#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwz n GLN 2 N 0.00 0.00 -3.80 0.03 3.00 -1.26 -4.07 117.38 111.28 2jwz n GLN 2 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2jwz n GLN 2 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 30.24 30.13 2jwz n GLN 2 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2jwz s ILE 3 N 0.00 0.02 -0.08 5.09 -1.09 -0.94 -1.68 121.20 122.52 2jwz s ILE 3 Ca 0.00 -0.21 0.04 0.00 -2.23 0.00 0.00 60.65 58.25 2jwz s ILE 3 Cb 0.00 -0.41 0.00 0.00 -1.58 0.00 0.00 42.46 40.47 2jwz s ILE 3 CO 0.00 -0.11 -0.21 -0.36 -1.23 0.00 0.00 174.94 173.03 2jwz s PHE 4 N -0.39 2.23 -0.18 3.97 0.08 -0.99 -2.46 117.98 120.25 2jwz s PHE 4 Ca -0.05 -0.86 -0.01 0.00 0.12 0.00 0.00 56.93 56.13 2jwz s PHE 4 Cb -0.03 -1.51 0.00 0.00 -0.57 0.00 0.00 43.02 40.90 2jwz s PHE 4 CO 0.01 -0.35 -0.13 0.08 -0.10 0.00 0.00 175.22 174.73 2jwz s VAL 5 N 0.34 2.73 0.30 -0.44 1.01 -1.22 -2.36 120.40 120.76 2jwz s VAL 5 Ca -0.15 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 60.88 2jwz s VAL 5 Cb -0.17 -2.18 -0.09 0.00 0.00 0.00 0.00 36.38 33.94 2jwz s VAL 5 CO 0.07 0.50 0.83 -0.54 0.00 0.00 0.00 175.10 175.95 2jwz s LYS 6 N 1.08 4.31 0.37 2.72 -0.14 -1.22 -2.29 119.74 124.57 2jwz s LYS 6 Ca -0.00 1.02 0.07 0.00 -1.36 0.00 0.00 55.97 55.70 2jwz s LYS 6 Cb -0.14 -2.69 -0.01 0.00 -1.68 0.00 0.00 37.83 33.31 2jwz s LYS 6 CO -0.04 0.26 0.44 0.95 -0.76 0.00 0.00 175.35 176.21 2jwz s THR 7 N -1.72 3.41 -0.52 2.17 -4.23 0.33 -3.48 115.64 111.61 2jwz s THR 7 Ca 0.50 -1.14 0.19 0.00 -1.18 0.00 0.00 61.69 60.06 2jwz s THR 7 Cb -0.15 -3.17 0.19 0.00 1.34 0.00 0.00 72.50 70.71 2jwz s THR 7 CO 0.20 -0.09 1.59 0.18 -0.54 0.00 0.00 174.62 175.96 2jwz n LEU 8 N -1.63 0.47 -1.10 4.79 4.32 -1.26 -1.99 117.00 120.61 2jwz n LEU 8 Ca 0.02 0.66 0.12 0.00 -0.02 0.00 0.00 56.01 56.79 2jwz n LEU 8 Cb 0.59 -0.64 0.24 0.00 -1.62 0.00 0.00 43.42 41.99 2jwz n LEU 8 CO 0.41 -0.64 0.72 0.35 -1.22 0.00 0.00 177.39 177.01 2jwz n THR 9 N -2.07 0.50 -1.20 -5.08 -2.24 -1.26 -4.94 114.28 97.99 2jwz n THR 9 Ca 0.01 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 2jwz n THR 9 Cb 0.13 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2jwz n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jwz n GLY 10 N 1.47 0.77 3.19 3.38 0.00 -0.84 -5.08 105.19 108.09 2jwz n GLY 10 Ca 0.19 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 2jwz n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jwz s LYS 11 N -2.62 3.03 0.04 1.61 2.20 -1.26 -4.91 119.74 117.83 2jwz s LYS 11 Ca 0.00 -0.86 0.04 0.00 -0.36 0.00 0.00 55.97 54.79 2jwz s LYS 11 Cb 0.00 -2.40 -0.04 0.00 -1.51 0.00 0.00 37.83 33.88 2jwz s LYS 11 CO 0.00 0.04 -0.06 -0.08 -0.36 0.00 0.00 175.35 174.89 2jwz s THR 12 N 0.68 3.66 0.23 3.43 -1.32 -1.26 -0.51 115.64 120.55 2jwz s THR 12 Ca -0.10 -0.90 0.11 0.00 -1.21 0.00 0.00 61.69 59.59 2jwz s THR 12 Cb -0.16 -2.64 -0.05 0.00 -1.51 0.00 0.00 72.50 68.14 2jwz s THR 12 CO 0.01 0.30 -0.20 -0.63 -2.21 0.00 0.00 174.62 171.89 2jwz s ILE 13 N -1.09 2.53 -0.29 5.08 1.01 -0.97 -4.98 121.20 122.49 2jwz s ILE 13 Ca 0.19 -2.12 -0.13 0.00 0.00 0.00 0.00 60.65 58.59 2jwz s ILE 13 Cb -0.11 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2jwz s ILE 13 CO 0.10 -0.23 0.28 -0.89 0.00 0.00 0.00 174.94 174.21 2jwz s THR 14 N -1.99 5.24 0.14 2.92 2.01 -1.26 -3.42 115.64 119.27 2jwz s THR 14 Ca 0.25 0.23 0.11 0.00 0.31 0.00 0.00 61.69 62.59 2jwz s THR 14 Cb -0.07 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2jwz s THR 14 CO 0.13 0.13 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.72 2jwz s LEU 15 N 1.90 2.41 -0.33 4.42 2.96 -1.03 -5.02 118.68 123.99 2jwz s LEU 15 Ca 0.10 -0.74 -0.13 0.00 -0.22 0.00 0.00 54.13 53.15 2jwz s LEU 15 Cb -0.16 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.23 2jwz s LEU 15 CO 0.11 0.17 0.27 -0.70 -1.32 0.00 0.00 176.35 174.87 2jwz s GLU 16 N -2.18 3.63 0.29 1.98 -6.30 -1.26 -2.22 118.70 112.63 2jwz s GLU 16 Ca 0.16 -0.49 0.04 0.00 -2.50 0.00 0.00 54.97 52.17 2jwz s GLU 16 Cb -0.10 -3.77 -0.06 0.00 0.00 0.00 0.00 34.13 30.20 2jwz s GLU 16 CO 0.07 -0.40 0.04 0.14 0.02 0.00 0.00 175.26 175.13 2jwz s VAL 17 N 1.82 1.15 -0.04 3.70 -7.23 -1.26 -4.83 120.40 113.71 2jwz s VAL 17 Ca 0.08 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.21 2jwz s VAL 17 Cb -0.17 -2.65 0.02 0.00 0.56 0.00 0.00 36.38 34.14 2jwz s VAL 17 CO 0.11 -0.10 0.08 -1.83 -0.31 0.00 0.00 175.10 173.05 2jwz s GLU 18 N -3.88 0.04 0.65 4.82 1.03 -1.26 0.47 118.70 120.56 2jwz s GLU 18 Ca 0.34 0.21 0.17 0.00 0.03 0.00 0.00 54.97 55.73 2jwz s GLU 18 Cb 0.08 -0.13 0.84 0.00 -0.80 0.00 0.00 34.13 34.11 2jwz s GLU 18 CO 0.14 -0.11 1.45 1.03 -1.33 0.00 0.00 175.26 176.43 2jwz h SER 19 N 6.85 0.00 0.40 0.83 0.87 -1.97 0.32 113.55 120.86 2jwz h SER 19 Ca -0.38 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.08 2jwz h SER 19 Cb 1.16 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 2jwz h SER 19 CO 0.46 0.00 -1.69 -1.54 -0.53 0.00 0.00 176.83 173.53 2jwz n SER 20 N -2.88 0.42 -4.77 6.23 3.41 -1.26 -2.04 113.62 112.72 2jwz n SER 20 Ca 0.04 0.17 -0.36 0.00 -0.26 0.00 0.00 58.87 58.46 2jwz n SER 20 Cb 0.84 1.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.79 2jwz n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jwz s ASP 21 N -5.20 6.11 0.37 4.04 -1.08 0.10 -4.93 116.67 116.08 2jwz s ASP 21 Ca -0.05 2.24 -0.26 0.00 -0.52 0.00 0.00 52.55 53.96 2jwz s ASP 21 Cb 0.10 -2.59 -0.09 0.00 -1.46 0.00 0.00 42.92 38.88 2jwz s ASP 21 CO 0.84 -0.95 1.10 -0.89 0.52 0.00 0.00 175.17 175.79 2jwz s THR 22 N -1.63 3.48 0.42 1.71 2.01 -1.26 -4.24 115.64 116.12 2jwz s THR 22 Ca 0.66 1.25 0.11 0.00 0.31 0.00 0.00 61.69 64.02 2jwz s THR 22 Cb -0.26 -3.70 0.31 0.00 0.01 0.00 0.00 72.50 68.86 2jwz s THR 22 CO 0.32 0.12 1.98 0.40 -0.69 0.00 0.00 174.62 176.75 2jwz h ILE 23 N 2.46 0.94 -0.51 1.82 1.08 -1.55 -2.17 117.51 119.58 2jwz h ILE 23 Ca -0.48 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.82 2jwz h ILE 23 Cb 1.22 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 35.35 2jwz h ILE 23 CO 0.63 0.09 0.33 -2.24 -0.69 0.00 0.00 178.15 176.28 2jwz h ASP 24 N 0.49 0.59 -0.85 1.72 3.04 -1.68 -1.64 116.42 118.10 2jwz h ASP 24 Ca 0.27 -0.02 0.13 0.00 -3.24 0.00 0.00 57.03 54.17 2jwz h ASP 24 Cb 0.42 -0.15 -0.09 0.00 -1.04 0.00 0.00 39.33 38.48 2jwz h ASP 24 CO -0.08 0.44 0.46 -1.13 -2.04 0.00 0.00 179.24 176.89 2jwz h ASN 25 N 0.69 0.61 0.01 4.15 -1.24 -1.70 -0.65 115.58 117.45 2jwz h ASN 25 Ca 0.19 0.07 -0.12 0.00 0.71 0.00 0.00 56.30 57.15 2jwz h ASN 25 Cb -0.07 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 2jwz h ASN 25 CO -0.04 0.29 -0.39 0.58 -1.29 0.00 0.00 177.43 176.59 2jwz h VAL 26 N 0.70 1.30 0.00 2.57 2.07 -1.30 -1.38 116.25 120.21 2jwz h VAL 26 Ca 0.44 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.43 2jwz h VAL 26 Cb 0.55 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2jwz h VAL 26 CO -0.32 0.48 -0.02 0.11 0.02 0.00 0.00 177.57 177.84 2jwz h LYS 27 N 0.41 0.00 0.08 1.57 1.57 -0.25 -2.33 116.57 117.61 2jwz h LYS 27 Ca 0.04 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.52 2jwz h LYS 27 Cb 0.86 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 2jwz h LYS 27 CO 0.07 0.02 -1.57 0.66 -0.57 0.00 0.00 179.45 178.06 2jwz h SER 28 N 0.00 0.25 -0.23 0.86 4.64 -0.39 -1.86 113.55 116.82 2jwz h SER 28 Ca -0.00 -0.40 -0.03 0.00 -0.47 0.00 0.00 61.79 60.89 2jwz h SER 28 Cb 0.04 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 2jwz h SER 28 CO 0.00 1.34 0.06 0.50 -0.87 0.00 0.00 176.83 177.86 2jwz h LYS 29 N 0.04 0.46 -0.04 4.77 3.64 -0.78 -0.36 116.57 124.30 2jwz h LYS 29 Ca -0.25 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.02 2jwz h LYS 29 Cb 1.99 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 2jwz h LYS 29 CO 0.13 0.45 -0.11 0.97 -2.27 0.00 0.00 179.45 178.62 2jwz h ILE 30 N 0.45 1.45 -0.89 2.00 2.10 -1.53 -2.11 117.51 118.98 2jwz h ILE 30 Ca 0.11 -1.50 0.20 0.00 1.08 0.00 0.00 64.86 64.75 2jwz h ILE 30 Cb 0.21 2.35 -0.12 0.00 -1.09 0.00 0.00 36.82 38.18 2jwz h ILE 30 CO -0.00 0.41 0.42 -0.61 -1.08 0.00 0.00 178.15 177.28 2jwz h GLN 31 N -0.41 0.45 -0.50 2.19 -0.00 -0.60 0.21 115.11 116.46 2jwz h GLN 31 Ca -0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.65 58.61 2jwz h GLN 31 Cb 0.72 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 28.08 2jwz h GLN 31 CO 0.02 0.30 0.26 -0.44 0.00 0.00 0.00 178.83 178.97 2jwz h ASP 32 N 0.46 0.64 0.45 -0.69 3.32 -1.00 0.54 116.42 120.14 2jwz h ASP 32 Ca 0.54 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.46 2jwz h ASP 32 Cb 0.98 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2jwz h ASP 32 CO -0.49 0.56 -0.22 0.50 -1.72 0.00 0.00 179.24 177.88 2jwz h LYS 33 N 0.66 -0.58 0.00 3.56 3.64 -0.30 -3.40 116.57 120.15 2jwz h LYS 33 Ca 0.17 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2jwz h LYS 33 Cb 0.08 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2jwz h LYS 33 CO -0.03 -0.34 -1.49 -1.91 -2.27 0.00 0.00 179.45 173.41 2jwz n GLU 34 N -5.18 0.71 -0.22 1.90 4.07 0.53 -5.05 120.64 117.40 2jwz n GLU 34 Ca -0.08 -0.11 0.00 0.00 -0.06 0.00 0.00 57.16 56.91 2jwz n GLU 34 Cb 0.26 -1.30 0.00 0.00 -0.06 0.00 0.00 31.44 30.34 2jwz n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jwz n GLY 35 N 1.66 0.88 3.67 8.31 0.00 0.19 -5.00 105.19 114.90 2jwz n GLY 35 Ca -0.02 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2jwz n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jwz s ILE 36 N -2.00 4.44 0.04 -0.61 2.07 -1.26 -4.90 121.20 118.98 2jwz s ILE 36 Ca 0.00 1.74 -0.33 0.00 -1.41 0.00 0.00 60.65 60.65 2jwz s ILE 36 Cb 0.00 -4.12 -0.12 0.00 0.13 0.00 0.00 42.46 38.34 2jwz s ILE 36 CO 0.00 -0.11 1.77 -2.65 -1.91 0.00 0.00 174.94 172.04 2jwz n PRO 37 N 6.14 2.30 -0.29 3.50 -0.02 -1.26 -4.17 135.00 141.21 2jwz n PRO 37 Ca 0.12 0.84 0.01 0.00 -2.02 0.00 0.00 63.50 62.45 2jwz n PRO 37 Cb 0.46 -2.67 0.14 0.00 -0.02 0.00 0.00 33.50 31.41 2jwz n PRO 37 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2jwz h PRO 38 N 7.99 0.81 0.00 0.52 0.13 -1.91 -1.09 132.00 138.44 2jwz h PRO 38 Ca -0.47 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2jwz h PRO 38 Cb 1.26 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2jwz h PRO 38 CO 0.93 0.53 0.00 0.22 -0.23 0.00 0.00 178.00 179.45 2jwz h ASP 39 N 0.83 0.00 -0.56 1.44 1.82 -1.97 -2.81 116.42 115.17 2jwz h ASP 39 Ca 0.37 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.01 2jwz h ASP 39 Cb 0.26 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.27 2jwz h ASP 39 CO -0.21 0.00 0.00 1.67 -1.61 0.00 0.00 179.24 179.09 2jwz n GLN 40 N -3.07 3.68 -4.69 0.28 -0.06 -0.52 -4.92 117.38 108.08 2jwz n GLN 40 Ca 0.02 -2.84 -0.25 0.00 -2.00 0.00 0.00 57.00 51.93 2jwz n GLN 40 Cb 0.38 -1.87 -0.16 0.00 -4.06 0.00 0.00 30.24 24.52 2jwz n GLN 40 CO 0.00 0.00 0.00 1.14 -0.20 0.00 0.00 177.06 178.00 2jwz s GLN 41 N -2.00 1.70 -0.15 3.69 1.03 -0.60 -4.37 119.66 118.95 2jwz s GLN 41 Ca 0.48 -0.50 0.01 0.00 0.04 0.00 0.00 55.36 55.39 2jwz s GLN 41 Cb 0.32 -1.44 0.02 0.00 0.03 0.00 0.00 33.01 31.94 2jwz s GLN 41 CO 0.21 0.13 -0.19 0.50 -2.54 0.00 0.00 175.29 173.40 2jwz s ARG 42 N 0.33 2.74 -0.26 9.60 6.06 0.26 -4.83 118.95 132.86 2jwz s ARG 42 Ca -0.09 -0.74 -0.18 0.00 -2.50 0.00 0.00 55.73 52.23 2jwz s ARG 42 Cb -0.13 -2.34 -0.03 0.00 0.06 0.00 0.00 34.95 32.51 2jwz s ARG 42 CO 0.03 -0.15 0.50 -0.51 -2.50 0.00 0.00 175.30 172.67 2jwz s LEU 43 N 1.17 4.06 0.08 -0.88 1.43 -1.26 0.12 118.68 123.40 2jwz s LEU 43 Ca 0.00 0.50 0.07 0.00 -1.03 0.00 0.00 54.13 53.68 2jwz s LEU 43 Cb -0.14 -2.63 -0.03 0.00 0.03 0.00 0.00 46.19 43.42 2jwz s LEU 43 CO -0.08 -0.27 -0.20 -0.51 0.23 0.00 0.00 176.35 175.53 2jwz s ILE 44 N 2.23 1.60 -0.08 -0.59 1.10 -0.85 -1.67 121.20 122.95 2jwz s ILE 44 Ca 0.21 -1.39 -0.01 0.00 -0.51 0.00 0.00 60.65 58.94 2jwz s ILE 44 Cb -0.16 -1.44 0.03 0.00 0.15 0.00 0.00 42.46 41.04 2jwz s ILE 44 CO 0.09 -0.00 0.00 0.12 -2.11 0.00 0.00 174.94 173.04 2jwz s PHE 45 N -1.06 0.70 -1.35 3.50 5.36 -0.73 -2.74 117.98 121.66 2jwz s PHE 45 Ca 0.05 -0.20 -0.12 0.00 -0.96 0.00 0.00 56.93 55.70 2jwz s PHE 45 Cb -0.10 -0.82 0.01 0.00 -0.34 0.00 0.00 43.02 41.78 2jwz s PHE 45 CO 0.03 -0.34 0.43 0.00 -1.46 0.00 0.00 175.22 173.88 2jwz n ALA 46 N 5.14 -2.25 -1.22 11.12 0.00 -1.26 -1.43 120.51 130.61 2jwz n ALA 46 Ca -0.07 -0.38 -0.08 0.00 0.00 0.00 0.00 53.44 52.91 2jwz n ALA 46 Cb 0.50 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 2jwz n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jwz n GLY 47 N -2.12 0.94 3.25 0.00 0.00 -1.26 -5.03 105.19 100.97 2jwz n GLY 47 Ca -0.23 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.04 2jwz n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwz s LYS 48 N -2.41 1.59 -0.17 1.61 1.02 -0.52 -5.13 119.74 115.73 2jwz s LYS 48 Ca 0.00 -0.88 -0.12 0.00 0.02 0.00 0.00 55.97 55.00 2jwz s LYS 48 Cb 0.00 -1.64 -0.05 0.00 -0.52 0.00 0.00 37.83 35.63 2jwz s LYS 48 CO 0.00 0.43 0.21 -1.14 -0.92 0.00 0.00 175.35 173.93 2jwz s GLN 49 N -0.87 4.16 0.02 1.68 -0.44 -1.26 -1.78 119.66 121.17 2jwz s GLN 49 Ca 0.08 -0.06 -0.25 0.00 -2.50 0.00 0.00 55.36 52.63 2jwz s GLN 49 Cb -0.09 -3.40 -0.05 0.00 -1.64 0.00 0.00 33.01 27.83 2jwz s GLN 49 CO 0.01 0.32 0.76 -0.51 0.50 0.00 0.00 175.29 176.37 2jwz s LEU 50 N 0.27 4.42 -0.25 3.68 1.43 -0.67 -5.03 118.68 122.53 2jwz s LEU 50 Ca 0.13 1.40 -0.09 0.00 -1.03 0.00 0.00 54.13 54.53 2jwz s LEU 50 Cb -0.12 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 2jwz s LEU 50 CO 0.01 -0.03 0.13 -0.70 0.23 0.00 0.00 176.35 176.00 2jwz s GLU 51 N 0.19 3.88 0.56 1.70 -6.30 -1.26 -4.68 118.70 112.80 2jwz s GLU 51 Ca 0.39 -0.36 0.45 0.00 -2.50 0.00 0.00 54.97 52.94 2jwz s GLU 51 Cb -0.20 -3.48 1.59 0.00 0.00 0.00 0.00 34.13 32.05 2jwz s GLU 51 CO 0.22 -0.08 1.58 -0.44 0.02 0.00 0.00 175.26 176.56 2jwz h ASP 52 N 7.96 0.00 0.69 -1.70 5.19 -1.97 -0.75 116.42 125.84 2jwz h ASP 52 Ca -0.37 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 55.93 2jwz h ASP 52 Cb 1.18 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.67 2jwz h ASP 52 CO 0.60 0.00 -0.55 1.23 -3.12 0.00 0.00 179.24 177.40 2jwz h GLY 53 N 0.00 0.00 -2.85 2.75 0.00 -1.95 -1.91 103.07 99.11 2jwz h GLY 53 Ca 0.80 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.64 2jwz h GLY 53 CO -0.01 0.00 -0.17 -1.60 0.00 0.00 0.00 176.54 174.77 2jwz s ARG 54 N -3.60 3.53 0.28 4.80 6.06 -0.29 -4.82 118.95 124.90 2jwz s ARG 54 Ca -0.01 -0.20 -0.05 0.00 -2.50 0.00 0.00 55.73 52.97 2jwz s ARG 54 Cb 0.12 -2.65 -0.05 0.00 0.06 0.00 0.00 34.95 32.43 2jwz s ARG 54 CO 0.74 0.16 0.54 0.95 -2.50 0.00 0.00 175.30 175.19 2jwz s THR 55 N -2.25 5.03 0.16 4.11 -4.23 -1.26 -3.50 115.64 113.70 2jwz s THR 55 Ca 0.41 0.04 0.33 0.00 -1.18 0.00 0.00 61.69 61.29 2jwz s THR 55 Cb -0.10 -3.73 0.33 0.00 1.34 0.00 0.00 72.50 70.35 2jwz s THR 55 CO 0.35 -0.29 1.99 -0.07 -0.54 0.00 0.00 174.62 176.05 2jwz h LEU 56 N 1.76 0.00 -0.16 4.79 4.07 -1.74 -2.64 115.31 121.39 2jwz h LEU 56 Ca -0.48 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.46 2jwz h LEU 56 Cb 1.19 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.92 2jwz h LEU 56 CO 0.66 0.00 0.02 0.77 -1.08 0.00 0.00 178.44 178.82 2jwz h SER 57 N 0.00 0.26 0.30 -0.43 4.64 -1.76 -2.55 113.55 114.02 2jwz h SER 57 Ca 0.00 -0.26 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 2jwz h SER 57 Cb 0.09 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2jwz h SER 57 CO 0.00 0.46 -0.11 0.44 -0.87 0.00 0.00 176.83 176.75 2jwz h ASP 58 N 0.05 0.00 -1.15 4.97 5.19 -1.76 -1.29 116.42 122.42 2jwz h ASP 58 Ca 0.05 0.00 -0.56 0.00 -0.62 0.00 0.00 57.03 55.90 2jwz h ASP 58 Cb 0.31 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 39.61 2jwz h ASP 58 CO 0.00 0.11 0.66 -1.22 -3.12 0.00 0.00 179.24 175.67 2jwz n TYR 59 N -3.72 2.26 0.00 4.55 4.01 -0.96 -4.91 117.16 118.39 2jwz n TYR 59 Ca -0.02 -2.27 0.00 0.00 -0.16 0.00 0.00 57.90 55.45 2jwz n TYR 59 Cb 0.22 -1.26 0.00 0.00 -0.31 0.00 0.00 39.34 37.99 2jwz n TYR 59 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2jwz n ASN 60 N 0.05 0.00 -4.72 7.72 2.04 -0.49 -4.78 115.26 115.08 2jwz n ASN 60 Ca 0.49 0.00 -0.42 0.00 -0.44 0.00 0.00 54.58 54.21 2jwz n ASN 60 Cb 0.50 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.72 2jwz n ASN 60 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2jwz s ILE 61 N 0.00 3.11 0.56 1.53 1.01 -1.25 -5.01 121.20 121.15 2jwz s ILE 61 Ca 0.00 0.79 0.05 0.00 0.00 0.00 0.00 60.65 61.49 2jwz s ILE 61 Cb 0.00 -3.51 0.06 0.00 0.01 0.00 0.00 42.46 39.02 2jwz s ILE 61 CO 0.00 0.06 0.77 -1.10 0.00 0.00 0.00 174.94 174.67 2jwz s GLN 62 N 1.16 2.38 0.27 2.79 1.11 -1.26 -4.90 119.66 121.22 2jwz s GLN 62 Ca 0.66 -1.17 -0.28 0.00 0.01 0.00 0.00 55.36 54.58 2jwz s GLN 62 Cb -0.39 -2.56 -0.15 0.00 -1.01 0.00 0.00 33.01 28.90 2jwz s GLN 62 CO 0.30 -0.79 0.91 0.36 0.01 0.00 0.00 175.29 176.08 2jwz n LYS 63 N -2.30 1.08 -2.34 2.91 -0.00 -1.26 -3.61 118.16 112.64 2jwz n LYS 63 Ca 0.11 0.38 -0.03 0.00 -0.00 0.00 0.00 58.31 58.77 2jwz n LYS 63 Cb 0.60 -1.67 0.00 0.00 -0.00 0.00 0.00 35.03 33.96 2jwz n LYS 63 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2jwz n GLU 64 N 0.77 -0.55 -3.24 -1.58 2.13 -0.68 -5.03 120.64 112.47 2jwz n GLU 64 Ca 0.11 0.11 -0.34 0.00 0.66 0.00 0.00 57.16 57.70 2jwz n GLU 64 Cb 0.31 -3.32 -0.06 0.00 0.27 0.00 0.00 31.44 28.64 2jwz n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jwz s SER 65 N -2.96 6.84 -0.23 4.31 0.01 -1.24 -4.92 113.70 115.50 2jwz s SER 65 Ca 0.03 1.20 -0.06 0.00 1.31 0.00 0.00 55.95 58.44 2jwz s SER 65 Cb -0.01 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.86 2jwz s SER 65 CO 0.04 -0.04 0.02 -0.89 0.41 0.00 0.00 173.24 172.78 2jwz s THR 66 N -1.69 3.87 0.12 1.44 2.01 -1.26 -2.35 115.64 117.78 2jwz s THR 66 Ca 0.46 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.19 2jwz s THR 66 Cb -0.13 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 2jwz s THR 66 CO 0.19 0.38 0.01 -0.76 -0.69 0.00 0.00 174.62 173.76 2jwz s LEU 67 N 1.54 3.45 -0.27 4.42 1.43 -1.00 -4.95 118.68 123.30 2jwz s LEU 67 Ca 0.06 -0.23 -0.10 0.00 -1.03 0.00 0.00 54.13 52.83 2jwz s LEU 67 Cb -0.15 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 2jwz s LEU 67 CO 0.00 0.14 0.15 -2.28 0.23 0.00 0.00 176.35 174.60 2jwz s HIS 68 N -1.46 3.19 -0.14 0.29 2.46 -1.11 -3.45 115.29 115.07 2jwz s HIS 68 Ca 0.27 -0.02 -0.23 0.00 0.47 0.00 0.00 55.06 55.54 2jwz s HIS 68 Cb -0.11 -2.32 -0.03 0.00 -0.13 0.00 0.00 32.58 29.99 2jwz s HIS 68 CO 0.19 -0.19 0.70 0.45 -2.47 0.00 0.00 174.74 173.42 2jwz s SER 69 N 1.62 6.86 0.15 9.88 0.15 -1.23 -2.00 113.70 129.14 2jwz s SER 69 Ca 0.07 1.04 0.10 0.00 0.70 0.00 0.00 55.95 57.86 2jwz s SER 69 Cb -0.15 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.72 2jwz s SER 69 CO 0.08 -0.25 -0.22 0.68 1.20 0.00 0.00 173.24 174.74 2jwz s VAL 70 N 1.56 2.02 0.19 4.45 -7.23 0.32 -4.66 120.40 117.05 2jwz s VAL 70 Ca 0.34 -1.84 -0.03 0.00 -1.81 0.00 0.00 61.98 58.64 2jwz s VAL 70 Cb -0.17 -1.88 -0.05 0.00 0.56 0.00 0.00 36.38 34.84 2jwz s VAL 70 CO 0.13 -0.13 0.42 -0.76 -0.31 0.00 0.00 175.10 174.45 2jwz s LEU 71 N -2.39 4.21 0.02 1.32 1.02 -1.26 0.93 118.68 122.52 2jwz s LEU 71 Ca 0.15 0.55 0.06 0.00 0.02 0.00 0.00 54.13 54.91 2jwz s LEU 71 Cb -0.08 -3.31 -0.03 0.00 0.02 0.00 0.00 46.19 42.79 2jwz s LEU 71 CO 0.07 -0.03 -0.16 0.00 0.02 0.00 0.00 176.35 176.25 2jwz s ARG 72 N -3.06 2.22 0.00 1.70 1.70 -1.26 -4.97 118.95 115.28 2jwz s ARG 72 Ca 0.41 -0.89 0.00 0.00 -0.47 0.00 0.00 55.73 54.78 2jwz s ARG 72 Cb -0.11 -2.26 0.00 0.00 -0.57 0.00 0.00 34.95 32.00 2jwz s ARG 72 CO 0.27 0.57 0.00 1.47 -1.08 0.00 0.00 175.30 176.53 2jwz n LEU 73 N 1.72 0.00 0.00 -1.89 -0.00 -1.26 -5.09 117.00 110.48 2jwz n LEU 73 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.85 2jwz n LEU 73 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 2jwz n LEU 73 CO 0.27 0.00 0.00 -1.14 -0.00 0.00 0.00 177.39 176.52 2jwz n ARG 74 N 0.00 0.00 0.00 1.47 0.63 -1.26 -4.94 116.66 112.55 2jwz n ARG 74 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2jwz n ARG 74 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2jwz n ARG 74 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jwz n GLY 75 N 0.00 0.61 0.00 5.14 0.00 -1.26 -5.35 105.19 104.33 2jwz n GLY 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jwz n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93