#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 -3.82 0.03 3.00 -1.26 -2.85 117.38 112.48 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 0.04 -0.09 5.09 -1.09 -0.87 -1.77 121.20 122.52 2jwz s ILE 3 Ca 0.00 -0.34 0.04 0.00 -2.23 0.00 0.00 60.65 58.12 2jwz s ILE 3 Cb 0.00 -0.40 0.00 0.00 -1.58 0.00 0.00 42.46 40.49 2jwz s ILE 3 CO 0.00 -0.19 -0.22 -0.36 -1.23 0.00 0.00 174.94 172.95 2jwz s PHE 4 N -0.67 2.32 -0.17 3.97 0.08 -0.97 -2.54 117.98 119.99 2jwz s PHE 4 Ca -0.08 -0.89 -0.00 0.00 0.12 0.00 0.00 56.93 56.08 2jwz s PHE 4 Cb -0.04 -1.56 0.00 0.00 -0.57 0.00 0.00 43.02 40.85 2jwz s PHE 4 CO 0.01 -0.36 -0.14 0.08 -0.10 0.00 0.00 175.22 174.72 2jwz s VAL 5 N 0.31 2.68 0.31 -0.44 1.01 -1.22 -2.46 120.40 120.59 2jwz s VAL 5 Ca -0.15 -0.75 -0.22 0.00 0.00 0.00 0.00 61.98 60.86 2jwz s VAL 5 Cb -0.17 -2.15 -0.09 0.00 0.00 0.00 0.00 36.38 33.97 2jwz s VAL 5 CO 0.07 0.50 0.85 -0.54 0.00 0.00 0.00 175.10 175.99 2jwz s LYS 6 N 1.06 4.34 0.39 2.72 -0.14 -1.24 -2.22 119.74 124.65 2jwz s LYS 6 Ca -0.01 1.06 0.08 0.00 -1.36 0.00 0.00 55.97 55.74 2jwz s LYS 6 Cb -0.15 -2.65 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 2jwz s LYS 6 CO -0.04 0.24 0.45 0.95 -0.76 0.00 0.00 175.35 176.19 2jwz s THR 7 N -1.75 3.14 -0.47 2.17 -4.23 0.38 -3.74 115.64 111.14 2jwz s THR 7 Ca 0.51 -1.16 0.19 0.00 -1.18 0.00 0.00 61.69 60.05 2jwz s THR 7 Cb -0.15 -3.09 0.20 0.00 1.34 0.00 0.00 72.50 70.79 2jwz s THR 7 CO 0.20 -0.05 1.59 0.18 -0.54 0.00 0.00 174.62 176.00 2jwz n LEU 8 N -1.65 0.49 -1.07 4.79 4.32 -1.26 -1.88 117.00 120.75 2jwz n LEU 8 Ca 0.04 0.67 0.12 0.00 -0.02 0.00 0.00 56.01 56.82 2jwz n LEU 8 Cb 0.60 -0.66 0.24 0.00 -1.62 0.00 0.00 43.42 41.97 2jwz n LEU 8 CO 0.41 -0.68 0.71 0.35 -1.22 0.00 0.00 177.39 176.96 2jwz n THR 9 N -2.10 0.44 -1.18 -5.08 -2.24 -1.26 -4.94 114.28 97.93 2jwz n THR 9 Ca 0.01 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 2jwz n THR 9 Cb 0.12 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 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 1.45 0.77 3.20 3.38 0.00 -0.79 -5.08 105.19 108.13 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 -2.56 3.03 0.03 1.61 2.20 -1.26 -4.91 119.74 117.89 2jwz s LYS 11 Ca 0.00 -0.87 0.03 0.00 -0.36 0.00 0.00 55.97 54.77 2jwz s LYS 11 Cb 0.00 -2.35 -0.04 0.00 -1.51 0.00 0.00 37.83 33.93 2jwz s LYS 11 CO 0.00 0.10 -0.00 -0.08 -0.36 0.00 0.00 175.35 175.01 2jwz s THR 12 N 0.54 4.10 0.21 3.43 -1.32 -1.26 -0.47 115.64 120.86 2jwz s THR 12 Ca -0.14 -0.74 0.11 0.00 -1.21 0.00 0.00 61.69 59.70 2jwz s THR 12 Cb -0.17 -2.87 -0.04 0.00 -1.51 0.00 0.00 72.50 67.90 2jwz s THR 12 CO 0.04 0.28 -0.19 -0.63 -2.21 0.00 0.00 174.62 171.92 2jwz s ILE 13 N -1.17 2.62 -0.29 5.08 1.01 -0.94 -4.98 121.20 122.53 2jwz s ILE 13 Ca 0.22 -2.01 -0.13 0.00 0.00 0.00 0.00 60.65 58.73 2jwz s ILE 13 Cb -0.12 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 2jwz s ILE 13 CO 0.13 -0.18 0.27 -0.89 0.00 0.00 0.00 174.94 174.28 2jwz s THR 14 N -1.86 5.25 0.13 2.92 2.01 -1.26 -3.42 115.64 119.40 2jwz s THR 14 Ca 0.24 0.28 0.11 0.00 0.31 0.00 0.00 61.69 62.62 2jwz s THR 14 Cb -0.07 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 2jwz s THR 14 CO 0.12 0.17 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.75 2jwz s LEU 15 N 1.89 2.40 -0.29 4.42 2.96 -1.05 -5.03 118.68 123.98 2jwz s LEU 15 Ca 0.10 -0.72 -0.11 0.00 -0.22 0.00 0.00 54.13 53.18 2jwz s LEU 15 Cb -0.16 -1.28 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 2jwz s LEU 15 CO 0.11 0.18 0.19 -0.70 -1.32 0.00 0.00 176.35 174.80 2jwz s GLU 16 N -2.11 3.84 0.27 1.98 -6.30 -1.26 -2.05 118.70 113.07 2jwz s GLU 16 Ca 0.15 -0.39 0.06 0.00 -2.50 0.00 0.00 54.97 52.29 2jwz s GLU 16 Cb -0.10 -3.65 -0.06 0.00 0.00 0.00 0.00 34.13 30.32 2jwz s GLU 16 CO 0.07 -0.23 -0.04 0.14 0.02 0.00 0.00 175.26 175.22 2jwz s VAL 17 N 1.74 1.51 -0.08 3.70 -7.23 -1.13 -4.76 120.40 114.14 2jwz s VAL 17 Ca 0.07 -2.10 -0.07 0.00 -1.81 0.00 0.00 61.98 58.07 2jwz s VAL 17 Cb -0.16 -2.44 0.02 0.00 0.56 0.00 0.00 36.38 34.36 2jwz s VAL 17 CO 0.10 -0.30 0.22 -1.83 -0.31 0.00 0.00 175.10 172.98 2jwz s GLU 18 N -3.76 0.24 0.61 4.82 -1.05 -1.26 0.63 118.70 118.93 2jwz s GLU 18 Ca 0.29 0.32 0.25 0.00 -0.15 0.00 0.00 54.97 55.69 2jwz s GLU 18 Cb 0.04 0.09 0.95 0.00 -0.44 0.00 0.00 34.13 34.78 2jwz s GLU 18 CO 0.11 -0.05 1.38 1.03 0.95 0.00 0.00 175.26 178.69 2jwz h SER 19 N 5.97 0.00 0.38 0.83 0.87 -1.99 0.52 113.55 120.13 2jwz h SER 19 Ca -0.27 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.20 2jwz h SER 19 Cb 1.19 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 2jwz h SER 19 CO 0.37 0.00 -1.70 -1.54 -0.53 0.00 0.00 176.83 173.44 2jwz n SER 20 N -3.25 0.38 -4.76 6.23 3.41 -1.26 -4.05 113.62 110.33 2jwz n SER 20 Ca 0.19 0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.55 2jwz n SER 20 Cb 1.33 1.10 -0.04 0.00 -0.26 0.00 0.00 64.21 66.35 2jwz n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jwz s ASP 21 N -5.12 7.12 0.33 4.04 1.11 0.18 -5.01 116.67 119.31 2jwz s ASP 21 Ca -0.05 2.35 -0.27 0.00 0.18 0.00 0.00 52.55 54.76 2jwz s ASP 21 Cb 0.11 -2.63 -0.09 0.00 1.07 0.00 0.00 42.92 41.38 2jwz s ASP 21 CO 0.85 -0.28 1.05 -0.89 1.18 0.00 0.00 175.17 177.08 2jwz s THR 22 N -0.89 3.70 0.45 -1.27 2.01 -1.26 -4.41 115.64 113.97 2jwz s THR 22 Ca 0.47 1.52 0.16 0.00 0.31 0.00 0.00 61.69 64.15 2jwz s THR 22 Cb -0.34 -3.89 0.34 0.00 0.01 0.00 0.00 72.50 68.62 2jwz s THR 22 CO 0.42 0.22 1.98 0.40 -0.69 0.00 0.00 174.62 176.96 2jwz h ILE 23 N 2.70 0.87 -0.60 1.82 1.08 -1.57 -1.94 117.51 119.88 2jwz h ILE 23 Ca -0.47 -0.12 0.02 0.00 -0.39 0.00 0.00 64.86 63.90 2jwz h ILE 23 Cb 1.21 0.50 -0.04 0.00 -3.07 0.00 0.00 36.82 35.43 2jwz h ILE 23 CO 0.65 0.06 0.37 -0.78 -0.69 0.00 0.00 178.15 177.77 2jwz h ASP 24 N 0.34 0.62 -0.76 1.72 1.82 -1.65 -1.59 116.42 116.92 2jwz h ASP 24 Ca 0.27 -0.00 0.12 0.00 -0.39 0.00 0.00 57.03 57.03 2jwz h ASP 24 Cb 0.60 -0.14 -0.09 0.00 0.68 0.00 0.00 39.33 40.39 2jwz h ASP 24 CO -0.07 0.44 0.35 -1.13 -1.61 0.00 0.00 179.24 177.22 2jwz h ASN 25 N 0.75 0.40 0.19 2.28 -1.24 -1.65 -0.26 115.58 116.04 2jwz h ASN 25 Ca 0.23 0.09 -0.13 0.00 0.71 0.00 0.00 56.30 57.20 2jwz h ASN 25 Cb -0.02 0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.05 2jwz h ASN 25 CO -0.08 0.19 -0.47 -0.37 -1.29 0.00 0.00 177.43 175.41 2jwz h VAL 26 N 0.54 1.33 0.00 2.57 -1.51 -1.39 -1.85 116.25 115.94 2jwz h VAL 26 Ca 0.40 -1.66 -0.00 0.00 -1.23 0.00 0.00 66.70 64.20 2jwz h VAL 26 Cb 0.53 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.43 2jwz h VAL 26 CO -0.34 0.50 -0.01 0.11 -1.23 0.00 0.00 177.57 176.61 2jwz h LYS 27 N 0.27 0.00 0.07 5.19 1.79 -0.14 -2.14 116.57 121.61 2jwz h LYS 27 Ca 0.02 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.19 2jwz h LYS 27 Cb 0.93 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.55 2jwz h LYS 27 CO 0.08 0.01 -1.53 0.66 -1.08 0.00 0.00 179.45 177.58 2jwz h SER 28 N 0.00 0.24 -0.25 0.86 4.64 -0.52 -1.96 113.55 116.56 2jwz h SER 28 Ca -0.00 -0.36 -0.02 0.00 -0.47 0.00 0.00 61.79 60.93 2jwz h SER 28 Cb 0.01 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 2jwz h SER 28 CO 0.00 1.30 0.09 0.50 -0.87 0.00 0.00 176.83 177.86 2jwz h LYS 29 N 0.04 0.46 -0.06 4.77 3.64 -0.75 -1.07 116.57 123.60 2jwz h LYS 29 Ca -0.23 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.04 2jwz h LYS 29 Cb 1.98 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.72 2jwz h LYS 29 CO 0.13 0.42 -0.14 0.97 -2.27 0.00 0.00 179.45 178.56 2jwz h ILE 30 N 0.46 1.43 -0.87 2.00 2.10 -1.51 -2.27 117.51 118.85 2jwz h ILE 30 Ca 0.11 -1.50 0.23 0.00 1.08 0.00 0.00 64.86 64.78 2jwz h ILE 30 Cb 0.16 2.28 -0.14 0.00 -1.09 0.00 0.00 36.82 38.03 2jwz h ILE 30 CO -0.01 0.42 0.27 -0.61 -1.08 0.00 0.00 178.15 177.14 2jwz h GLN 31 N -0.32 0.24 -0.47 2.19 5.75 -0.51 0.24 115.11 122.23 2jwz h GLN 31 Ca -0.00 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2jwz h GLN 31 Cb 0.75 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 2jwz h GLN 31 CO 0.03 0.16 0.25 -0.44 -2.65 0.00 0.00 178.83 176.18 2jwz h ASP 32 N 0.25 0.59 0.35 -0.69 3.32 -1.10 0.51 116.42 119.64 2jwz h ASP 32 Ca 0.55 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.49 2jwz h ASP 32 Cb 1.09 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.50 2jwz h ASP 32 CO -0.62 0.52 -0.17 0.50 -1.72 0.00 0.00 179.24 177.75 2jwz h LYS 33 N 0.62 -0.45 0.00 3.56 3.64 -0.28 -3.39 116.57 120.26 2jwz h LYS 33 Ca 0.16 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2jwz h LYS 33 Cb 0.06 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2jwz h LYS 33 CO -0.03 -0.18 -1.59 -1.91 -2.27 0.00 0.00 179.45 173.47 2jwz n GLU 34 N -5.09 0.63 -0.23 1.90 4.07 0.61 -5.05 120.64 117.48 2jwz n GLU 34 Ca -0.08 -0.12 0.00 0.00 -0.06 0.00 0.00 57.16 56.90 2jwz n GLU 34 Cb 0.24 -1.34 0.00 0.00 -0.06 0.00 0.00 31.44 30.28 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 1.62 0.88 3.67 8.31 0.00 0.18 -5.00 105.19 114.84 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 4.58 0.07 -0.61 2.07 -1.26 -4.90 121.20 119.15 2jwz s ILE 36 Ca 0.00 1.89 -0.33 0.00 -1.41 0.00 0.00 60.65 60.81 2jwz s ILE 36 Cb 0.00 -4.22 -0.12 0.00 0.13 0.00 0.00 42.46 38.25 2jwz s ILE 36 CO 0.00 -0.12 1.80 -2.65 -1.91 0.00 0.00 174.94 172.06 2jwz n PRO 37 N 6.01 2.49 -0.30 3.50 -0.02 -1.26 -4.14 135.00 141.28 2jwz n PRO 37 Ca 0.12 0.91 0.04 0.00 -2.02 0.00 0.00 63.50 62.54 2jwz n PRO 37 Cb 0.46 -2.76 0.18 0.00 -0.02 0.00 0.00 33.50 31.36 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 8.19 0.80 0.00 0.52 0.13 -1.91 -1.17 132.00 138.56 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 1.24 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.19 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 0.82 0.00 -0.60 1.44 3.58 -1.97 -2.90 116.42 116.79 2jwz h ASP 39 Ca 0.41 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.86 2jwz h ASP 39 Cb 0.39 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2jwz h ASP 39 CO -0.25 0.00 0.00 1.67 -2.88 0.00 0.00 179.24 177.78 2jwz n GLN 40 N -3.07 3.75 -4.64 0.28 -0.06 -0.50 -4.88 117.38 108.25 2jwz n GLN 40 Ca 0.02 -2.87 -0.24 0.00 -2.00 0.00 0.00 57.00 51.90 2jwz n GLN 40 Cb 0.39 -1.89 -0.16 0.00 -4.06 0.00 0.00 30.24 24.51 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 -1.95 1.59 -0.14 3.69 1.03 -0.84 -4.24 119.66 118.79 2jwz s GLN 41 Ca 0.49 -0.47 0.02 0.00 0.04 0.00 0.00 55.36 55.44 2jwz s GLN 41 Cb 0.33 -1.36 0.02 0.00 0.03 0.00 0.00 33.01 32.02 2jwz s GLN 41 CO 0.22 0.13 -0.18 0.50 -2.54 0.00 0.00 175.29 173.42 2jwz s ARG 42 N 0.32 2.63 -0.23 9.60 6.06 0.37 -4.85 118.95 132.85 2jwz s ARG 42 Ca -0.08 -0.70 -0.18 0.00 -2.50 0.00 0.00 55.73 52.27 2jwz s ARG 42 Cb -0.13 -2.23 -0.03 0.00 0.06 0.00 0.00 34.95 32.62 2jwz s ARG 42 CO 0.03 -0.11 0.49 -0.51 -2.50 0.00 0.00 175.30 172.69 2jwz s LEU 43 N 1.09 4.10 0.07 -0.88 1.43 -1.26 0.11 118.68 123.35 2jwz s LEU 43 Ca -0.02 0.56 0.07 0.00 -1.03 0.00 0.00 54.13 53.72 2jwz s LEU 43 Cb -0.14 -2.64 -0.03 0.00 0.03 0.00 0.00 46.19 43.41 2jwz s LEU 43 CO -0.06 -0.21 -0.20 -0.51 0.23 0.00 0.00 176.35 175.61 2jwz s ILE 44 N 1.88 1.62 -0.08 -0.59 1.10 -0.86 -1.61 121.20 122.65 2jwz s ILE 44 Ca 0.21 -1.37 -0.01 0.00 -0.51 0.00 0.00 60.65 58.97 2jwz s ILE 44 Cb -0.15 -1.45 0.03 0.00 0.15 0.00 0.00 42.46 41.03 2jwz s ILE 44 CO 0.09 0.03 0.00 0.12 -2.11 0.00 0.00 174.94 173.07 2jwz s PHE 45 N -1.02 0.72 -1.36 3.50 5.36 -0.73 -2.83 117.98 121.63 2jwz s PHE 45 Ca 0.06 -0.24 -0.12 0.00 -0.96 0.00 0.00 56.93 55.67 2jwz s PHE 45 Cb -0.09 -0.83 0.01 0.00 -0.34 0.00 0.00 43.02 41.76 2jwz s PHE 45 CO 0.03 -0.36 0.43 0.00 -1.46 0.00 0.00 175.22 173.86 2jwz n ALA 46 N 5.13 -2.25 -1.22 11.12 0.00 -1.26 -1.38 120.51 130.65 2jwz n ALA 46 Ca -0.07 -0.39 -0.08 0.00 0.00 0.00 0.00 53.44 52.90 2jwz n ALA 46 Cb 0.50 -2.01 -0.03 0.00 0.00 0.00 0.00 19.45 17.91 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 -2.14 0.95 3.26 0.00 0.00 -1.26 -5.03 105.19 100.99 2jwz n GLY 47 Ca -0.23 -0.49 -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 -2.45 1.62 -0.15 1.61 1.02 -0.48 -5.13 119.74 115.78 2jwz s LYS 48 Ca 0.00 -0.91 -0.12 0.00 0.02 0.00 0.00 55.97 54.95 2jwz s LYS 48 Cb 0.00 -1.68 -0.05 0.00 -0.52 0.00 0.00 37.83 35.59 2jwz s LYS 48 CO 0.00 0.44 0.25 -1.14 -0.92 0.00 0.00 175.35 173.99 2jwz s GLN 49 N -0.93 4.15 0.02 1.68 -0.44 -1.26 -1.78 119.66 121.09 2jwz s GLN 49 Ca 0.09 0.03 -0.25 0.00 -2.50 0.00 0.00 55.36 52.73 2jwz s GLN 49 Cb -0.09 -3.39 -0.05 0.00 -1.64 0.00 0.00 33.01 27.84 2jwz s GLN 49 CO 0.01 0.33 0.77 -0.51 0.50 0.00 0.00 175.29 176.39 2jwz s LEU 50 N 0.21 4.41 -0.26 3.68 1.43 -0.64 -5.02 118.68 122.49 2jwz s LEU 50 Ca 0.15 1.41 -0.10 0.00 -1.03 0.00 0.00 54.13 54.56 2jwz s LEU 50 Cb -0.13 -3.23 -0.04 0.00 0.03 0.00 0.00 46.19 42.82 2jwz s LEU 50 CO 0.03 -0.04 0.14 -0.70 0.23 0.00 0.00 176.35 176.02 2jwz s GLU 51 N 0.23 3.90 0.59 1.70 -6.30 -1.26 -4.67 118.70 112.90 2jwz s GLU 51 Ca 0.39 -0.35 0.33 0.00 -2.50 0.00 0.00 54.97 52.84 2jwz s GLU 51 Cb -0.20 -3.51 1.16 0.00 0.00 0.00 0.00 34.13 31.57 2jwz s GLU 51 CO 0.22 -0.10 1.40 -0.44 0.02 0.00 0.00 175.26 176.36 2jwz h ASP 52 N 8.02 0.00 0.63 -1.70 3.32 -1.96 0.18 116.42 124.91 2jwz h ASP 52 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2jwz h ASP 52 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2jwz h ASP 52 CO 0.59 0.00 -0.26 0.61 -1.72 0.00 0.00 179.24 178.47 2jwz n GLY 53 N -1.77 -1.25 3.89 2.75 0.00 -1.26 -1.69 105.19 105.86 2jwz n GLY 53 Ca 0.28 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.89 3.67 0.22 1.61 3.00 0.63 -4.87 118.95 120.32 2jwz s ARG 54 Ca 0.16 0.03 -0.06 0.00 -1.00 0.00 0.00 55.73 54.86 2jwz s ARG 54 Cb 0.19 -2.72 -0.06 0.00 0.00 0.00 0.00 34.95 32.36 2jwz s ARG 54 CO 0.60 0.33 0.50 0.95 0.00 0.00 0.00 175.30 177.68 2jwz s THR 55 N -1.86 5.03 0.34 4.11 -4.23 -1.26 -3.44 115.64 114.32 2jwz s THR 55 Ca 0.44 0.19 0.38 0.00 -1.18 0.00 0.00 61.69 61.52 2jwz s THR 55 Cb -0.11 -3.66 0.41 0.00 1.34 0.00 0.00 72.50 70.48 2jwz s THR 55 CO 0.26 -0.13 2.15 0.17 -0.54 0.00 0.00 174.62 176.53 2jwz h LEU 56 N 2.32 0.00 -0.27 4.79 8.10 -1.77 -2.86 115.31 125.62 2jwz h LEU 56 Ca -0.47 0.00 -0.09 0.00 0.11 0.00 0.00 57.88 57.43 2jwz h LEU 56 Cb 1.18 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.39 2jwz h LEU 56 CO 0.69 0.00 -0.17 -1.28 -4.11 0.00 0.00 178.44 173.57 2jwz h SER 57 N 0.00 0.62 0.28 0.17 0.87 -1.88 -2.65 113.55 110.95 2jwz h SER 57 Ca 0.00 -0.43 -0.01 0.00 -1.23 0.00 0.00 61.79 60.12 2jwz h SER 57 Cb 0.26 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2jwz h SER 57 CO 0.00 0.91 -0.07 0.44 -0.53 0.00 0.00 176.83 177.59 2jwz h ASP 58 N 0.33 0.00 -1.15 6.23 5.19 -1.83 -0.81 116.42 124.38 2jwz h ASP 58 Ca 0.06 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.91 2jwz h ASP 58 Cb 0.70 0.00 -0.21 0.00 0.18 0.00 0.00 39.33 40.00 2jwz h ASP 58 CO 0.05 0.07 0.63 0.00 -3.12 0.00 0.00 179.24 176.86 2jwz n TYR 59 N -3.56 2.16 0.00 4.55 4.19 -1.00 -4.90 117.16 118.61 2jwz n TYR 59 Ca -0.02 -2.21 0.00 0.00 3.31 0.00 0.00 57.90 58.98 2jwz n TYR 59 Cb 0.18 -1.26 0.00 0.00 0.49 0.00 0.00 39.34 38.75 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 -4.71 2.98 2.04 -0.31 -4.77 115.26 110.64 2jwz n ASN 60 Ca 0.48 0.00 -0.42 0.00 -0.44 0.00 0.00 54.58 54.20 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 3.34 0.55 1.53 1.01 -1.25 -5.01 121.20 121.38 2jwz s ILE 61 Ca 0.00 0.92 0.04 0.00 0.00 0.00 0.00 60.65 61.61 2jwz s ILE 61 Cb 0.00 -3.59 0.06 0.00 0.01 0.00 0.00 42.46 38.94 2jwz s ILE 61 CO 0.00 0.05 0.76 -1.10 0.00 0.00 0.00 174.94 174.66 2jwz s GLN 62 N 1.45 2.41 0.28 2.79 1.11 -1.26 -4.83 119.66 121.60 2jwz s GLN 62 Ca 0.65 -1.15 -0.28 0.00 0.01 0.00 0.00 55.36 54.59 2jwz s GLN 62 Cb -0.36 -2.57 -0.14 0.00 -1.01 0.00 0.00 33.01 28.93 2jwz s GLN 62 CO 0.30 -0.76 0.94 0.36 0.01 0.00 0.00 175.29 176.14 2jwz n LYS 63 N -2.28 1.16 -2.24 2.91 -0.00 -1.26 -3.66 118.16 112.78 2jwz n LYS 63 Ca 0.11 0.41 0.00 0.00 -0.00 0.00 0.00 58.31 58.83 2jwz n LYS 63 Cb 0.60 -1.73 0.00 0.00 -0.00 0.00 0.00 35.03 33.91 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 0.00 -3.25 -1.58 4.07 -0.73 -5.04 120.64 114.89 2jwz n GLU 64 Ca 0.11 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.87 2jwz n GLU 64 Cb 0.31 -3.01 -0.06 0.00 -0.06 0.00 0.00 31.44 28.62 2jwz n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2jwz s SER 65 N -3.00 6.84 -0.23 4.31 0.01 -1.24 -4.92 113.70 115.47 2jwz s SER 65 Ca 0.00 1.18 -0.06 0.00 1.31 0.00 0.00 55.95 58.39 2jwz s SER 65 Cb 0.00 -2.33 -0.02 0.00 0.21 0.00 0.00 66.02 63.88 2jwz s SER 65 CO 0.00 -0.01 0.01 -0.89 0.41 0.00 0.00 173.24 172.76 2jwz s THR 66 N -1.66 3.89 0.13 1.44 2.01 -1.26 -2.30 115.64 117.89 2jwz s THR 66 Ca 0.44 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.18 2jwz s THR 66 Cb -0.14 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.54 2jwz s THR 66 CO 0.20 0.39 0.03 -0.76 -0.69 0.00 0.00 174.62 173.78 2jwz s LEU 67 N 1.43 3.49 -0.27 4.42 1.43 -1.03 -4.95 118.68 123.19 2jwz s LEU 67 Ca 0.05 -0.23 -0.10 0.00 -1.03 0.00 0.00 54.13 52.82 2jwz s LEU 67 Cb -0.15 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 2jwz s LEU 67 CO 0.01 0.13 0.16 -2.28 0.23 0.00 0.00 176.35 174.60 2jwz s HIS 68 N -1.52 3.19 -0.16 0.29 2.46 -1.13 -3.60 115.29 114.82 2jwz s HIS 68 Ca 0.27 -0.01 -0.22 0.00 0.47 0.00 0.00 55.06 55.58 2jwz s HIS 68 Cb -0.11 -2.35 -0.03 0.00 -0.13 0.00 0.00 32.58 29.97 2jwz s HIS 68 CO 0.19 -0.21 0.67 0.45 -2.47 0.00 0.00 174.74 173.38 2jwz s SER 69 N 1.72 6.79 0.17 9.88 0.15 -1.24 -2.03 113.70 129.13 2jwz s SER 69 Ca 0.07 0.96 0.08 0.00 0.70 0.00 0.00 55.95 57.76 2jwz s SER 69 Cb -0.16 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2jwz s SER 69 CO 0.09 -0.25 -0.16 0.68 1.20 0.00 0.00 173.24 174.80 2jwz s VAL 70 N 1.68 1.67 0.19 4.45 -7.23 0.31 -4.73 120.40 116.74 2jwz s VAL 70 Ca 0.32 -1.96 -0.11 0.00 -1.81 0.00 0.00 61.98 58.43 2jwz s VAL 70 Cb -0.16 -1.83 -0.07 0.00 0.56 0.00 0.00 36.38 34.88 2jwz s VAL 70 CO 0.12 -0.43 0.53 -0.76 -0.31 0.00 0.00 175.10 174.25 2jwz s LEU 71 N -2.81 4.23 0.11 1.32 1.02 -1.26 0.14 118.68 121.42 2jwz s LEU 71 Ca 0.16 0.93 0.10 0.00 0.02 0.00 0.00 54.13 55.34 2jwz s LEU 71 Cb -0.04 -3.50 -0.04 0.00 0.02 0.00 0.00 46.19 42.63 2jwz s LEU 71 CO 0.06 -0.00 -0.24 -0.13 0.02 0.00 0.00 176.35 176.05 2jwz s ARG 72 N -2.52 1.30 0.00 1.70 0.52 -1.26 -4.95 118.95 113.74 2jwz s ARG 72 Ca 0.43 -1.24 0.00 0.00 -0.52 0.00 0.00 55.73 54.40 2jwz s ARG 72 Cb -0.12 -1.67 0.00 0.00 0.52 0.00 0.00 34.95 33.68 2jwz s ARG 72 CO 0.21 0.39 0.00 1.28 0.02 0.00 0.00 175.30 177.20 2jwz n LEU 73 N 1.06 0.63 0.00 2.53 4.77 -1.26 -4.98 117.00 119.75 2jwz n LEU 73 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 2jwz n LEU 73 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2jwz n LEU 73 CO 0.23 0.01 0.00 -1.14 -1.33 0.00 0.00 177.39 175.15 2jwz n ARG 74 N -2.68 0.00 -0.89 3.23 0.63 -1.26 -5.15 116.66 110.54 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 0.36 -0.17 0.00 0.00 0.45 0.00 0.00 32.46 33.10 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 -3.24 0.00 5.14 0.00 -1.26 -5.34 105.19 100.48 2jwz n GLY 75 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2jwz n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93