.04 0.86 -0.35 0.11 0.09 0.00 0.00 178.44 179.20 2jaz h LYS 20 N 0.44 0.00 -0.29 1.13 1.79 -0.85 -0.14 116.57 118.66 2jaz h LYS 20 Ca 0.05 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.33 2jaz h LYS 20 Cb 0.84 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.49 2jaz h LYS 20 CO 0.07 0.35 -0.54 1.49 -1.08 0.00 0.00 179.45 179.74 2jaz h GLU 21 N 0.00 0.85 -0.53 3.15 4.57 -1.16 -1.17 114.58 120.29 2jaz h GLU 21 Ca -0.00 -0.53 -0.11 0.00 -1.18 0.00 0.00 59.36 57.53 2jaz h GLU 21 Cb 0.95 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.59 2jaz h GLU 21 CO 0.05 1.17 -0.11 0.82 -1.18 0.00 0.00 179.01 179.75 2jaz h ILE 22 N 0.65 1.27 -0.73 2.32 2.04 -1.06 -1.42 117.51 120.58 2jaz h ILE 22 Ca 0.02 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.60 2jaz h ILE 22 Cb 1.14 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 2jaz h ILE 22 CO 0.12 0.44 0.39 -0.33 0.00 0.00 0.00 178.15 178.78 2jaz h GLU 23 N 0.89 1.01 -0.27 2.37 5.08 -0.74 -0.43 114.58 122.49 2jaz h GLU 23 Ca 0.14 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2jaz h GLU 23 Cb 0.67 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2jaz h GLU 23 CO 0.05 0.74 0.02 -0.22 -1.00 0.00 0.00 179.01 178.60 2jaz h LYS 24 N 1.01 0.45 0.00 2.33 3.64 -0.82 -2.90 116.57 120.29 2jaz h LYS 24 Ca 0.26 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2jaz h LYS 24 Cb 0.03 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2jaz h LYS 24 CO -0.04 0.59 -0.19 0.93 -2.27 0.00 0.00 179.45 178.47 2jaz h GLU 25 N 0.25 0.00 -0.77 1.90 4.39 -0.87 -2.38 114.58 117.11 2jaz h GLU 25 Ca 0.08 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.86 2jaz h GLU 25 Cb 0.37 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 2jaz h GLU 25 CO 0.01 0.19 0.50 -0.91 -1.16 0.00 0.00 179.01 177.64 2jaz h ASN 26 N 0.00 0.66 -0.54 1.42 -0.26 -0.87 -1.92 115.58 114.06 2jaz h ASN 26 Ca -0.00 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2jaz h ASN 26 Cb 0.49 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.63 2jaz h ASN 26 CO 0.02 0.40 0.00 1.33 -1.06 0.00 0.00 177.43 178.13 2jaz n VAL 27 N -4.50 0.71 -1.56 2.81 0.24 -0.90 -4.95 118.33 110.18 2jaz n VAL 27 Ca 0.12 -0.82 -0.31 0.00 -2.04 0.00 0.00 64.34 61.30 2jaz n VAL 27 Cb 0.29 0.66 0.05 0.00 -1.47 0.00 0.00 33.84 33.38 2jaz n VAL 27 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jaz s ALA 28 N -1.29 2.65 0.27 2.33 0.00 -0.72 -4.94 121.76 120.06 2jaz s ALA 28 Ca 0.42 0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.46 2jaz s ALA 28 Cb 0.23 -3.17 0.61 0.00 0.00 0.00 0.00 23.12 20.79 2jaz s ALA 28 CO 0.31 -1.26 1.69 0.00 0.00 0.00 0.00 175.76 176.50 2jaz h ALA 29 N -0.75 1.23 -1.32 0.00 0.00 -1.93 -3.43 119.26 113.06 2jaz h ALA 29 Ca -0.44 0.16 -0.59 0.00 0.00 0.00 0.00 54.91 54.05 2jaz h ALA 29 Cb 1.21 0.18 -0.13 0.00 0.00 0.00 0.00 17.79 19.05 2jaz h ALA 29 CO 0.57 -0.33 -0.53 0.95 0.00 0.00 0.00 179.25 179.91 2jaz s THR 30 N -5.96 0.92 -1.10 0.00 -4.23 -1.26 -5.06 115.64 98.95 2jaz s THR 30 Ca -0.12 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.56 2jaz s THR 30 Cb 0.23 -2.39 0.56 0.00 1.34 0.00 0.00 72.50 72.24 2jaz s THR 30 CO 0.77 0.00 1.48 0.47 -0.54 0.00 0.00 174.62 176.80 2jaz n ASP 31 N -1.19 3.95 0.05 3.99 8.00 -1.26 -4.71 116.55 125.38 2jaz n ASP 31 Ca -0.09 -2.31 -0.11 0.00 0.71 0.00 0.00 54.79 52.99 2jaz n ASP 31 Cb 0.66 -0.45 -0.05 0.00 -0.02 0.00 0.00 41.12 41.26 2jaz n ASP 31 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2jaz h ASP 32 N 3.21 -0.88 -0.11 -2.24 3.45 -1.97 -0.68 116.42 117.20 2jaz h ASP 32 Ca 0.00 0.12 -0.17 0.00 0.43 0.00 0.00 57.03 57.41 2jaz h ASP 32 Cb 1.15 0.36 0.01 0.00 -0.56 0.00 0.00 39.33 40.29 2jaz h ASP 32 CO 0.12 -0.35 -0.58 0.58 -1.57 0.00 0.00 179.24 177.43 2jaz h VAL 33 N -0.43 1.35 -0.44 -1.35 2.07 -1.96 -3.30 116.25 112.19 2jaz h VAL 33 Ca 0.07 -1.88 0.09 0.00 0.82 0.00 0.00 66.70 65.80 2jaz h VAL 33 Cb 0.52 2.17 -0.08 0.00 -1.52 0.00 0.00 31.29 32.38 2jaz h VAL 33 CO -0.27 0.57 -0.10 0.25 0.02 0.00 0.00 177.57 178.05 2jaz h LEU 34 N 0.21 -0.38 -2.06 2.57 5.85 -1.80 -1.76 115.31 117.93 2jaz h LEU 34 Ca -0.04 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 2jaz h LEU 34 Cb 1.23 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.52 2jaz h LEU 34 CO 0.12 -0.14 -0.09 0.44 -0.34 0.00 0.00 178.44 178.44 2jaz h ASP 35 N 0.01 0.00 0.06 1.25 5.19 -1.22 0.15 116.42 121.85 2jaz h ASP 35 Ca 0.21 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.39 2jaz h ASP 35 Cb 0.32 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.85 2jaz h ASP 35 CO -0.44 0.09 -0.93 0.58 -3.12 0.00 0.00 179.24 175.41 2jaz h VAL 36 N 0.00 1.36 -0.45 -1.35 2.07 -1.42 -1.86 116.25 114.60 2jaz h VAL 36 Ca -0.00 -2.29 -0.07 0.00 0.82 0.00 0.00 66.70 65.15 2jaz h VAL 36 Cb 0.24 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.66 2jaz h VAL 36 CO 0.01 0.68 -0.00 -0.07 0.02 0.00 0.00 177.57 178.21 2jaz h LEU 37 N 0.09 0.71 -0.43 2.57 3.38 -0.61 -2.05 115.31 118.97 2jaz h LEU 37 Ca -0.13 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 2jaz h LEU 37 Cb 1.63 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 2jaz h LEU 37 CO 0.18 0.78 0.01 -0.07 0.09 0.00 0.00 178.44 179.43 2jaz h LEU 38 N 0.70 0.74 -0.90 1.67 3.38 -0.76 -0.68 115.31 119.47 2jaz h LEU 38 Ca 0.14 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2jaz h LEU 38 Cb 0.44 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2jaz h LEU 38 CO 0.02 0.86 0.58 -0.33 0.09 0.00 0.00 178.44 179.66 2jaz h GLU 39 N 0.60 1.19 -0.73 1.13 5.08 -1.07 0.58 114.58 121.36 2jaz h GLU 39 Ca 0.12 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2jaz h GLU 39 Cb 0.47 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 2jaz h GLU 39 CO 0.02 0.80 0.37 1.25 -1.00 0.00 0.00 179.01 180.45 2jaz h HIS 40 N 1.22 1.04 -0.23 4.33 2.76 -1.07 0.38 115.15 123.57 2jaz h HIS 40 Ca 0.33 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.45 2jaz h HIS 40 Cb -0.12 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 28.50 2jaz h HIS 40 CO -0.01 0.75 0.11 0.35 -1.30 0.00 0.00 177.93 177.84 2jaz h PHE 41 N 1.02 0.34 -0.58 5.26 3.04 -0.44 -1.75 116.94 123.83 2jaz h PHE 41 Ca 0.25 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.19 2jaz h PHE 41 Cb 0.09 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.47 2jaz h PHE 41 CO 0.00 0.33 0.37 0.28 -2.02 0.00 0.00 178.31 177.27 2jaz h VAL 42 N 0.25 1.17 0.20 1.41 2.07 -0.55 -1.98 116.25 118.82 2jaz h VAL 42 Ca 0.08 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2jaz h VAL 42 Cb 0.12 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2jaz h VAL 42 CO -0.01 0.17 -0.16 0.50 0.02 0.00 0.00 177.57 178.09 2jaz h LYS 43 N 0.79 -0.35 -0.00 1.57 3.64 -0.70 -2.60 116.57 118.92 2jaz h LYS 43 Ca 0.21 0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.46 2jaz h LYS 43 Cb -0.04 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2jaz h LYS 43 CO -0.04 -0.23 -0.74 -0.84 -2.27 0.00 0.00 179.45 175.32 2jaz h ILE 44 N -0.37 1.53 -0.12 2.00 3.07 -1.27 -3.28 117.51 119.07 2jaz h ILE 44 Ca -0.01 -2.52 -0.20 0.00 1.55 0.00 0.00 64.86 63.68 2jaz h ILE 44 Cb 0.33 2.36 0.00 0.00 -0.27 0.00 0.00 36.82 39.24 2jaz h ILE 44 CO -0.01 0.72 -0.75 0.71 -1.05 0.00 0.00 178.15 177.77 2jaz h THR 45 N 0.01 1.33 -0.59 0.16 1.35 -1.37 -3.35 112.91 110.44 2jaz h THR 45 Ca -0.01 -2.05 -0.25 0.00 -0.55 0.00 0.00 66.41 63.55 2jaz h THR 45 Cb 1.31 2.04 -0.10 0.00 -1.73 0.00 0.00 68.15 69.67 2jaz h THR 45 CO 0.10 0.63 -0.23 -0.62 -0.25 0.00 0.00 175.52 175.15 2jaz n GLU 46 N -3.89 -1.21 -2.75 4.72 1.02 -0.98 -4.97 120.64 112.58 2jaz n GLU 46 Ca -0.06 0.91 -0.41 0.00 -0.02 0.00 0.00 57.16 57.58 2jaz n GLU 46 Cb 0.72 -5.08 -0.04 0.00 -0.02 0.00 0.00 31.44 27.02 2jaz n GLU 46 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jaz s HIS 47 N -2.29 3.77 0.53 -0.32 2.46 -1.26 -4.94 115.29 113.24 2jaz s HIS 47 Ca 0.00 1.75 0.22 0.00 0.47 0.00 0.00 55.06 57.50 2jaz s HIS 47 Cb 0.00 -3.05 1.38 0.00 -0.13 0.00 0.00 32.58 30.79 2jaz s HIS 47 CO 0.00 0.17 2.07 -1.00 -2.47 0.00 0.00 174.74 173.51 2jaz h PRO 48 N 5.85 0.00 -0.01 2.88 0.13 -1.96 -0.85 132.00 138.04 2jaz h PRO 48 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2jaz h PRO 48 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2jaz h PRO 48 CO 0.72 0.00 -0.06 -0.25 -0.23 0.00 0.00 178.00 178.18 2jaz n ASP 49 N -4.37 0.72 0.00 1.44 8.00 -1.26 -4.98 116.55 116.10 2jaz n ASP 49 Ca 0.03 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.55 2jaz n ASP 49 Cb 0.36 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 2jaz n ASP 49 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jaz n GLY 50 N 1.19 2.50 0.28 0.44 0.00 -0.33 -1.08 105.19 108.19 2jaz n GLY 50 Ca 0.18 0.20 0.19 0.00 0.00 0.00 0.00 46.02 46.59 2jaz n GLY 50 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jaz h THR 51 N 0.00 0.00 -0.40 2.61 1.35 -1.91 -2.39 112.91 112.17 2jaz h THR 51 Ca 0.00 -0.04 0.12 0.00 -0.55 0.00 0.00 66.41 65.94 2jaz h THR 51 Cb 0.00 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.29 2jaz h THR 51 CO 0.00 0.00 0.31 0.44 -0.25 0.00 0.00 175.52 176.02 2jaz h ASP 52 N 0.00 0.00 -0.21 5.36 3.32 -1.46 0.43 116.42 123.86 2jaz h ASP 52 Ca 0.00 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.11 2jaz h ASP 52 Cb 0.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2jaz h ASP 52 CO 0.00 0.00 0.15 -0.07 -1.72 0.00 0.00 179.24 177.60 2jaz h LEU 53 N 0.00 0.00 0.01 1.55 3.38 -1.60 0.38 115.31 119.02 2jaz h LEU 53 Ca 0.19 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.85 2jaz h LEU 53 Cb 0.80 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 2jaz h LEU 53 CO -0.00 0.00 -1.72 -0.38 0.09 0.00 0.00 178.44 176.43 2jaz n ILE 54 N -4.47 1.55 0.72 1.22 5.41 0.14 -4.34 119.36 119.59 2jaz n ILE 54 Ca 0.02 -0.18 0.12 0.00 1.00 0.00 0.00 62.75 63.70 2jaz n ILE 54 Cb 0.29 -1.96 0.12 0.00 -0.71 0.00 0.00 39.64 37.39 2jaz n ILE 54 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2jaz n TYR 55 N -4.29 0.26 -3.19 1.39 4.01 -0.55 -4.49 117.16 110.30 2jaz n TYR 55 Ca -0.39 0.08 -0.19 0.00 -0.16 0.00 0.00 57.90 57.23 2jaz n TYR 55 Cb 0.77 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.34 2jaz n TYR 55 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2jaz n TYR 56 N -1.85 0.01 -1.83 -0.72 4.01 0.13 -5.03 117.16 111.88 2jaz n TYR 56 Ca 0.03 -3.74 -0.40 0.00 -0.16 0.00 0.00 57.90 53.64 2jaz n TYR 56 Cb 0.40 -0.38 0.01 0.00 -0.31 0.00 0.00 39.34 39.07 2jaz n TYR 56 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2jaz s PRO 57 N -2.09 3.75 0.55 -0.72 0.04 -1.18 -4.62 135.00 130.72 2jaz s PRO 57 Ca 0.39 2.39 -0.21 0.00 0.04 0.00 0.00 61.00 63.60 2jaz s PRO 57 Cb 0.30 -2.69 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 2jaz s PRO 57 CO -0.09 -0.76 1.30 -1.12 0.04 0.00 0.00 177.00 176.38 2jaz s SER 58 N -0.52 5.34 0.00 6.66 0.01 -1.26 -4.88 113.70 119.05 2jaz s SER 58 Ca 0.60 2.63 0.19 0.00 1.31 0.00 0.00 55.95 60.68 2jaz s SER 58 Cb -0.43 -2.62 0.87 0.00 0.21 0.00 0.00 66.02 64.05 2jaz s SER 58 CO 0.56 -1.51 1.60 0.47 0.41 0.00 0.00 173.24 174.77 2jaz n ASP 59 N -1.09 0.00 -0.44 2.44 10.43 -1.26 -2.72 116.55 123.91 2jaz n ASP 59 Ca 0.11 0.30 0.07 0.00 2.57 0.00 0.00 54.79 57.84 2jaz n ASP 59 Cb 0.46 -0.41 0.27 0.00 1.84 0.00 0.00 41.12 43.28 2jaz n ASP 59 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2jaz n ASN 60 N -1.41 1.31 -3.84 -2.24 2.04 -1.26 -4.89 115.26 104.96 2jaz n ASN 60 Ca 0.06 -1.82 -0.09 0.00 -0.44 0.00 0.00 54.58 52.29 2jaz n ASN 60 Cb 0.19 -0.13 -0.05 0.00 -2.53 0.00 0.00 39.78 37.27 2jaz n ASN 60 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2jaz s ARG 61 N -1.75 1.35 0.26 -3.83 1.04 -1.10 -5.14 118.95 109.78 2jaz s ARG 61 Ca 0.24 -1.01 -0.29 0.00 -1.04 0.00 0.00 55.73 53.63 2jaz s ARG 61 Cb 0.13 0.48 -0.09 0.00 -2.04 0.00 0.00 34.95 33.42 2jaz s ARG 61 CO 0.18 -0.55 1.27 -0.51 -0.04 0.00 0.00 175.30 175.65 2jaz s ASP 62 N -2.92 6.92 -1.20 -2.89 1.01 -1.26 -4.78 116.67 111.54 2jaz s ASP 62 Ca 0.13 2.49 -0.18 0.00 0.71 0.00 0.00 52.55 55.70 2jaz s ASP 62 Cb 0.00 -2.63 0.09 0.00 1.01 0.00 0.00 42.92 41.39 2jaz s ASP 62 CO -0.00 -0.46 1.59 -0.62 0.21 0.00 0.00 175.17 175.89 2jaz s ASP 63 N -0.19 6.79 0.13 0.27 3.68 -1.26 -4.17 116.67 121.91 2jaz s ASP 63 Ca 0.52 -2.30 -0.25 0.00 2.13 0.00 0.00 52.55 52.65 2jaz s ASP 63 Cb -0.37 -2.54 0.07 0.00 -1.45 0.00 0.00 42.92 38.63 2jaz s ASP 63 CO 0.44 -1.17 0.80 -0.94 0.13 0.00 0.00 175.17 174.44 2jaz s SER 64 N 4.13 -0.35 0.28 -0.34 1.04 -1.26 -4.99 113.70 112.20 2jaz s SER 64 Ca 0.49 -0.21 0.02 0.00 0.48 0.00 0.00 55.95 56.74 2jaz s SER 64 Cb 0.01 0.53 0.62 0.00 0.10 0.00 0.00 66.02 67.28 2jaz s SER 64 CO 0.02 -0.91 1.78 -0.65 0.98 0.00 0.00 173.24 174.46 2jaz h PRO 65 N 2.00 0.74 -0.52 4.02 0.11 -1.97 0.21 132.00 136.59 2jaz h PRO 65 Ca -0.25 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.72 2jaz h PRO 65 Cb 1.26 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2jaz h PRO 65 CO 0.30 0.49 -0.05 0.93 -0.21 0.00 0.00 178.00 179.47 2jaz h GLU 66 N 0.76 0.94 -0.28 1.05 3.07 -1.96 -1.75 114.58 116.42 2jaz h GLU 66 Ca 0.52 -0.32 -0.10 0.00 -0.50 0.00 0.00 59.36 58.96 2jaz h GLU 66 Cb 0.71 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 2jaz h GLU 66 CO -0.35 0.98 -0.24 0.78 -1.40 0.00 0.00 179.01 178.79 2jaz h GLY 67 N 0.81 0.57 0.89 -3.84 0.00 -1.16 -1.11 103.07 99.23 2jaz h GLY 67 Ca 0.14 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 2jaz h GLY 67 CO 0.04 0.43 -0.01 -2.22 0.00 0.00 0.00 176.54 174.77 2jaz h ILE 68 N 0.47 1.26 -0.65 2.60 2.04 -0.55 -1.76 117.51 120.92 2jaz h ILE 68 Ca 0.07 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 64.92 2jaz h ILE 68 Cb 0.67 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 2jaz h ILE 68 CO 0.05 0.31 0.23 0.58 0.00 0.00 0.00 178.15 179.32 2jaz h VAL 69 N 0.35 1.23 0.15 1.67 2.07 -1.10 -2.03 116.25 118.59 2jaz h VAL 69 Ca 0.09 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 2jaz h VAL 69 Cb 0.45 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2jaz h VAL 69 CO 0.02 0.30 -0.07 0.50 0.02 0.00 0.00 177.57 178.34 2jaz h LYS 70 N 0.94 -0.20 -0.46 1.57 3.64 -0.98 0.01 116.57 121.09 2jaz h LYS 70 Ca 0.22 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.67 2jaz h LYS 70 Cb 0.23 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 2jaz h LYS 70 CO -0.01 -0.00 0.17 1.49 -2.27 0.00 0.00 179.45 178.82 2jaz h GLU 71 N -0.36 0.33 -0.42 1.90 4.81 -1.18 0.55 114.58 120.21 2jaz h GLU 71 Ca -0.02 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2jaz h GLU 71 Cb 0.29 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2jaz h GLU 71 CO 0.03 0.22 0.24 0.82 -0.73 0.00 0.00 179.01 179.60 2jaz h ILE 72 N 0.34 1.14 -0.18 2.32 2.04 -1.30 0.11 117.51 121.98 2jaz h ILE 72 Ca 0.22 -0.34 0.03 0.00 1.00 0.00 0.00 64.86 65.77 2jaz h ILE 72 Cb 0.21 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2jaz h ILE 72 CO -0.22 0.14 0.01 0.50 0.00 0.00 0.00 178.15 178.58 2jaz h LYS 73 N 0.55 0.07 -0.47 2.37 3.64 -0.34 0.78 116.57 123.16 2jaz h LYS 73 Ca 0.15 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.42 2jaz h LYS 73 Cb 0.02 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2jaz h LYS 73 CO -0.03 0.04 -0.12 0.93 -2.27 0.00 0.00 179.45 178.00 2jaz h GLU 74 N 0.07 0.87 -0.18 1.90 5.08 -0.67 -2.17 114.58 119.49 2jaz h GLU 74 Ca 0.09 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 2jaz h GLU 74 Cb 0.10 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2jaz h GLU 74 CO -0.14 0.95 -0.06 2.35 -1.00 0.00 0.00 179.01 181.11 2jaz h TRP 75 N 0.78 0.41 0.00 4.33 7.01 -0.67 -1.12 115.95 126.68 2jaz h TRP 75 Ca 0.13 -0.09 -0.05 0.00 2.11 0.00 0.00 58.89 60.98 2jaz h TRP 75 Cb 0.64 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.60 2jaz h TRP 75 CO 0.04 0.64 -0.23 0.00 -2.79 0.00 0.00 178.44 176.09 2jaz h ARG 76 N 0.06 0.00 -0.06 2.65 3.08 -0.82 -2.08 114.38 117.21 2jaz h ARG 76 Ca 0.04 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.88 2jaz h ARG 76 Cb 0.52 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.58 2jaz h ARG 76 CO 0.02 0.23 -0.79 0.00 -1.07 0.00 0.00 179.97 178.36 2jaz h ALA 77 N 1.77 0.17 0.00 0.04 0.00 -1.28 0.40 119.26 120.36 2jaz h ALA 77 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2jaz h ALA 77 Cb 0.42 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jaz h ALA 77 CO 0.03 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.84 2jaz h ALA 78 N 0.43 1.00 -0.28 0.00 0.00 -0.85 -2.60 119.26 116.97 2jaz h ALA 78 Ca -0.08 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2jaz h ALA 78 Cb 1.45 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 2jaz h ALA 78 CO 0.16 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.50 2jaz n ASN 79 N -2.91 3.63 -2.50 0.00 3.02 -0.81 -4.98 115.26 110.71 2jaz n ASN 79 Ca -0.01 -3.15 -0.15 0.00 -0.03 0.00 0.00 54.58 51.24 2jaz n ASN 79 Cb 0.18 -0.56 -0.01 0.00 -0.61 0.00 0.00 39.78 38.78 2jaz n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jaz n GLY 80 N -0.64 -0.50 3.92 7.41 0.00 -0.98 -4.97 105.19 109.43 2jaz n GLY 80 Ca 0.24 0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 2jaz n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jaz s LYS 81 N -5.10 3.38 0.44 1.61 1.02 0.12 -5.04 119.74 116.16 2jaz s LYS 81 Ca 0.03 -0.56 -0.26 0.00 0.02 0.00 0.00 55.97 55.20 2jaz s LYS 81 Cb -0.02 -2.96 -0.09 0.00 -0.52 0.00 0.00 37.83 34.25 2jaz s LYS 81 CO 0.04 0.55 1.45 -1.25 -0.92 0.00 0.00 175.35 175.22 2jaz s PRO 82 N -2.94 3.74 0.20 -1.68 0.04 -1.26 -4.44 135.00 128.66 2jaz s PRO 82 Ca 0.34 2.47 0.01 0.00 0.04 0.00 0.00 61.00 63.87 2jaz s PRO 82 Cb -0.12 -2.71 0.04 0.00 0.04 0.00 0.00 34.50 31.75 2jaz s PRO 82 CO 0.28 -0.79 0.28 0.41 0.04 0.00 0.00 177.00 177.21 2jaz n GLY 83 N 0.54 1.28 3.69 0.56 0.00 -1.26 -4.69 105.19 105.32 2jaz n GLY 83 Ca 0.04 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.67 2jaz n GLY 83 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jaz s PHE 84 N -0.47 1.78 0.22 1.61 0.08 -1.26 -3.70 117.98 116.24 2jaz s PHE 84 Ca 0.20 1.69 -0.31 0.00 0.12 0.00 0.00 56.93 58.62 2jaz s PHE 84 Cb -0.01 -3.47 -0.11 0.00 -0.57 0.00 0.00 43.02 38.86 2jaz s PHE 84 CO 0.13 -2.86 1.56 0.21 -0.10 0.00 0.00 175.22 174.16 2jaz s LYS 85 N -4.20 4.20 0.00 0.44 2.20 0.16 -4.85 119.74 117.68 2jaz s LYS 85 Ca 0.72 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.76 2jaz s LYS 85 Cb -0.28 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 2jaz s LYS 85 CO 0.51 -0.58 0.00 1.04 -0.36 0.00 0.00 175.35 175.96 2jaz n GLN 86 N 3.19 0.00 0.00 4.03 6.02 -1.26 -4.43 117.38 124.93 2jaz n GLN 86 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2jaz n GLN 86 Cb 0.38 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.64 2jaz n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46