#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jw4 s SER 2 N 0.00 5.52 0.40 1.61 0.01 -1.26 -5.07 113.70 114.90 2jw4 s SER 2 Ca 0.00 -3.35 -0.27 0.00 1.31 0.00 0.00 55.95 53.63 2jw4 s SER 2 Cb 0.00 -1.85 -0.10 0.00 0.21 0.00 0.00 66.02 64.28 2jw4 s SER 2 CO 0.00 -0.25 1.43 -0.89 0.41 0.00 0.00 173.24 173.94 2jw4 s THR 3 N -0.79 2.18 0.56 1.44 2.01 -1.26 -4.90 115.64 114.88 2jw4 s THR 3 Ca 0.22 0.18 -0.15 0.00 0.31 0.00 0.00 61.69 62.25 2jw4 s THR 3 Cb -0.13 -3.11 -0.13 0.00 0.01 0.00 0.00 72.50 69.14 2jw4 s THR 3 CO -0.09 0.04 -0.29 0.23 -0.69 0.00 0.00 174.62 173.82 2jw4 n MET 4 N 0.28 0.00 0.09 4.92 0.00 -1.26 -4.92 117.12 116.23 2jw4 n MET 4 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.68 2jw4 n MET 4 Cb 0.41 -0.85 -0.02 0.00 0.00 0.00 0.00 33.22 32.75 2jw4 n MET 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jw4 h ALA 5 N -0.27 -0.52 -6.75 3.04 0.00 -2.06 -3.46 119.26 109.25 2jw4 h ALA 5 Ca -0.36 -0.06 -0.51 0.00 0.00 0.00 0.00 54.91 53.99 2jw4 h ALA 5 Cb 1.20 0.10 -0.16 0.00 0.00 0.00 0.00 17.79 18.93 2jw4 h ALA 5 CO 0.31 -0.50 -0.80 -1.91 0.00 0.00 0.00 179.25 176.35 2jw4 n GLU 6 N -3.35 -0.89 -1.75 0.00 2.13 -1.26 -4.89 120.64 110.63 2jw4 n GLU 6 Ca -0.03 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.85 2jw4 n GLU 6 Cb 0.10 -2.83 0.00 0.00 0.27 0.00 0.00 31.44 28.98 2jw4 n GLU 6 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2jw4 n GLU 7 N -3.98 0.78 -4.06 5.31 2.13 -1.26 -5.14 120.64 114.41 2jw4 n GLU 7 Ca -0.25 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.25 2jw4 n GLU 7 Cb 0.56 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.12 2jw4 n GLU 7 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2jw4 s VAL 8 N -1.48 2.01 -0.01 6.31 1.01 -1.26 -5.09 120.40 121.89 2jw4 s VAL 8 Ca 0.00 -1.34 0.06 0.00 0.00 0.00 0.00 61.98 60.70 2jw4 s VAL 8 Cb 0.00 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 2jw4 s VAL 8 CO 0.00 0.14 -0.18 0.54 0.00 0.00 0.00 175.10 175.60 2jw4 s VAL 9 N 1.21 1.42 -0.00 2.92 0.11 -1.26 0.54 120.40 125.33 2jw4 s VAL 9 Ca -0.04 -0.77 0.06 0.00 -2.93 0.00 0.00 61.98 58.30 2jw4 s VAL 9 Cb -0.18 -1.18 -0.02 0.00 -1.53 0.00 0.00 36.38 33.48 2jw4 s VAL 9 CO -0.08 0.40 -0.18 0.68 -3.33 0.00 0.00 175.10 172.60 2jw4 s VAL 10 N -0.42 1.38 0.02 2.04 -7.23 0.17 -2.57 120.40 113.80 2jw4 s VAL 10 Ca 0.07 -0.81 -0.00 0.00 -1.81 0.00 0.00 61.98 59.42 2jw4 s VAL 10 Cb -0.07 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 2jw4 s VAL 10 CO -0.01 0.34 0.14 0.54 -0.31 0.00 0.00 175.10 175.80 2jw4 s VAL 11 N -0.49 5.08 0.09 1.32 0.11 0.24 0.23 120.40 126.98 2jw4 s VAL 11 Ca 0.06 -0.39 -0.22 0.00 -2.93 0.00 0.00 61.98 58.51 2jw4 s VAL 11 Cb -0.07 -3.40 -0.07 0.00 -1.53 0.00 0.00 36.38 31.31 2jw4 s VAL 11 CO -0.00 0.25 0.65 0.00 -3.33 0.00 0.00 175.10 172.67 2jw4 s ALA 12 N -1.34 3.52 -0.16 1.54 0.00 0.10 -2.04 121.76 123.38 2jw4 s ALA 12 Ca 0.28 0.16 0.15 0.00 0.00 0.00 0.00 51.96 52.55 2jw4 s ALA 12 Cb -0.12 -2.77 -0.21 0.00 0.00 0.00 0.00 23.12 20.01 2jw4 s ALA 12 CO 0.20 0.32 0.07 1.63 0.00 0.00 0.00 175.76 177.99 2jw4 n LYS 13 N 1.85 1.23 -4.33 0.00 5.02 0.36 -0.95 118.16 121.34 2jw4 n LYS 13 Ca -0.08 -0.02 -0.17 0.00 -2.02 0.00 0.00 58.31 56.03 2jw4 n LYS 13 Cb 0.50 -1.43 -0.10 0.00 -0.02 0.00 0.00 35.03 33.98 2jw4 n LYS 13 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2jw4 s PHE 14 N -2.44 1.55 0.10 2.13 0.40 -1.25 -4.31 117.98 114.16 2jw4 s PHE 14 Ca -0.08 -0.93 -0.25 0.00 -0.60 0.00 0.00 56.93 55.08 2jw4 s PHE 14 Cb 0.05 -0.90 -0.07 0.00 0.51 0.00 0.00 43.02 42.62 2jw4 s PHE 14 CO 0.69 -0.05 0.75 0.16 0.70 0.00 0.00 175.22 177.48 2jw4 s ASP 15 N -3.30 7.28 0.02 1.36 -4.77 -1.26 -3.75 116.67 112.25 2jw4 s ASP 15 Ca 0.28 1.53 0.00 0.00 -3.30 0.00 0.00 52.55 51.06 2jw4 s ASP 15 Cb 0.06 -2.47 -0.02 0.00 -1.09 0.00 0.00 42.92 39.39 2jw4 s ASP 15 CO 0.09 0.13 -0.03 -0.47 0.70 0.00 0.00 175.17 175.58 2jw4 s TYR 16 N -0.67 0.28 -0.32 2.11 5.04 -1.25 -4.94 117.35 117.61 2jw4 s TYR 16 Ca 0.36 -0.48 -0.03 0.00 -2.44 0.00 0.00 57.07 54.48 2jw4 s TYR 16 Cb -0.22 -0.20 0.05 0.00 0.35 0.00 0.00 41.96 41.94 2jw4 s TYR 16 CO 0.24 -0.16 0.04 0.08 -1.34 0.00 0.00 175.55 174.41 2jw4 s VAL 17 N -1.31 3.25 -0.78 3.14 1.01 -1.26 -2.90 120.40 121.55 2jw4 s VAL 17 Ca -0.14 -1.33 -0.17 0.00 0.00 0.00 0.00 61.98 60.34 2jw4 s VAL 17 Cb -0.09 -2.87 -0.19 0.00 0.00 0.00 0.00 36.38 33.23 2jw4 s VAL 17 CO -0.01 -0.15 2.04 0.00 0.00 0.00 0.00 175.10 176.98 2jw4 n ALA 18 N 4.68 0.56 -0.15 5.51 0.00 -1.26 -4.76 120.51 125.10 2jw4 n ALA 18 Ca -0.13 -1.33 -0.11 0.00 0.00 0.00 0.00 53.44 51.88 2jw4 n ALA 18 Cb 0.44 -2.57 -0.08 0.00 0.00 0.00 0.00 19.45 17.24 2jw4 n ALA 18 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2jw4 h GLN 19 N 11.37 -0.25 -7.04 0.00 1.08 -1.92 -3.41 115.11 114.95 2jw4 h GLN 19 Ca 0.01 0.02 -0.47 0.00 -1.45 0.00 0.00 58.65 56.76 2jw4 h GLN 19 Cb 1.04 0.06 0.01 0.00 -0.05 0.00 0.00 27.48 28.54 2jw4 h GLN 19 CO 1.18 -0.17 0.38 -1.14 -0.95 0.00 0.00 178.83 178.13 2jw4 s GLN 20 N -5.06 3.99 0.57 1.46 0.74 -1.26 -4.93 119.66 115.17 2jw4 s GLN 20 Ca -0.11 1.33 0.31 0.00 0.05 0.00 0.00 55.36 56.94 2jw4 s GLN 20 Cb 0.07 -2.22 1.72 0.00 1.10 0.00 0.00 33.01 33.68 2jw4 s GLN 20 CO 0.48 -0.26 2.19 1.05 -0.55 0.00 0.00 175.29 178.20 2jw4 h GLU 21 N 1.87 0.00 0.00 1.67 -0.00 -2.02 -1.46 114.58 114.64 2jw4 h GLU 21 Ca -0.49 0.00 -0.18 0.00 -0.00 0.00 0.00 59.36 58.69 2jw4 h GLU 21 Cb 1.21 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.93 2jw4 h GLU 21 CO 0.60 0.05 -0.86 0.37 -0.00 0.00 0.00 179.01 179.18 2jw4 h GLN 22 N 0.00 0.01 -7.32 1.06 4.15 -1.91 -3.46 115.11 107.64 2jw4 h GLN 22 Ca -0.00 -0.01 -0.49 0.00 0.77 0.00 0.00 58.65 58.92 2jw4 h GLN 22 Cb 0.16 0.00 0.15 0.00 0.21 0.00 0.00 27.48 28.00 2jw4 h GLN 22 CO 0.01 0.86 0.25 -1.21 -1.93 0.00 0.00 178.83 176.81 2jw4 s GLU 23 N -3.06 1.35 0.01 1.69 2.02 -0.55 -3.13 118.70 117.03 2jw4 s GLU 23 Ca -0.00 0.94 0.03 0.00 0.02 0.00 0.00 54.97 55.97 2jw4 s GLU 23 Cb 0.11 -1.81 -0.03 0.00 0.10 0.00 0.00 34.13 32.50 2jw4 s GLU 23 CO 0.80 -2.21 -0.07 -1.17 0.02 0.00 0.00 175.26 172.63 2jw4 s LEU 24 N -6.23 3.14 0.15 1.80 0.20 -1.25 -4.67 118.68 111.83 2jw4 s LEU 24 Ca 0.63 -0.16 -0.27 0.00 0.69 0.00 0.00 54.13 55.02 2jw4 s LEU 24 Cb -0.18 -1.80 -0.07 0.00 -0.43 0.00 0.00 46.19 43.70 2jw4 s LEU 24 CO 0.57 0.28 0.83 1.51 -0.29 0.00 0.00 176.35 179.25 2jw4 s ASP 25 N -1.43 7.42 0.51 3.68 -4.77 -1.26 -4.07 116.67 116.74 2jw4 s ASP 25 Ca 0.17 1.69 0.01 0.00 -3.30 0.00 0.00 52.55 51.12 2jw4 s ASP 25 Cb -0.11 -2.53 -0.01 0.00 -1.09 0.00 0.00 42.92 39.18 2jw4 s ASP 25 CO 0.07 0.13 0.02 0.27 0.70 0.00 0.00 175.17 176.36 2jw4 s ILE 26 N -0.80 1.04 -0.15 2.11 -4.36 -1.14 -4.98 121.20 112.92 2jw4 s ILE 26 Ca 0.39 -2.00 -0.16 0.00 -0.26 0.00 0.00 60.65 58.62 2jw4 s ILE 26 Cb -0.23 -2.12 0.04 0.00 1.25 0.00 0.00 42.46 41.40 2jw4 s ILE 26 CO 0.27 0.00 0.44 -0.75 0.24 0.00 0.00 174.94 175.14 2jw4 s LYS 27 N -3.87 0.54 -0.36 0.37 2.47 -1.26 -3.97 119.74 113.66 2jw4 s LYS 27 Ca 0.06 0.55 -0.41 0.00 -1.56 0.00 0.00 55.97 54.60 2jw4 s LYS 27 Cb 0.01 0.26 -0.16 0.00 -1.46 0.00 0.00 37.83 36.48 2jw4 s LYS 27 CO 0.03 -0.08 1.83 1.17 0.16 0.00 0.00 175.35 178.46 2jw4 n LYS 28 N 2.69 0.79 -2.36 4.03 4.81 -1.25 0.19 118.16 127.06 2jw4 n LYS 28 Ca -0.14 0.28 -0.04 0.00 -0.87 0.00 0.00 58.31 57.54 2jw4 n LYS 28 Cb 0.57 -1.97 0.01 0.00 0.02 0.00 0.00 35.03 33.65 2jw4 n LYS 28 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2jw4 n ASN 29 N 6.00 -2.22 -4.42 3.14 2.85 -0.13 -4.96 115.26 115.51 2jw4 n ASN 29 Ca 0.33 -0.04 -0.36 0.00 -0.11 0.00 0.00 54.58 54.39 2jw4 n ASN 29 Cb 0.09 -1.21 -0.13 0.00 1.24 0.00 0.00 39.78 39.77 2jw4 n ASN 29 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 2jw4 s GLU 30 N -4.67 3.56 0.12 1.20 2.12 0.13 -4.85 118.70 116.31 2jw4 s GLU 30 Ca 0.05 -0.54 -0.30 0.00 0.36 0.00 0.00 54.97 54.53 2jw4 s GLU 30 Cb -0.02 -3.30 -0.06 0.00 0.26 0.00 0.00 34.13 31.00 2jw4 s GLU 30 CO 0.06 -0.22 1.09 1.03 -0.54 0.00 0.00 175.26 176.67 2jw4 s ARG 31 N 1.59 4.57 0.02 4.30 1.81 -1.26 0.03 118.95 130.00 2jw4 s ARG 31 Ca 0.06 1.65 0.03 0.00 -1.72 0.00 0.00 55.73 55.75 2jw4 s ARG 31 Cb -0.15 -3.33 -0.01 0.00 -0.45 0.00 0.00 34.95 31.00 2jw4 s ARG 31 CO 0.03 0.01 -0.09 -0.51 -0.68 0.00 0.00 175.30 174.06 2jw4 s LEU 32 N 0.16 2.13 -0.10 2.53 1.43 0.14 -4.74 118.68 120.22 2jw4 s LEU 32 Ca 0.51 -0.34 -0.19 0.00 -1.03 0.00 0.00 54.13 53.09 2jw4 s LEU 32 Cb -0.28 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 2jw4 s LEU 32 CO 0.32 -0.02 0.52 0.26 0.23 0.00 0.00 176.35 177.66 2jw4 s TRP 33 N -0.70 3.54 -0.16 0.29 0.51 -0.88 0.43 118.94 121.97 2jw4 s TRP 33 Ca -0.02 0.97 -0.25 0.00 -2.12 0.00 0.00 56.10 54.69 2jw4 s TRP 33 Cb -0.06 -2.58 -0.02 0.00 -0.81 0.00 0.00 33.47 30.00 2jw4 s TRP 33 CO 0.00 0.19 0.80 -1.17 -0.51 0.00 0.00 176.95 176.26 2jw4 s LEU 34 N 0.53 4.19 -0.14 2.99 2.96 0.19 0.85 118.68 130.25 2jw4 s LEU 34 Ca 0.28 1.15 -0.10 0.00 -0.22 0.00 0.00 54.13 55.24 2jw4 s LEU 34 Cb -0.16 -3.19 -0.06 0.00 0.50 0.00 0.00 46.19 43.28 2jw4 s LEU 34 CO 0.12 -0.36 -0.23 0.18 -1.32 0.00 0.00 176.35 174.74 2jw4 n LEU 35 N 5.05 1.42 -3.79 -0.68 4.77 -0.67 -4.48 117.00 118.62 2jw4 n LEU 35 Ca 0.03 0.24 -0.28 0.00 -0.03 0.00 0.00 56.01 55.97 2jw4 n LEU 35 Cb 0.49 -0.56 -0.16 0.00 -2.33 0.00 0.00 43.42 40.86 2jw4 n LEU 35 CO 0.48 0.03 -0.38 -1.81 -1.33 0.00 0.00 177.39 174.38 2jw4 s ASP 36 N -6.34 3.06 -0.27 -1.43 1.11 -1.11 -4.99 116.67 106.69 2jw4 s ASP 36 Ca -0.22 -0.86 0.08 0.00 0.18 0.00 0.00 52.55 51.73 2jw4 s ASP 36 Cb 0.07 -0.74 0.45 0.00 1.07 0.00 0.00 42.92 43.76 2jw4 s ASP 36 CO 0.30 -0.28 1.27 -0.90 1.18 0.00 0.00 175.17 176.75 2jw4 n ASP 37 N 4.96 3.44 -0.08 0.27 5.68 -1.26 0.27 116.55 129.82 2jw4 n ASP 37 Ca -0.10 -3.82 -0.23 0.00 -0.50 0.00 0.00 54.79 50.14 2jw4 n ASP 37 Cb 0.47 -0.48 -0.12 0.00 -1.14 0.00 0.00 41.12 39.84 2jw4 n ASP 37 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 2jw4 n SER 38 N -0.94 1.99 -4.81 -1.12 2.88 -1.26 -4.95 113.62 105.41 2jw4 n SER 38 Ca 0.33 0.23 -0.33 0.00 -1.33 0.00 0.00 58.87 57.78 2jw4 n SER 38 Cb 0.85 -0.80 -0.01 0.00 -0.75 0.00 0.00 64.21 63.51 2jw4 n SER 38 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2jw4 s LYS 39 N -2.48 3.53 0.21 -1.46 -0.14 -1.26 -4.91 119.74 113.23 2jw4 s LYS 39 Ca -0.30 1.20 -0.03 0.00 -1.36 0.00 0.00 55.97 55.48 2jw4 s LYS 39 Cb 0.09 -2.06 0.43 0.00 -1.68 0.00 0.00 37.83 34.60 2jw4 s LYS 39 CO 0.63 -0.64 1.13 0.45 -0.76 0.00 0.00 175.35 176.16 2jw4 n SER 40 N -1.71 -0.19 -4.70 2.83 2.88 -1.26 -3.96 113.62 107.51 2jw4 n SER 40 Ca 0.09 1.24 -0.40 0.00 -1.33 0.00 0.00 58.87 58.46 2jw4 n SER 40 Cb 0.53 -0.41 -0.05 0.00 -0.75 0.00 0.00 64.21 63.53 2jw4 n SER 40 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 2jw4 s TRP 41 N -5.79 3.52 -0.43 0.66 0.52 -1.26 -4.80 118.94 111.34 2jw4 s TRP 41 Ca -0.10 1.20 -0.28 0.00 0.02 0.00 0.00 56.10 56.93 2jw4 s TRP 41 Cb 0.20 -2.84 0.03 0.00 -1.15 0.00 0.00 33.47 29.71 2jw4 s TRP 41 CO 0.57 -0.01 1.09 -1.58 0.02 0.00 0.00 176.95 177.03 2jw4 s TRP 42 N 1.22 2.92 -0.06 -1.98 0.52 0.23 -4.68 118.94 117.10 2jw4 s TRP 42 Ca 0.36 0.80 -0.30 0.00 0.02 0.00 0.00 56.10 56.99 2jw4 s TRP 42 Cb -0.17 -4.18 -0.02 0.00 -1.15 0.00 0.00 33.47 27.95 2jw4 s TRP 42 CO 0.16 -1.11 1.04 0.50 0.02 0.00 0.00 176.95 177.55 2jw4 s ARG 43 N 4.15 4.45 0.33 4.98 3.52 0.14 -0.57 118.95 135.95 2jw4 s ARG 43 Ca 0.46 1.46 0.03 0.00 -0.13 0.00 0.00 55.73 57.55 2jw4 s ARG 43 Cb -0.09 -3.51 -0.05 0.00 -1.56 0.00 0.00 34.95 29.74 2jw4 s ARG 43 CO 0.27 -0.27 0.09 0.14 -0.81 0.00 0.00 175.30 174.72 2jw4 s VAL 44 N 1.75 0.85 0.19 7.11 -7.23 -0.45 -1.66 120.40 120.96 2jw4 s VAL 44 Ca 0.51 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.77 2jw4 s VAL 44 Cb -0.20 -2.64 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 2jw4 s VAL 44 CO 0.21 0.00 -0.19 -0.60 -0.31 0.00 0.00 175.10 174.21 2jw4 s ARG 45 N -3.89 1.40 0.28 4.82 3.52 0.25 -2.05 118.95 123.28 2jw4 s ARG 45 Ca 0.34 -1.51 0.11 0.00 -0.13 0.00 0.00 55.73 54.54 2jw4 s ARG 45 Cb 0.07 -1.50 -0.05 0.00 -1.56 0.00 0.00 34.95 31.91 2jw4 s ARG 45 CO 0.15 0.30 -0.14 1.21 -0.81 0.00 0.00 175.30 176.01 2jw4 s ASN 46 N -2.88 3.87 0.65 -2.12 3.84 0.66 -2.07 114.94 116.89 2jw4 s ASN 46 Ca 0.20 -0.93 0.33 0.00 0.21 0.00 0.00 52.86 52.67 2jw4 s ASN 46 Cb -0.06 -0.46 1.79 0.00 -0.55 0.00 0.00 41.25 41.98 2jw4 s ASN 46 CO 0.09 0.01 2.05 0.77 -2.79 0.00 0.00 177.10 177.23 2jw4 h SER 47 N 2.15 0.00 -0.02 -4.21 4.64 -1.87 0.44 113.55 114.67 2jw4 h SER 47 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2jw4 h SER 47 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2jw4 h SER 47 CO 0.61 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.80 2jw4 n MET 48 N -3.17 1.05 -0.44 4.77 2.81 -1.26 -4.83 117.12 116.06 2jw4 n MET 48 Ca -0.01 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 2jw4 n MET 48 Cb 0.33 -1.10 0.00 0.00 -0.71 0.00 0.00 33.22 31.74 2jw4 n MET 48 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2jw4 n ASN 49 N -0.52 0.00 -4.78 7.83 4.05 0.15 -4.98 115.26 117.02 2jw4 n ASN 49 Ca 0.05 0.00 -0.37 0.00 0.45 0.00 0.00 54.58 54.71 2jw4 n ASN 49 Cb 0.04 -0.53 -0.04 0.00 1.23 0.00 0.00 39.78 40.48 2jw4 n ASN 49 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2jw4 s LYS 50 N -0.13 4.21 0.03 1.20 1.02 -1.24 -4.78 119.74 120.04 2jw4 s LYS 50 Ca 0.00 1.54 0.03 0.00 0.02 0.00 0.00 55.97 57.56 2jw4 s LYS 50 Cb 0.00 -2.60 -0.02 0.00 -0.52 0.00 0.00 37.83 34.69 2jw4 s LYS 50 CO 0.00 -0.11 -0.10 0.99 -0.92 0.00 0.00 175.35 175.21 2jw4 s THR 51 N -1.61 0.77 0.36 2.17 2.01 -1.26 -0.25 115.64 117.83 2jw4 s THR 51 Ca 0.56 -0.79 -0.17 0.00 0.31 0.00 0.00 61.69 61.61 2jw4 s THR 51 Cb -0.23 -0.72 0.05 0.00 0.01 0.00 0.00 72.50 71.62 2jw4 s THR 51 CO 0.29 -0.05 0.81 -0.83 -0.69 0.00 0.00 174.62 174.14 2jw4 s GLY 52 N -0.94 0.31 -0.21 4.40 0.00 -0.87 -4.77 107.32 105.24 2jw4 s GLY 52 Ca -0.01 -0.68 -0.10 0.00 0.00 0.00 0.00 44.72 43.92 2jw4 s GLY 52 CO 0.01 -0.09 0.15 -1.36 0.00 0.00 0.00 173.10 171.81 2jw4 s PHE 53 N -2.41 3.38 0.02 1.90 0.08 -1.18 -1.34 117.98 118.43 2jw4 s PHE 53 Ca 0.16 0.32 -0.01 0.00 0.12 0.00 0.00 56.93 57.51 2jw4 s PHE 53 Cb -0.05 -2.21 -0.02 0.00 -0.57 0.00 0.00 43.02 40.18 2jw4 s PHE 53 CO 0.11 0.22 -0.00 0.14 -0.10 0.00 0.00 175.22 175.58 2jw4 s VAL 54 N 0.58 0.11 0.79 -0.44 -7.23 0.27 -3.76 120.40 110.72 2jw4 s VAL 54 Ca 0.08 -0.94 -0.11 0.00 -1.81 0.00 0.00 61.98 59.21 2jw4 s VAL 54 Cb -0.12 -0.39 0.07 0.00 0.56 0.00 0.00 36.38 36.50 2jw4 s VAL 54 CO 0.00 -0.52 1.09 -2.16 -0.31 0.00 0.00 175.10 173.21 2jw4 s PRO 55 N -1.65 2.13 -0.31 4.82 0.04 -1.26 0.76 135.00 139.53 2jw4 s PRO 55 Ca -0.14 1.12 0.02 0.00 0.04 0.00 0.00 61.00 62.05 2jw4 s PRO 55 Cb -0.08 -1.89 0.42 0.00 0.04 0.00 0.00 34.50 32.99 2jw4 s PRO 55 CO -0.01 -1.72 1.65 -1.13 0.04 0.00 0.00 177.00 175.83 2jw4 n SER 56 N -3.57 3.93 -0.04 6.66 3.41 -1.26 -3.97 113.62 118.78 2jw4 n SER 56 Ca 0.09 -3.08 0.01 0.00 -0.26 0.00 0.00 58.87 55.63 2jw4 n SER 56 Cb 0.53 -0.76 -0.13 0.00 -0.26 0.00 0.00 64.21 63.59 2jw4 n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jw4 n ASN 57 N -0.51 0.92 -0.05 4.04 4.13 -1.26 -4.53 115.26 118.01 2jw4 n ASN 57 Ca 0.39 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.65 2jw4 n ASN 57 Cb 1.18 1.41 -0.13 0.00 -1.54 0.00 0.00 39.78 40.70 2jw4 n ASN 57 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2jw4 n TYR 58 N -2.34 0.00 -4.32 3.10 4.02 -1.25 -4.94 117.16 111.43 2jw4 n TYR 58 Ca -0.14 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.52 2jw4 n TYR 58 Cb 0.72 -0.61 -0.08 0.00 -0.02 0.00 0.00 39.34 39.35 2jw4 n TYR 58 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2jw4 s VAL 59 N -2.78 3.09 -0.11 -0.72 -7.23 -1.26 -0.49 120.40 110.90 2jw4 s VAL 59 Ca -0.07 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 57.80 2jw4 s VAL 59 Cb 0.08 -2.75 0.10 0.00 0.56 0.00 0.00 36.38 34.36 2jw4 s VAL 59 CO 0.69 -0.33 0.83 -0.70 -0.31 0.00 0.00 175.10 175.29 2jw4 s GLU 60 N -3.67 0.84 0.29 4.82 2.56 -0.87 -4.72 118.70 117.95 2jw4 s GLU 60 Ca 0.32 0.23 -0.29 0.00 0.00 0.00 0.00 54.97 55.23 2jw4 s GLU 60 Cb -0.05 0.39 -0.10 0.00 2.00 0.00 0.00 34.13 36.37 2jw4 s GLU 60 CO 0.19 -0.25 1.45 -0.98 -0.56 0.00 0.00 175.26 175.11 2jw4 s ARG 61 N -1.08 4.23 0.00 4.30 1.70 -1.26 -0.60 118.95 126.25 2jw4 s ARG 61 Ca -0.06 2.37 0.00 0.00 -0.47 0.00 0.00 55.73 57.57 2jw4 s ARG 61 Cb -0.00 -3.07 0.00 0.00 -0.57 0.00 0.00 34.95 31.31 2jw4 s ARG 61 CO 0.06 -0.43 0.78 1.17 -1.08 0.00 0.00 175.30 175.79 2jw4 n LYS 62 N 1.75 0.00 -3.81 3.89 4.81 -1.06 -4.79 118.16 118.95 2jw4 n LYS 62 Ca 0.05 0.30 -0.32 0.00 -0.87 0.00 0.00 58.31 57.47 2jw4 n LYS 62 Cb 0.40 -1.29 -0.06 0.00 0.02 0.00 0.00 35.03 34.10 2jw4 n LYS 62 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2jw4 n ASN 63 N -1.40 -1.41 -4.65 3.14 2.85 -1.26 -4.81 115.26 107.72 2jw4 n ASN 63 Ca 0.00 -0.91 -0.42 0.00 -0.11 0.00 0.00 54.58 53.14 2jw4 n ASN 63 Cb 0.00 -1.24 -0.04 0.00 1.24 0.00 0.00 39.78 39.75 2jw4 n ASN 63 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2jw4 s SER 64 N -2.71 6.90 -0.59 1.20 1.04 -1.26 -4.93 113.70 113.34 2jw4 s SER 64 Ca 0.63 1.11 -0.01 0.00 0.48 0.00 0.00 55.95 58.15 2jw4 s SER 64 Cb -0.37 -2.47 0.45 0.00 0.10 0.00 0.00 66.02 63.73 2jw4 s SER 64 CO 0.77 -0.59 2.01 0.00 0.98 0.00 0.00 173.24 176.41 2jw4 n ALA 65 N 6.16 6.07 -2.83 5.32 0.00 -1.26 -4.92 120.51 129.04 2jw4 n ALA 65 Ca 0.08 -3.16 -0.32 0.00 0.00 0.00 0.00 53.44 50.04 2jw4 n ALA 65 Cb 0.47 -1.68 -0.15 0.00 0.00 0.00 0.00 19.45 18.09 2jw4 n ALA 65 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jw4 s ARG 66 N -3.49 2.87 0.08 0.00 0.52 -1.26 -5.02 118.95 112.66 2jw4 s ARG 66 Ca 0.59 -0.77 -0.00 0.00 -0.52 0.00 0.00 55.73 55.03 2jw4 s ARG 66 Cb 0.47 -2.39 -0.26 0.00 0.52 0.00 0.00 34.95 33.29 2jw4 s ARG 66 CO 0.01 0.37 1.16 0.00 0.02 0.00 0.00 175.30 176.86 2jw4 h ALA 67 N 6.16 0.21 0.09 2.13 0.00 -2.06 -3.37 119.26 122.41 2jw4 h ALA 67 Ca -0.32 -0.92 -0.00 0.00 0.00 0.00 0.00 54.91 53.67 2jw4 h ALA 67 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jw4 h ALA 67 CO 0.51 1.09 -0.04 0.00 0.00 0.00 0.00 179.25 180.80 2jw4 h ALA 68 N 0.73 -0.12 -0.94 0.00 0.00 -2.01 -3.44 119.26 113.47 2jw4 h ALA 68 Ca -0.10 -0.11 -0.62 0.00 0.00 0.00 0.00 54.91 54.08 2jw4 h ALA 68 Cb 1.91 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.72 2jw4 h ALA 68 CO 0.17 -0.12 1.49 0.00 0.00 0.00 0.00 179.25 180.79 2jw4 n ALA 69 N -2.73 0.88 -3.60 0.00 0.00 -1.26 -4.89 120.51 108.91 2jw4 n ALA 69 Ca -0.03 -0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.10 2jw4 n ALA 69 Cb 0.12 -2.57 -0.08 0.00 0.00 0.00 0.00 19.45 16.92 2jw4 n ALA 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jw4 s ASN 70 N 8.15 -0.75 0.00 0.00 4.22 -1.26 -4.83 114.94 120.47 2jw4 s ASN 70 Ca 1.12 1.32 0.00 0.00 -2.14 0.00 0.00 52.86 53.17 2jw4 s ASN 70 Cb -0.86 1.27 0.00 0.00 1.28 0.00 0.00 41.25 42.94 2jw4 s ASN 70 CO 0.47 -0.23 0.00 -1.54 -2.04 0.00 0.00 177.10 173.76 2jw4 n SER 71 N 3.52 -5.04 0.00 3.54 3.41 -1.26 -5.24 113.62 112.55 2jw4 n SER 71 Ca -0.17 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2jw4 n SER 71 Cb 0.57 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 2jw4 n SER 71 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64