#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 -3.87 0.03 1.13 -1.26 -4.35 117.38 109.06 2jwz n GLN 2 Ca 0.00 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.95 2jwz n GLN 2 Cb 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 30.24 30.24 2jwz n GLN 2 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2jwz s ILE 3 N 0.00 0.05 -0.08 5.09 -1.09 -0.88 -1.74 121.20 122.54 2jwz s ILE 3 Ca 0.00 -0.42 0.03 0.00 -2.23 0.00 0.00 60.65 58.03 2jwz s ILE 3 Cb 0.00 -0.29 0.01 0.00 -1.58 0.00 0.00 42.46 40.60 2jwz s ILE 3 CO 0.00 -0.23 -0.18 -0.36 -1.23 0.00 0.00 174.94 172.94 2jwz s PHE 4 N -0.76 2.02 -0.15 3.97 0.40 -0.96 -1.71 117.98 120.79 2jwz s PHE 4 Ca -0.08 -0.81 0.02 0.00 -0.60 0.00 0.00 56.93 55.46 2jwz s PHE 4 Cb -0.05 -1.40 0.01 0.00 0.51 0.00 0.00 43.02 42.10 2jwz s PHE 4 CO 0.01 -0.36 -0.21 0.08 0.70 0.00 0.00 175.22 175.44 2jwz s VAL 5 N 0.53 2.03 0.29 -0.44 1.01 -1.16 -2.60 120.40 120.05 2jwz s VAL 5 Ca -0.16 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 60.65 2jwz s VAL 5 Cb -0.17 -1.81 -0.09 0.00 0.00 0.00 0.00 36.38 34.31 2jwz s VAL 5 CO 0.06 0.54 0.82 -0.54 0.00 0.00 0.00 175.10 175.98 2jwz s LYS 6 N 0.97 4.34 0.39 2.72 -0.14 -1.25 -2.04 119.74 124.73 2jwz s LYS 6 Ca -0.03 1.03 0.08 0.00 -1.36 0.00 0.00 55.97 55.68 2jwz s LYS 6 Cb -0.15 -2.75 -0.01 0.00 -1.68 0.00 0.00 37.83 33.25 2jwz s LYS 6 CO -0.05 0.29 0.45 0.95 -0.76 0.00 0.00 175.35 176.23 2jwz s THR 7 N -1.66 3.19 -0.43 2.17 -4.23 0.16 -4.08 115.64 110.76 2jwz s THR 7 Ca 0.48 -1.16 0.20 0.00 -1.18 0.00 0.00 61.69 60.04 2jwz s THR 7 Cb -0.16 -3.11 0.21 0.00 1.34 0.00 0.00 72.50 70.78 2jwz s THR 7 CO 0.21 -0.06 1.62 0.18 -0.54 0.00 0.00 174.62 176.03 2jwz n LEU 8 N -1.64 0.53 -1.09 4.79 4.32 -1.26 -1.90 117.00 120.75 2jwz n LEU 8 Ca 0.04 0.68 0.12 0.00 -0.02 0.00 0.00 56.01 56.83 2jwz n LEU 8 Cb 0.60 -0.67 0.23 0.00 -1.62 0.00 0.00 43.42 41.96 2jwz n LEU 8 CO 0.41 -0.70 0.71 0.35 -1.22 0.00 0.00 177.39 176.94 2jwz n THR 9 N -2.15 0.46 -1.15 -5.08 -2.24 -1.26 -4.94 114.28 97.93 2jwz n THR 9 Ca 0.01 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 2jwz n THR 9 Cb 0.13 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 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 3.16 3.38 0.00 -0.80 -5.08 105.19 108.09 2jwz n GLY 10 Ca 0.19 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.49 2.83 0.01 1.61 2.36 -1.26 -4.91 119.74 117.90 2jwz s LYS 11 Ca 0.00 -0.79 0.02 0.00 -2.55 0.00 0.00 55.97 52.65 2jwz s LYS 11 Cb 0.00 -2.23 -0.04 0.00 -1.05 0.00 0.00 37.83 34.51 2jwz s LYS 11 CO 0.00 0.06 -0.01 -0.08 1.55 0.00 0.00 175.35 176.87 2jwz s THR 12 N 0.64 4.05 0.21 3.43 -1.32 -1.26 -0.66 115.64 120.73 2jwz s THR 12 Ca -0.12 -0.69 0.12 0.00 -1.21 0.00 0.00 61.69 59.79 2jwz s THR 12 Cb -0.16 -2.82 -0.05 0.00 -1.51 0.00 0.00 72.50 67.96 2jwz s THR 12 CO 0.03 0.34 -0.23 -0.63 -2.21 0.00 0.00 174.62 171.92 2jwz s ILE 13 N -1.10 2.38 -0.27 5.08 1.01 -0.87 -4.97 121.20 122.46 2jwz s ILE 13 Ca 0.20 -2.11 -0.11 0.00 0.00 0.00 0.00 60.65 58.63 2jwz s ILE 13 Cb -0.11 -2.16 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 2jwz s ILE 13 CO 0.11 -0.18 0.19 -0.89 0.00 0.00 0.00 174.94 174.18 2jwz s THR 14 N -1.84 5.31 0.11 2.92 2.01 -1.26 -2.98 115.64 119.91 2jwz s THR 14 Ca 0.23 0.19 0.08 0.00 0.31 0.00 0.00 61.69 62.50 2jwz s THR 14 Cb -0.07 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2jwz s THR 14 CO 0.11 0.27 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.93 2jwz s LEU 15 N 1.61 2.81 -0.34 4.42 2.96 -0.70 -4.99 118.68 124.45 2jwz s LEU 15 Ca 0.08 -0.50 -0.15 0.00 -0.22 0.00 0.00 54.13 53.33 2jwz s LEU 15 Cb -0.15 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 2jwz s LEU 15 CO 0.09 0.18 0.36 -0.70 -1.32 0.00 0.00 176.35 174.97 2jwz s GLU 16 N -2.15 3.57 0.28 1.98 -6.30 -1.26 -2.08 118.70 112.74 2jwz s GLU 16 Ca 0.19 -0.41 0.05 0.00 -2.50 0.00 0.00 54.97 52.30 2jwz s GLU 16 Cb -0.11 -3.80 -0.06 0.00 0.00 0.00 0.00 34.13 30.16 2jwz s GLU 16 CO 0.11 -0.52 -0.00 0.14 0.02 0.00 0.00 175.26 175.01 2jwz s VAL 17 N 2.02 1.30 -0.05 3.70 -7.23 -1.26 -4.84 120.40 114.04 2jwz s VAL 17 Ca 0.12 -2.05 -0.03 0.00 -1.81 0.00 0.00 61.98 58.20 2jwz s VAL 17 Cb -0.17 -2.54 0.03 0.00 0.56 0.00 0.00 36.38 34.26 2jwz s VAL 17 CO 0.12 -0.20 0.13 -1.83 -0.31 0.00 0.00 175.10 173.00 2jwz s GLU 18 N -3.82 0.11 0.64 4.82 1.03 -1.26 0.40 118.70 120.62 2jwz s GLU 18 Ca 0.32 0.27 0.15 0.00 0.03 0.00 0.00 54.97 55.74 2jwz s GLU 18 Cb 0.06 -0.07 0.70 0.00 -0.80 0.00 0.00 34.13 34.02 2jwz s GLU 18 CO 0.12 -0.10 1.36 1.03 -1.33 0.00 0.00 175.26 176.34 2jwz h SER 19 N 6.66 0.00 0.27 0.83 0.87 -1.94 0.63 113.55 120.87 2jwz h SER 19 Ca -0.35 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.09 2jwz h SER 19 Cb 1.17 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.11 2jwz h SER 19 CO 0.43 0.00 -1.84 -1.54 -0.53 0.00 0.00 176.83 173.35 2jwz n SER 20 N -2.86 0.29 -4.78 6.23 3.41 -1.26 -0.97 113.62 113.69 2jwz n SER 20 Ca 0.05 0.12 -0.36 0.00 -0.26 0.00 0.00 58.87 58.42 2jwz n SER 20 Cb 0.94 1.19 -0.01 0.00 -0.26 0.00 0.00 64.21 66.07 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 -5.11 6.17 0.35 4.04 -1.08 0.21 -4.89 116.67 116.35 2jwz s ASP 21 Ca -0.06 2.21 -0.27 0.00 -0.52 0.00 0.00 52.55 53.91 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 0.86 -0.91 1.10 -0.89 0.52 0.00 0.00 175.17 175.85 2jwz s THR 22 N -1.64 3.47 0.43 1.71 2.01 -1.26 -4.21 115.64 116.14 2jwz s THR 22 Ca 0.65 1.30 0.13 0.00 0.31 0.00 0.00 61.69 64.08 2jwz s THR 22 Cb -0.26 -3.76 0.32 0.00 0.01 0.00 0.00 72.50 68.82 2jwz s THR 22 CO 0.31 0.18 1.99 0.40 -0.69 0.00 0.00 174.62 176.80 2jwz h ILE 23 N 2.61 0.92 -0.41 1.82 1.08 -1.57 -2.38 117.51 119.58 2jwz h ILE 23 Ca -0.48 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 2jwz h ILE 23 Cb 1.22 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.41 2jwz h ILE 23 CO 0.64 0.08 0.26 -0.78 -0.69 0.00 0.00 178.15 177.66 2jwz h ASP 24 N 0.42 0.49 -0.80 1.72 3.58 -1.73 -1.72 116.42 118.38 2jwz h ASP 24 Ca 0.26 -0.03 0.13 0.00 0.42 0.00 0.00 57.03 57.80 2jwz h ASP 24 Cb 0.46 -0.12 -0.09 0.00 1.72 0.00 0.00 39.33 41.30 2jwz h ASP 24 CO -0.07 0.37 0.40 -1.13 -2.88 0.00 0.00 179.24 175.93 2jwz h ASN 25 N 0.55 0.49 0.11 2.28 -1.24 -1.74 -0.28 115.58 115.76 2jwz h ASN 25 Ca 0.15 0.08 -0.12 0.00 0.71 0.00 0.00 56.30 57.12 2jwz h ASN 25 Cb -0.04 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 2jwz h ASN 25 CO -0.03 0.24 -0.42 0.58 -1.29 0.00 0.00 177.43 176.51 2jwz h VAL 26 N 0.61 1.31 -0.06 2.57 2.07 -1.41 -1.56 116.25 119.79 2jwz h VAL 26 Ca 0.42 -1.58 0.02 0.00 0.82 0.00 0.00 66.70 66.38 2jwz h VAL 26 Cb 0.54 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2jwz h VAL 26 CO -0.33 0.48 0.04 0.11 0.02 0.00 0.00 177.57 177.89 2jwz h LYS 27 N 0.32 0.00 0.08 1.57 1.57 -0.18 -2.22 116.57 117.72 2jwz h LYS 27 Ca 0.03 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.51 2jwz h LYS 27 Cb 0.88 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2jwz h LYS 27 CO 0.07 0.00 -1.54 0.66 -0.57 0.00 0.00 179.45 178.07 2jwz h SER 28 N 0.00 0.28 -0.21 0.86 4.64 -0.41 -1.96 113.55 116.74 2jwz h SER 28 Ca 0.03 -0.42 -0.03 0.00 -0.47 0.00 0.00 61.79 60.90 2jwz h SER 28 Cb 0.11 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 2jwz h SER 28 CO -0.00 1.35 0.06 0.50 -0.87 0.00 0.00 176.83 177.87 2jwz h LYS 29 N 0.05 0.43 -0.07 4.77 3.64 -0.79 -0.78 116.57 123.82 2jwz h LYS 29 Ca -0.24 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.03 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 0.14 0.41 -0.14 0.97 -2.27 0.00 0.00 179.45 178.55 2jwz h ILE 30 N 0.42 1.41 -0.85 2.00 2.10 -1.53 -2.27 117.51 118.80 2jwz h ILE 30 Ca 0.10 -1.45 0.22 0.00 1.08 0.00 0.00 64.86 64.80 2jwz h ILE 30 Cb 0.19 2.21 -0.13 0.00 -1.09 0.00 0.00 36.82 37.99 2jwz h ILE 30 CO -0.00 0.41 0.23 -0.61 -1.08 0.00 0.00 178.15 177.10 2jwz h GLN 31 N -0.27 0.23 -0.48 2.19 5.75 -0.48 0.18 115.11 122.23 2jwz h GLN 31 Ca 0.00 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2jwz h GLN 31 Cb 0.73 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 2jwz h GLN 31 CO 0.03 0.16 0.27 -0.44 -2.65 0.00 0.00 178.83 176.20 2jwz h ASP 32 N 0.24 0.59 0.36 -0.69 3.32 -1.04 0.52 116.42 119.72 2jwz h ASP 32 Ca 0.52 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.48 2jwz h ASP 32 Cb 1.01 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2jwz h ASP 32 CO -0.61 0.49 -0.17 0.50 -1.72 0.00 0.00 179.24 177.73 2jwz h LYS 33 N 0.64 -0.47 0.00 3.56 3.64 -0.41 -3.40 116.57 120.13 2jwz h LYS 33 Ca 0.17 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2jwz h LYS 33 Cb 0.02 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2jwz h LYS 33 CO -0.03 -0.22 -1.53 -1.91 -2.27 0.00 0.00 179.45 173.49 2jwz n GLU 34 N -5.11 0.67 -0.21 1.90 4.07 0.44 -5.05 120.64 117.35 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 0.24 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.30 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 1.65 0.89 3.67 8.31 0.00 0.18 -5.00 105.19 114.89 2jwz n GLY 35 Ca -0.02 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 4.47 0.04 -0.61 2.07 -1.26 -4.90 121.20 119.01 2jwz s ILE 36 Ca 0.00 1.77 -0.33 0.00 -1.41 0.00 0.00 60.65 60.68 2jwz s ILE 36 Cb 0.00 -4.14 -0.12 0.00 0.13 0.00 0.00 42.46 38.33 2jwz s ILE 36 CO 0.00 -0.11 1.79 -2.65 -1.91 0.00 0.00 174.94 172.06 2jwz n PRO 37 N 6.08 2.35 -0.28 3.50 -0.02 -1.26 -4.14 135.00 141.23 2jwz n PRO 37 Ca 0.12 0.86 0.02 0.00 -2.02 0.00 0.00 63.50 62.48 2jwz n PRO 37 Cb 0.46 -2.70 0.16 0.00 -0.02 0.00 0.00 33.50 31.40 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 8.17 0.76 0.00 0.52 0.13 -1.92 -1.17 132.00 138.50 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 1.25 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2jwz h PRO 38 CO 0.93 0.50 -0.01 0.22 -0.23 0.00 0.00 178.00 179.41 2jwz h ASP 39 N 0.78 0.00 -0.57 1.44 1.82 -1.96 -2.92 116.42 115.01 2jwz h ASP 39 Ca 0.38 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.02 2jwz h ASP 39 Cb 0.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.34 2jwz h ASP 39 CO -0.24 0.01 0.00 1.67 -1.61 0.00 0.00 179.24 179.07 2jwz n GLN 40 N -3.10 3.97 -4.75 0.28 -0.06 -0.52 -4.92 117.38 108.28 2jwz n GLN 40 Ca 0.02 -2.94 -0.25 0.00 -2.00 0.00 0.00 57.00 51.83 2jwz n GLN 40 Cb 0.40 -1.97 -0.16 0.00 -4.06 0.00 0.00 30.24 24.45 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 -2.20 1.72 -0.18 3.69 1.03 -0.71 -4.05 119.66 118.95 2jwz s GLN 41 Ca 0.50 -0.55 0.01 0.00 0.04 0.00 0.00 55.36 55.36 2jwz s GLN 41 Cb 0.35 -1.47 0.02 0.00 0.03 0.00 0.00 33.01 31.94 2jwz s GLN 41 CO 0.20 0.19 -0.20 0.50 -2.54 0.00 0.00 175.29 173.44 2jwz s ARG 42 N 0.18 2.98 -0.24 9.60 6.06 0.31 -4.83 118.95 133.01 2jwz s ARG 42 Ca -0.06 -0.83 -0.17 0.00 -2.50 0.00 0.00 55.73 52.17 2jwz s ARG 42 Cb -0.12 -2.56 -0.03 0.00 0.06 0.00 0.00 34.95 32.29 2jwz s ARG 42 CO 0.02 -0.21 0.45 -0.51 -2.50 0.00 0.00 175.30 172.55 2jwz s LEU 43 N 1.29 4.09 0.08 -0.88 1.43 -1.26 0.11 118.68 123.54 2jwz s LEU 43 Ca 0.05 0.48 0.08 0.00 -1.03 0.00 0.00 54.13 53.71 2jwz s LEU 43 Cb -0.13 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 2jwz s LEU 43 CO -0.13 -0.19 -0.21 -0.51 0.23 0.00 0.00 176.35 175.54 2jwz s ILE 44 N 1.88 1.70 -0.08 -0.59 1.10 -0.80 -1.63 121.20 122.77 2jwz s ILE 44 Ca 0.19 -1.39 -0.01 0.00 -0.51 0.00 0.00 60.65 58.93 2jwz s ILE 44 Cb -0.15 -1.52 0.03 0.00 0.15 0.00 0.00 42.46 40.97 2jwz s ILE 44 CO 0.09 0.06 0.00 0.12 -2.11 0.00 0.00 174.94 173.10 2jwz s PHE 45 N -1.00 0.68 -1.34 3.50 5.36 -0.77 -2.81 117.98 121.60 2jwz s PHE 45 Ca 0.07 -0.20 -0.13 0.00 -0.96 0.00 0.00 56.93 55.71 2jwz s PHE 45 Cb -0.09 -0.81 0.01 0.00 -0.34 0.00 0.00 43.02 41.78 2jwz s PHE 45 CO 0.03 -0.34 0.46 0.00 -1.46 0.00 0.00 175.22 173.91 2jwz n ALA 46 N 5.14 -2.27 -1.24 11.12 0.00 -1.26 -1.49 120.51 130.52 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 -2.14 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 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 -2.09 0.99 3.26 0.00 0.00 -1.26 -5.03 105.19 101.06 2jwz n GLY 47 Ca -0.22 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.52 1.61 -0.17 1.61 1.02 -0.56 -5.13 119.74 115.61 2jwz s LYS 48 Ca 0.00 -0.90 -0.13 0.00 0.02 0.00 0.00 55.97 54.96 2jwz s LYS 48 Cb 0.00 -1.66 -0.05 0.00 -0.52 0.00 0.00 37.83 35.60 2jwz s LYS 48 CO 0.00 0.44 0.26 -1.14 -0.92 0.00 0.00 175.35 173.99 2jwz s GLN 49 N -0.90 4.22 0.03 1.68 -0.44 -1.26 -1.86 119.66 121.13 2jwz s GLN 49 Ca 0.08 0.03 -0.26 0.00 -2.50 0.00 0.00 55.36 52.71 2jwz s GLN 49 Cb -0.09 -3.42 -0.05 0.00 -1.64 0.00 0.00 33.01 27.82 2jwz s GLN 49 CO 0.01 0.27 0.81 -0.51 0.50 0.00 0.00 175.29 176.37 2jwz s LEU 50 N 0.40 4.42 -0.25 3.68 1.43 -0.65 -5.03 118.68 122.69 2jwz s LEU 50 Ca 0.15 1.48 -0.09 0.00 -1.03 0.00 0.00 54.13 54.63 2jwz s LEU 50 Cb -0.13 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 2jwz s LEU 50 CO 0.03 -0.06 0.13 -0.70 0.23 0.00 0.00 176.35 175.98 2jwz s GLU 51 N 0.26 3.89 0.58 1.70 -6.30 -1.26 -4.68 118.70 112.88 2jwz s GLU 51 Ca 0.41 -0.36 0.42 0.00 -2.50 0.00 0.00 54.97 52.95 2jwz s GLU 51 Cb -0.20 -3.47 1.47 0.00 0.00 0.00 0.00 34.13 31.92 2jwz s GLU 51 CO 0.24 -0.07 1.49 -0.44 0.02 0.00 0.00 175.26 176.50 2jwz h ASP 52 N 7.91 0.00 1.14 -1.70 5.19 -1.97 0.59 116.42 127.58 2jwz h ASP 52 Ca -0.37 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 2jwz h ASP 52 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.69 2jwz h ASP 52 CO 0.60 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.33 2jwz n GLY 53 N -1.85 -1.56 3.89 2.75 0.00 -1.26 -1.98 105.19 105.18 2jwz n GLY 53 Ca 0.37 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 46.00 2jwz n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jwz s ARG 54 N -3.03 3.70 0.17 1.61 3.00 0.20 -4.89 118.95 119.71 2jwz s ARG 54 Ca 0.13 0.08 -0.06 0.00 -1.00 0.00 0.00 55.73 54.88 2jwz s ARG 54 Cb 0.17 -2.73 -0.06 0.00 0.00 0.00 0.00 34.95 32.33 2jwz s ARG 54 CO 0.55 0.36 0.44 0.95 0.00 0.00 0.00 175.30 177.59 2jwz s THR 55 N -1.80 5.09 0.03 4.11 -4.23 -1.26 -3.46 115.64 114.12 2jwz s THR 55 Ca 0.44 0.17 0.31 0.00 -1.18 0.00 0.00 61.69 61.43 2jwz s THR 55 Cb -0.11 -3.62 0.32 0.00 1.34 0.00 0.00 72.50 70.42 2jwz s THR 55 CO 0.24 -0.01 1.93 -0.07 -0.54 0.00 0.00 174.62 176.17 2jwz h LEU 56 N 2.70 0.00 -0.06 4.79 4.07 -1.73 -2.90 115.31 122.18 2jwz h LEU 56 Ca -0.46 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.49 2jwz h LEU 56 Cb 1.17 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.90 2jwz h LEU 56 CO 0.71 0.00 0.02 0.77 -1.08 0.00 0.00 178.44 178.86 2jwz h SER 57 N 0.00 0.09 0.35 -0.43 4.64 -1.39 -2.16 113.55 114.65 2jwz h SER 57 Ca 0.00 -0.21 -0.02 0.00 -0.47 0.00 0.00 61.79 61.09 2jwz h SER 57 Cb 0.17 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2jwz h SER 57 CO 0.00 0.28 -0.07 0.44 -0.87 0.00 0.00 176.83 176.61 2jwz h ASP 58 N -0.10 0.00 -1.16 4.97 3.32 -1.79 -1.45 116.42 120.20 2jwz h ASP 58 Ca 0.02 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.48 2jwz h ASP 58 Cb 0.22 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 39.55 2jwz h ASP 58 CO -0.00 0.07 0.72 0.00 -1.72 0.00 0.00 179.24 178.31 2jwz n TYR 59 N -3.50 2.44 0.00 4.55 4.19 -0.82 -4.91 117.16 119.11 2jwz n TYR 59 Ca -0.02 -2.38 0.00 0.00 3.31 0.00 0.00 57.90 58.81 2jwz n TYR 59 Cb 0.20 -1.26 0.00 0.00 0.49 0.00 0.00 39.34 38.77 2jwz n TYR 59 CO 0.00 0.00 0.00 0.27 0.91 0.00 0.00 176.86 178.04 2jwz n ASN 60 N -0.15 0.00 -4.70 2.98 2.04 -0.55 -4.77 115.26 110.11 2jwz n ASN 60 Ca 0.50 0.00 -0.42 0.00 -0.44 0.00 0.00 54.58 54.22 2jwz n ASN 60 Cb 0.51 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.73 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 3.17 0.54 1.53 1.01 -1.24 -5.00 121.20 121.21 2jwz s ILE 61 Ca 0.00 0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.44 2jwz s ILE 61 Cb 0.00 -3.46 0.06 0.00 0.01 0.00 0.00 42.46 39.07 2jwz s ILE 61 CO 0.00 0.02 0.74 -1.10 0.00 0.00 0.00 174.94 174.60 2jwz s GLN 62 N 1.92 2.43 0.24 2.79 -1.52 -1.26 -4.89 119.66 119.36 2jwz s GLN 62 Ca 0.69 -1.39 -0.29 0.00 -1.95 0.00 0.00 55.36 52.41 2jwz s GLN 62 Cb -0.38 -2.64 -0.15 0.00 -0.22 0.00 0.00 33.01 29.62 2jwz s GLN 62 CO 0.30 -0.72 0.92 1.17 -0.25 0.00 0.00 175.29 176.71 2jwz n LYS 63 N -2.19 0.95 -2.32 2.91 4.81 -1.26 -3.60 118.16 117.46 2jwz n LYS 63 Ca 0.13 0.33 -0.02 0.00 -0.87 0.00 0.00 58.31 57.88 2jwz n LYS 63 Cb 0.60 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 34.02 2jwz n LYS 63 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2jwz n GLU 64 N 1.01 -0.40 -3.24 1.64 2.13 -0.71 -5.03 120.64 116.03 2jwz n GLU 64 Ca 0.13 0.07 -0.35 0.00 0.66 0.00 0.00 57.16 57.68 2jwz n GLU 64 Cb 0.28 -3.21 -0.06 0.00 0.27 0.00 0.00 31.44 28.72 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 -2.98 6.87 -0.24 4.31 0.01 -1.24 -4.91 113.70 115.52 2jwz s SER 65 Ca 0.02 1.20 -0.06 0.00 1.31 0.00 0.00 55.95 58.43 2jwz s SER 65 Cb -0.01 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.87 2jwz s SER 65 CO 0.03 0.00 0.02 -0.89 0.41 0.00 0.00 173.24 172.82 2jwz s THR 66 N -1.62 3.89 0.12 1.44 2.01 -1.26 -2.26 115.64 117.96 2jwz s THR 66 Ca 0.43 -0.35 0.05 0.00 0.31 0.00 0.00 61.69 62.14 2jwz s THR 66 Cb -0.14 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 2jwz s THR 66 CO 0.20 0.35 0.02 -0.76 -0.69 0.00 0.00 174.62 173.74 2jwz s LEU 67 N 1.55 3.47 -0.27 4.42 1.43 -1.07 -4.95 118.68 123.25 2jwz s LEU 67 Ca 0.06 -0.22 -0.09 0.00 -1.03 0.00 0.00 54.13 52.84 2jwz s LEU 67 Cb -0.15 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 2jwz s LEU 67 CO 0.01 0.14 0.14 -1.00 0.23 0.00 0.00 176.35 175.87 2jwz s HIS 68 N -1.46 3.16 -0.13 0.29 3.76 -1.12 -3.86 115.29 115.93 2jwz s HIS 68 Ca 0.27 -0.12 -0.21 0.00 -0.15 0.00 0.00 55.06 54.85 2jwz s HIS 68 Cb -0.11 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.22 2jwz s HIS 68 CO 0.19 -0.25 0.61 0.45 -0.85 0.00 0.00 174.74 174.89 2jwz s SER 69 N 1.70 6.79 0.14 1.40 0.15 -1.24 -1.91 113.70 120.73 2jwz s SER 69 Ca 0.07 0.95 0.10 0.00 0.70 0.00 0.00 55.95 57.77 2jwz s SER 69 Cb -0.16 -2.35 -0.04 0.00 -1.71 0.00 0.00 66.02 61.76 2jwz s SER 69 CO 0.08 -0.14 -0.22 0.54 1.20 0.00 0.00 173.24 174.69 2jwz s VAL 70 N 1.16 2.00 0.17 4.45 0.11 0.31 -4.74 120.40 123.86 2jwz s VAL 70 Ca 0.31 -1.78 -0.03 0.00 -2.93 0.00 0.00 61.98 57.55 2jwz s VAL 70 Cb -0.16 -1.84 -0.05 0.00 -1.53 0.00 0.00 36.38 32.79 2jwz s VAL 70 CO 0.13 -0.09 0.39 -0.76 -3.33 0.00 0.00 175.10 171.44 2jwz s LEU 71 N -2.26 4.24 0.11 2.54 1.02 -1.26 0.11 118.68 123.19 2jwz s LEU 71 Ca 0.13 0.53 0.09 0.00 0.02 0.00 0.00 54.13 54.91 2jwz s LEU 71 Cb -0.09 -3.28 -0.04 0.00 0.02 0.00 0.00 46.19 42.81 2jwz s LEU 71 CO 0.06 0.01 -0.19 0.00 0.02 0.00 0.00 176.35 176.25 2jwz s ARG 72 N -2.90 1.76 -0.14 1.70 1.70 -1.26 -4.97 118.95 114.84 2jwz s ARG 72 Ca 0.40 -1.18 -0.12 0.00 -0.47 0.00 0.00 55.73 54.36 2jwz s ARG 72 Cb -0.12 -2.09 -0.09 0.00 -0.57 0.00 0.00 34.95 32.08 2jwz s ARG 72 CO 0.26 0.48 0.08 1.25 -1.08 0.00 0.00 175.30 176.30 2jwz h LEU 73 N 3.82 0.00 0.00 -1.89 5.85 -1.99 -3.49 115.31 117.60 2jwz h LEU 73 Ca -0.50 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 57.98 2jwz h LEU 73 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2jwz h LEU 73 CO 0.45 0.88 0.00 -2.11 -0.34 0.00 0.00 178.44 177.32 2jwz n ARG 74 N -4.62 0.00 0.00 1.25 1.85 -1.26 -5.13 116.66 108.75 2jwz n ARG 74 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.74 2jwz n ARG 74 Cb 0.31 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.72 2jwz n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jwz n GLY 75 N 0.00 0.97 0.00 2.89 0.00 -1.26 -5.32 105.19 102.48 2jwz n GLY 75 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2jwz n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93