#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jw4 n SER 2 N 0.00 0.00 -4.76 1.61 7.64 -1.26 -5.12 113.62 111.73 2jw4 n SER 2 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 2jw4 n SER 2 Cb 0.00 0.41 -0.01 0.00 -1.01 0.00 0.00 64.21 63.60 2jw4 n SER 2 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2jw4 n THR 3 N -2.37 1.42 -4.43 0.44 -1.04 -1.17 -4.64 114.28 102.50 2jw4 n THR 3 Ca 0.00 -0.35 -0.25 0.00 -2.04 0.00 0.00 64.05 61.41 2jw4 n THR 3 Cb 0.00 -1.97 -0.11 0.00 -1.82 0.00 0.00 70.33 66.44 2jw4 n THR 3 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 2jw4 s MET 4 N -1.15 1.56 0.12 -2.82 1.00 -1.26 -5.08 119.30 111.68 2jw4 s MET 4 Ca 0.60 -1.62 -0.13 0.00 0.00 0.00 0.00 55.69 54.54 2jw4 s MET 4 Cb -0.49 -1.74 -0.07 0.00 0.00 0.00 0.00 34.83 32.53 2jw4 s MET 4 CO 0.55 0.35 0.50 0.00 0.00 0.00 0.00 175.02 176.42 2jw4 s ALA 5 N -2.11 3.63 -0.76 3.03 0.00 -1.26 -4.94 121.76 119.35 2jw4 s ALA 5 Ca 0.24 -0.21 -0.36 0.00 0.00 0.00 0.00 51.96 51.64 2jw4 s ALA 5 Cb -0.06 -2.44 -0.20 0.00 0.00 0.00 0.00 23.12 20.41 2jw4 s ALA 5 CO 0.12 0.49 2.39 0.39 0.00 0.00 0.00 175.76 179.15 2jw4 n GLU 6 N 0.86 0.00 -4.23 0.00 1.02 -1.26 -4.86 120.64 112.16 2jw4 n GLU 6 Ca -0.06 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.84 2jw4 n GLU 6 Cb 0.52 -1.46 -0.07 0.00 -0.02 0.00 0.00 31.44 30.41 2jw4 n GLU 6 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2jw4 n GLU 7 N 7.85 0.59 -4.16 3.49 1.02 -1.26 -5.17 120.64 122.99 2jw4 n GLU 7 Ca 0.60 -3.21 -0.16 0.00 -0.02 0.00 0.00 57.16 54.36 2jw4 n GLU 7 Cb -0.00 1.80 -0.12 0.00 -0.02 0.00 0.00 31.44 33.09 2jw4 n GLU 7 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2jw4 s VAL 8 N -3.00 0.73 -0.01 2.62 1.01 -1.24 -5.08 120.40 115.43 2jw4 s VAL 8 Ca 0.20 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.29 2jw4 s VAL 8 Cb 0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 2jw4 s VAL 8 CO 0.14 -0.18 -0.15 0.68 0.00 0.00 0.00 175.10 175.60 2jw4 s VAL 9 N -1.01 1.16 -0.01 2.92 -7.23 -1.26 0.13 120.40 115.09 2jw4 s VAL 9 Ca -0.04 -0.63 0.04 0.00 -1.81 0.00 0.00 61.98 59.54 2jw4 s VAL 9 Cb -0.08 -0.97 -0.01 0.00 0.56 0.00 0.00 36.38 35.88 2jw4 s VAL 9 CO 0.01 0.33 -0.12 0.68 -0.31 0.00 0.00 175.10 175.69 2jw4 s VAL 10 N -0.33 0.94 -0.02 1.32 -7.23 -0.33 -0.71 120.40 114.03 2jw4 s VAL 10 Ca 0.05 -0.49 0.01 0.00 -1.81 0.00 0.00 61.98 59.74 2jw4 s VAL 10 Cb -0.06 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 36.06 2jw4 s VAL 10 CO -0.01 0.27 0.00 0.54 -0.31 0.00 0.00 175.10 175.59 2jw4 s VAL 11 N -0.20 4.19 0.06 1.32 0.11 -0.17 -0.26 120.40 125.45 2jw4 s VAL 11 Ca 0.03 -0.51 -0.16 0.00 -2.93 0.00 0.00 61.98 58.41 2jw4 s VAL 11 Cb -0.05 -2.84 -0.06 0.00 -1.53 0.00 0.00 36.38 31.89 2jw4 s VAL 11 CO -0.00 0.43 0.49 0.00 -3.33 0.00 0.00 175.10 172.69 2jw4 s ALA 12 N -1.03 3.64 -0.58 1.54 0.00 0.81 -2.04 121.76 124.09 2jw4 s ALA 12 Ca 0.18 -0.12 0.17 0.00 0.00 0.00 0.00 51.96 52.18 2jw4 s ALA 12 Cb -0.11 -2.49 -0.20 0.00 0.00 0.00 0.00 23.12 20.31 2jw4 s ALA 12 CO 0.08 0.45 0.62 0.36 0.00 0.00 0.00 175.76 177.28 2jw4 n LYS 13 N 1.51 1.23 -4.21 0.00 2.85 0.20 -0.59 118.16 119.16 2jw4 n LYS 13 Ca -0.10 -0.04 -0.16 0.00 -1.05 0.00 0.00 58.31 56.95 2jw4 n LYS 13 Cb 0.52 -1.32 -0.07 0.00 -0.65 0.00 0.00 35.03 33.50 2jw4 n LYS 13 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2jw4 s PHE 14 N -2.74 1.41 -0.10 5.58 0.08 -1.26 -4.49 117.98 116.46 2jw4 s PHE 14 Ca 0.03 -1.48 -0.10 0.00 0.12 0.00 0.00 56.93 55.51 2jw4 s PHE 14 Cb 0.12 -0.50 -0.05 0.00 -0.57 0.00 0.00 43.02 42.03 2jw4 s PHE 14 CO 0.69 -0.89 0.22 0.16 -0.10 0.00 0.00 175.22 175.30 2jw4 s ASP 15 N -3.28 6.48 0.02 1.36 1.47 -1.26 -2.95 116.67 118.50 2jw4 s ASP 15 Ca 0.37 0.57 -0.01 0.00 1.18 0.00 0.00 52.55 54.66 2jw4 s ASP 15 Cb 0.03 -2.12 -0.02 0.00 -0.34 0.00 0.00 42.92 40.47 2jw4 s ASP 15 CO 0.22 0.35 -0.00 -0.47 0.68 0.00 0.00 175.17 175.94 2jw4 s TYR 16 N -0.82 0.20 -0.34 2.11 5.04 -1.26 -4.95 117.35 117.34 2jw4 s TYR 16 Ca 0.17 -0.42 -0.04 0.00 -2.44 0.00 0.00 57.07 54.34 2jw4 s TYR 16 Cb -0.13 -0.15 0.06 0.00 0.35 0.00 0.00 41.96 42.09 2jw4 s TYR 16 CO 0.06 -0.18 0.08 0.08 -1.34 0.00 0.00 175.55 174.24 2jw4 s VAL 17 N -1.30 3.31 -0.83 3.14 1.01 -1.26 -2.90 120.40 121.56 2jw4 s VAL 17 Ca -0.14 -1.44 -0.15 0.00 0.00 0.00 0.00 61.98 60.25 2jw4 s VAL 17 Cb -0.09 -2.97 -0.23 0.00 0.00 0.00 0.00 36.38 33.09 2jw4 s VAL 17 CO -0.01 -0.25 2.11 0.00 0.00 0.00 0.00 175.10 176.95 2jw4 n ALA 18 N 4.68 0.75 -0.07 5.51 0.00 -1.26 -4.76 120.51 125.36 2jw4 n ALA 18 Ca -0.11 -1.12 -0.11 0.00 0.00 0.00 0.00 53.44 52.11 2jw4 n ALA 18 Cb 0.43 -2.55 -0.07 0.00 0.00 0.00 0.00 19.45 17.26 2jw4 n ALA 18 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2jw4 h GLN 19 N 11.38 -0.33 -6.98 0.00 5.75 -1.92 -3.41 115.11 119.61 2jw4 h GLN 19 Ca 0.02 0.02 -0.49 0.00 -0.15 0.00 0.00 58.65 58.06 2jw4 h GLN 19 Cb 1.07 0.08 0.03 0.00 1.07 0.00 0.00 27.48 29.72 2jw4 h GLN 19 CO 1.32 -0.22 0.42 -1.14 -2.65 0.00 0.00 178.83 176.56 2jw4 s GLN 20 N -4.96 4.05 0.39 1.69 0.74 -1.26 -4.91 119.66 115.40 2jw4 s GLN 20 Ca -0.11 1.55 0.27 0.00 0.05 0.00 0.00 55.36 57.13 2jw4 s GLN 20 Cb 0.06 -2.47 1.41 0.00 1.10 0.00 0.00 33.01 33.10 2jw4 s GLN 20 CO 0.45 -0.25 1.84 1.05 -0.55 0.00 0.00 175.29 177.83 2jw4 h GLU 21 N 2.32 0.00 0.00 1.67 4.11 -2.02 -0.88 114.58 119.79 2jw4 h GLU 21 Ca -0.49 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.76 2jw4 h GLU 21 Cb 1.22 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 2jw4 h GLU 21 CO 0.62 0.00 -1.10 0.37 0.07 0.00 0.00 179.01 178.96 2jw4 h GLN 22 N 0.00 0.00 -7.38 1.06 5.75 -1.91 -3.47 115.11 109.17 2jw4 h GLN 22 Ca 0.00 0.00 -0.49 0.00 -0.15 0.00 0.00 58.65 58.01 2jw4 h GLN 22 Cb 0.10 0.00 0.12 0.00 1.07 0.00 0.00 27.48 28.77 2jw4 h GLN 22 CO 0.00 0.60 0.31 -1.21 -2.65 0.00 0.00 178.83 175.89 2jw4 s GLU 23 N -2.80 1.92 0.06 1.69 2.02 -0.34 -2.98 118.70 118.27 2jw4 s GLU 23 Ca -0.00 0.75 0.05 0.00 0.02 0.00 0.00 54.97 55.79 2jw4 s GLU 23 Cb 0.09 -1.89 -0.04 0.00 0.10 0.00 0.00 34.13 32.39 2jw4 s GLU 23 CO 0.80 -1.76 -0.07 -1.17 0.02 0.00 0.00 175.26 173.08 2jw4 s LEU 24 N -5.90 3.16 0.16 1.80 0.20 -1.23 -4.68 118.68 112.19 2jw4 s LEU 24 Ca 0.61 -0.24 -0.28 0.00 0.69 0.00 0.00 54.13 54.91 2jw4 s LEU 24 Cb -0.16 -1.88 -0.07 0.00 -0.43 0.00 0.00 46.19 43.65 2jw4 s LEU 24 CO 0.55 0.23 0.88 1.51 -0.29 0.00 0.00 176.35 179.23 2jw4 s ASP 25 N -1.85 7.48 0.53 3.68 1.47 -1.26 -4.05 116.67 122.67 2jw4 s ASP 25 Ca 0.20 1.76 0.02 0.00 1.18 0.00 0.00 52.55 55.71 2jw4 s ASP 25 Cb -0.11 -2.56 0.00 0.00 -0.34 0.00 0.00 42.92 39.91 2jw4 s ASP 25 CO 0.12 0.09 0.08 0.27 0.68 0.00 0.00 175.17 176.41 2jw4 s ILE 26 N -0.67 1.18 -0.08 2.11 -4.36 -1.14 -4.98 121.20 113.26 2jw4 s ILE 26 Ca 0.41 -1.90 -0.14 0.00 -0.26 0.00 0.00 60.65 58.76 2jw4 s ILE 26 Cb -0.24 -2.08 0.03 0.00 1.25 0.00 0.00 42.46 41.42 2jw4 s ILE 26 CO 0.29 0.00 0.36 -0.75 0.24 0.00 0.00 174.94 175.07 2jw4 s LYS 27 N -3.97 0.56 -0.17 0.37 2.47 -1.26 -4.05 119.74 113.69 2jw4 s LYS 27 Ca 0.09 0.20 -0.35 0.00 -1.56 0.00 0.00 55.97 54.35 2jw4 s LYS 27 Cb 0.00 0.26 -0.12 0.00 -1.46 0.00 0.00 37.83 36.51 2jw4 s LYS 27 CO 0.05 -0.12 1.94 1.17 0.16 0.00 0.00 175.35 178.56 2jw4 n LYS 28 N 2.12 1.84 -2.62 4.03 4.81 -1.15 -0.99 118.16 126.19 2jw4 n LYS 28 Ca -0.17 0.64 -0.04 0.00 -0.87 0.00 0.00 58.31 57.87 2jw4 n LYS 28 Cb 0.57 -2.59 0.01 0.00 0.02 0.00 0.00 35.03 33.04 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 7.41 -2.72 -4.48 3.14 2.85 0.24 -4.93 115.26 116.77 2jw4 n ASN 29 Ca 0.27 -0.09 -0.33 0.00 -0.11 0.00 0.00 54.58 54.31 2jw4 n ASN 29 Cb 0.27 -1.36 -0.13 0.00 1.24 0.00 0.00 39.78 39.80 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 -5.11 3.31 -0.24 1.20 2.12 -0.16 -4.88 118.70 114.94 2jw4 s GLU 30 Ca 0.10 -0.58 -0.17 0.00 0.36 0.00 0.00 54.97 54.67 2jw4 s GLU 30 Cb -0.04 -2.73 -0.03 0.00 0.26 0.00 0.00 34.13 31.59 2jw4 s GLU 30 CO 0.12 0.36 0.49 1.03 -0.54 0.00 0.00 175.26 176.71 2jw4 s ARG 31 N 0.02 4.11 0.16 4.30 1.81 -1.26 -0.14 118.95 127.95 2jw4 s ARG 31 Ca -0.01 0.30 0.10 0.00 -1.72 0.00 0.00 55.73 54.40 2jw4 s ARG 31 Cb -0.14 -3.61 -0.04 0.00 -0.45 0.00 0.00 34.95 30.71 2jw4 s ARG 31 CO 0.03 -0.25 -0.16 -0.51 -0.68 0.00 0.00 175.30 173.73 2jw4 s LEU 32 N 1.97 2.74 -0.39 2.53 2.01 0.63 -4.82 118.68 123.35 2jw4 s LEU 32 Ca 0.21 -0.65 -0.20 0.00 0.01 0.00 0.00 54.13 53.50 2jw4 s LEU 32 Cb -0.15 -1.49 0.01 0.00 0.01 0.00 0.00 46.19 44.56 2jw4 s LEU 32 CO 0.09 0.13 0.60 0.26 1.01 0.00 0.00 176.35 178.45 2jw4 s TRP 33 N -1.50 3.12 -0.05 0.29 0.51 -0.88 -1.19 118.94 119.24 2jw4 s TRP 33 Ca 0.21 0.11 -0.30 0.00 -2.12 0.00 0.00 56.10 54.01 2jw4 s TRP 33 Cb -0.09 -3.17 -0.04 0.00 -0.81 0.00 0.00 33.47 29.36 2jw4 s TRP 33 CO 0.12 -0.71 1.33 -1.17 -0.51 0.00 0.00 176.95 176.01 2jw4 s LEU 34 N 2.66 4.28 -0.19 2.99 2.96 0.12 0.52 118.68 132.02 2jw4 s LEU 34 Ca 0.22 1.95 -0.09 0.00 -0.22 0.00 0.00 54.13 55.99 2jw4 s LEU 34 Cb -0.15 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 42.91 2jw4 s LEU 34 CO 0.16 -0.70 -0.24 0.18 -1.32 0.00 0.00 176.35 174.43 2jw4 n LEU 35 N 5.66 1.42 -3.64 -0.68 4.77 -0.47 -3.71 117.00 120.34 2jw4 n LEU 35 Ca 0.13 0.22 -0.26 0.00 -0.03 0.00 0.00 56.01 56.07 2jw4 n LEU 35 Cb 0.45 -0.57 -0.17 0.00 -2.33 0.00 0.00 43.42 40.80 2jw4 n LEU 35 CO 0.57 0.42 -0.34 -1.81 -1.33 0.00 0.00 177.39 174.90 2jw4 s ASP 36 N -6.69 2.32 -0.27 -1.43 1.11 -0.91 -5.00 116.67 105.80 2jw4 s ASP 36 Ca -0.27 -0.58 0.09 0.00 0.18 0.00 0.00 52.55 51.97 2jw4 s ASP 36 Cb 0.10 -0.30 0.45 0.00 1.07 0.00 0.00 42.92 44.24 2jw4 s ASP 36 CO 0.34 -0.33 1.27 -0.90 1.18 0.00 0.00 175.17 176.73 2jw4 n ASP 37 N 5.24 3.19 -0.07 0.27 5.68 -1.26 0.45 116.55 130.05 2jw4 n ASP 37 Ca -0.07 -3.83 -0.22 0.00 -0.50 0.00 0.00 54.79 50.16 2jw4 n ASP 37 Cb 0.49 -0.49 -0.12 0.00 -1.14 0.00 0.00 41.12 39.85 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 -0.97 1.99 -4.81 -1.12 2.88 -1.26 -4.93 113.62 105.41 2jw4 n SER 38 Ca 0.32 0.26 -0.33 0.00 -1.33 0.00 0.00 58.87 57.79 2jw4 n SER 38 Cb 0.84 -0.84 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 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 3.57 0.24 -1.46 -0.14 -1.26 -4.90 119.74 113.32 2jw4 s LYS 39 Ca -0.28 1.19 0.07 0.00 -1.36 0.00 0.00 55.97 55.58 2jw4 s LYS 39 Cb 0.08 -2.07 0.72 0.00 -1.68 0.00 0.00 37.83 34.88 2jw4 s LYS 39 CO 0.65 -0.60 1.16 0.43 -0.76 0.00 0.00 175.35 176.22 2jw4 n SER 40 N -1.67 0.04 -4.69 2.83 7.64 -1.26 -3.92 113.62 112.58 2jw4 n SER 40 Ca 0.08 1.24 -0.39 0.00 1.01 0.00 0.00 58.87 60.81 2jw4 n SER 40 Cb 0.53 -0.51 -0.06 0.00 -1.01 0.00 0.00 64.21 63.16 2jw4 n SER 40 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2jw4 s TRP 41 N -5.45 3.45 -0.52 1.43 0.52 -1.26 -4.75 118.94 112.35 2jw4 s TRP 41 Ca -0.08 0.91 -0.28 0.00 0.02 0.00 0.00 56.10 56.67 2jw4 s TRP 41 Cb 0.23 -2.67 0.03 0.00 -1.15 0.00 0.00 33.47 29.91 2jw4 s TRP 41 CO 0.57 0.01 1.10 -1.58 0.02 0.00 0.00 176.95 177.07 2jw4 s TRP 42 N 1.21 2.75 -0.08 -1.98 0.52 0.34 -4.69 118.94 117.00 2jw4 s TRP 42 Ca 0.28 0.45 -0.30 0.00 0.02 0.00 0.00 56.10 56.55 2jw4 s TRP 42 Cb -0.16 -4.35 -0.02 0.00 -1.15 0.00 0.00 33.47 27.79 2jw4 s TRP 42 CO 0.11 -1.38 1.03 0.50 0.02 0.00 0.00 176.95 177.23 2jw4 s ARG 43 N 4.48 4.43 0.32 4.98 3.52 0.17 -1.12 118.95 135.73 2jw4 s ARG 43 Ca 0.42 1.44 0.03 0.00 -0.13 0.00 0.00 55.73 57.49 2jw4 s ARG 43 Cb -0.08 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 2jw4 s ARG 43 CO 0.27 -0.30 0.13 0.14 -0.81 0.00 0.00 175.30 174.73 2jw4 s VAL 44 N 1.91 0.50 0.21 7.11 -7.23 -0.91 -1.37 120.40 120.63 2jw4 s VAL 44 Ca 0.50 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.78 2jw4 s VAL 44 Cb -0.20 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.17 2jw4 s VAL 44 CO 0.20 0.00 -0.23 -0.60 -0.31 0.00 0.00 175.10 174.16 2jw4 s ARG 45 N -3.83 1.54 0.35 4.82 3.52 0.18 -2.15 118.95 123.38 2jw4 s ARG 45 Ca 0.34 -1.57 0.08 0.00 -0.13 0.00 0.00 55.73 54.45 2jw4 s ARG 45 Cb 0.05 -1.82 -0.04 0.00 -1.56 0.00 0.00 34.95 31.58 2jw4 s ARG 45 CO 0.16 0.38 0.14 1.21 -0.81 0.00 0.00 175.30 176.38 2jw4 s ASN 46 N -2.84 4.62 0.64 -2.12 3.84 0.82 -2.07 114.94 117.83 2jw4 s ASN 46 Ca 0.22 -0.82 0.41 0.00 0.21 0.00 0.00 52.86 52.89 2jw4 s ASN 46 Cb -0.07 -0.69 2.21 0.00 -0.55 0.00 0.00 41.25 42.15 2jw4 s ASN 46 CO 0.11 -0.32 2.31 0.77 -2.79 0.00 0.00 177.10 177.17 2jw4 h SER 47 N 1.55 0.00 -0.06 -4.21 4.64 -1.87 0.03 113.55 113.62 2jw4 h SER 47 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2jw4 h SER 47 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2jw4 h SER 47 CO 0.64 0.01 0.00 0.23 -0.87 0.00 0.00 176.83 176.84 2jw4 n MET 48 N -3.19 1.14 -0.50 4.77 2.81 -1.26 -4.83 117.12 116.07 2jw4 n MET 48 Ca -0.03 -0.22 0.00 0.00 -1.81 0.00 0.00 57.70 55.65 2jw4 n MET 48 Cb 0.11 -1.06 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 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 -0.31 0.00 -4.84 7.83 4.05 -0.00 -4.98 115.26 117.00 2jw4 n ASN 49 Ca 0.02 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.74 2jw4 n ASN 49 Cb 0.06 -0.59 0.02 0.00 1.23 0.00 0.00 39.78 40.49 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 -0.17 3.38 0.03 1.20 1.02 -1.25 -4.79 119.74 119.16 2jw4 s LYS 50 Ca 0.00 0.93 0.01 0.00 0.02 0.00 0.00 55.97 56.92 2jw4 s LYS 50 Cb 0.00 -2.05 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 2jw4 s LYS 50 CO 0.00 -0.75 -0.04 0.99 -0.92 0.00 0.00 175.35 174.63 2jw4 s THR 51 N -2.93 0.24 -0.03 2.17 2.01 -1.26 -0.13 115.64 115.71 2jw4 s THR 51 Ca 0.58 -0.92 -0.29 0.00 0.31 0.00 0.00 61.69 61.37 2jw4 s THR 51 Cb -0.13 -0.36 0.11 0.00 0.01 0.00 0.00 72.50 72.13 2jw4 s THR 51 CO 0.48 -0.44 0.91 -0.83 -0.69 0.00 0.00 174.62 174.06 2jw4 s GLY 52 N -1.43 -0.44 0.18 4.40 0.00 -0.91 -4.67 107.32 104.45 2jw4 s GLY 52 Ca -0.13 1.14 -0.27 0.00 0.00 0.00 0.00 44.72 45.46 2jw4 s GLY 52 CO -0.01 0.41 0.82 -1.36 0.00 0.00 0.00 173.10 172.97 2jw4 s PHE 53 N -2.89 3.92 -0.00 1.90 0.08 -1.16 -2.14 117.98 117.69 2jw4 s PHE 53 Ca 0.04 1.70 -0.14 0.00 0.12 0.00 0.00 56.93 58.66 2jw4 s PHE 53 Cb -0.01 -2.83 0.02 0.00 -0.57 0.00 0.00 43.02 39.63 2jw4 s PHE 53 CO -0.08 0.48 0.28 0.14 -0.10 0.00 0.00 175.22 175.95 2jw4 s VAL 54 N -1.06 0.07 0.99 -0.44 -7.23 -0.27 -3.53 120.40 108.93 2jw4 s VAL 54 Ca 0.37 -0.54 -0.12 0.00 -1.81 0.00 0.00 61.98 59.88 2jw4 s VAL 54 Cb -0.24 -0.64 0.18 0.00 0.56 0.00 0.00 36.38 36.25 2jw4 s VAL 54 CO 0.28 -0.30 1.09 -2.16 -0.31 0.00 0.00 175.10 173.70 2jw4 s PRO 55 N -1.52 0.49 -0.42 4.82 0.04 -1.26 0.13 135.00 137.27 2jw4 s PRO 55 Ca -0.12 0.55 0.05 0.00 0.04 0.00 0.00 61.00 61.52 2jw4 s PRO 55 Cb -0.05 -1.74 0.67 0.00 0.04 0.00 0.00 34.50 33.42 2jw4 s PRO 55 CO 0.03 -2.70 1.87 -1.13 0.04 0.00 0.00 177.00 175.10 2jw4 n SER 56 N -4.16 3.80 -0.08 6.66 3.41 -1.26 -4.15 113.62 117.84 2jw4 n SER 56 Ca 0.05 -3.57 -0.08 0.00 -0.26 0.00 0.00 58.87 55.02 2jw4 n SER 56 Cb 0.57 -0.81 -0.16 0.00 -0.26 0.00 0.00 64.21 63.55 2jw4 n SER 56 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2jw4 n ASN 57 N -1.01 0.12 -0.09 4.04 5.15 -1.26 -4.53 115.26 117.69 2jw4 n ASN 57 Ca 0.55 0.06 -0.09 0.00 -0.60 0.00 0.00 54.58 54.50 2jw4 n ASN 57 Cb 1.59 0.95 -0.13 0.00 -0.53 0.00 0.00 39.78 41.66 2jw4 n ASN 57 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2jw4 n TYR 58 N -2.74 0.00 -4.13 1.20 4.02 -1.26 -4.95 117.16 109.30 2jw4 n TYR 58 Ca -0.28 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.39 2jw4 n TYR 58 Cb 1.08 -0.82 -0.06 0.00 -0.02 0.00 0.00 39.34 39.52 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 -2.41 3.55 -0.28 -0.72 -7.23 -1.26 -0.62 120.40 111.44 2jw4 s VAL 59 Ca -0.11 -1.66 -0.22 0.00 -1.81 0.00 0.00 61.98 58.17 2jw4 s VAL 59 Cb 0.05 -3.06 0.10 0.00 0.56 0.00 0.00 36.38 34.04 2jw4 s VAL 59 CO 0.66 -0.28 0.86 -0.70 -0.31 0.00 0.00 175.10 175.32 2jw4 s GLU 60 N -3.81 0.64 0.46 4.82 2.12 -0.86 -4.62 118.70 117.45 2jw4 s GLU 60 Ca 0.35 0.85 -0.25 0.00 0.36 0.00 0.00 54.97 56.28 2jw4 s GLU 60 Cb -0.05 0.27 -0.08 0.00 0.26 0.00 0.00 34.13 34.52 2jw4 s GLU 60 CO 0.23 -0.09 1.40 -0.98 -0.54 0.00 0.00 175.26 175.27 2jw4 s ARG 61 N 0.65 3.63 1.01 4.30 1.70 -1.26 -1.00 118.95 127.99 2jw4 s ARG 61 Ca -0.02 2.35 -0.20 0.00 -0.47 0.00 0.00 55.73 57.39 2jw4 s ARG 61 Cb -0.05 -2.60 -0.09 0.00 -0.57 0.00 0.00 34.95 31.64 2jw4 s ARG 61 CO -0.07 -0.83 -0.69 1.17 -1.08 0.00 0.00 175.30 173.80 2jw4 n LYS 62 N -0.29 -0.34 0.00 3.89 4.81 0.11 -4.86 118.16 121.48 2jw4 n LYS 62 Ca 0.06 -0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 2jw4 n LYS 62 Cb 0.43 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 34.20 2jw4 n LYS 62 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2jw4 n ASN 63 N 1.72 2.39 -4.50 3.14 3.02 -1.26 -4.97 115.26 114.81 2jw4 n ASN 63 Ca -0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 2jw4 n ASN 63 Cb 0.63 0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.99 2jw4 n ASN 63 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jw4 s SER 64 N -2.11 6.47 -0.58 6.41 0.15 -1.26 -4.97 113.70 117.81 2jw4 s SER 64 Ca 0.00 -1.54 -0.19 0.00 0.70 0.00 0.00 55.95 54.92 2jw4 s SER 64 Cb 0.00 -2.47 0.09 0.00 -1.71 0.00 0.00 66.02 61.93 2jw4 s SER 64 CO 0.00 -1.34 0.71 0.00 1.20 0.00 0.00 173.24 173.81 2jw4 s ALA 65 N 3.94 3.39 0.74 5.45 0.00 -1.26 -5.05 121.76 128.97 2jw4 s ALA 65 Ca 0.36 -2.13 -0.12 0.00 0.00 0.00 0.00 51.96 50.07 2jw4 s ALA 65 Cb -0.05 -3.52 0.04 0.00 0.00 0.00 0.00 23.12 19.58 2jw4 s ALA 65 CO -0.05 -2.32 1.11 1.03 0.00 0.00 0.00 175.76 175.54 2jw4 s ARG 66 N 2.75 2.57 -0.13 0.00 0.52 -1.26 -5.02 118.95 118.38 2jw4 s ARG 66 Ca 0.13 0.42 -0.26 0.00 -0.52 0.00 0.00 55.73 55.49 2jw4 s ARG 66 Cb -0.23 -1.99 -0.26 0.00 0.52 0.00 0.00 34.95 32.99 2jw4 s ARG 66 CO 0.07 -1.23 0.70 0.00 0.02 0.00 0.00 175.30 174.86 2jw4 h ALA 67 N -0.80 0.03 -0.50 2.13 0.00 -2.05 -3.33 119.26 114.75 2jw4 h ALA 67 Ca -0.45 -0.67 -0.32 0.00 0.00 0.00 0.00 54.91 53.47 2jw4 h ALA 67 Cb 1.27 0.15 -0.15 0.00 0.00 0.00 0.00 17.79 19.06 2jw4 h ALA 67 CO 0.64 0.21 0.41 0.00 0.00 0.00 0.00 179.25 180.50 2jw4 n ALA 68 N -2.75 4.81 -1.13 0.00 0.00 -1.26 -4.42 120.51 115.77 2jw4 n ALA 68 Ca -0.15 -1.65 -0.26 0.00 0.00 0.00 0.00 53.44 51.38 2jw4 n ALA 68 Cb 0.59 -1.34 0.13 0.00 0.00 0.00 0.00 19.45 18.83 2jw4 n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jw4 n ALA 69 N 0.08 5.66 -2.58 0.00 0.00 -1.25 -4.96 120.51 117.47 2jw4 n ALA 69 Ca 0.31 -2.86 -0.20 0.00 0.00 0.00 0.00 53.44 50.69 2jw4 n ALA 69 Cb 0.75 -1.53 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 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 -1.26 6.05 -0.59 0.00 2.20 -1.26 -5.01 114.94 115.08 2jw4 s ASN 70 Ca 0.55 -0.02 0.04 0.00 -0.94 0.00 0.00 52.86 52.50 2jw4 s ASN 70 Cb 0.45 -1.47 0.16 0.00 -2.00 0.00 0.00 41.25 38.39 2jw4 s ASN 70 CO 0.06 -0.38 0.41 -0.55 -2.94 0.00 0.00 177.10 173.70 2jw4 s SER 71 N -4.13 3.77 0.00 3.54 0.15 -1.26 -5.16 113.70 110.61 2jw4 s SER 71 Ca 0.43 -3.46 0.04 0.00 0.70 0.00 0.00 55.95 53.66 2jw4 s SER 71 Cb -0.09 -1.25 0.04 0.00 -1.71 0.00 0.00 66.02 63.00 2jw4 s SER 71 CO 0.32 -0.14 0.64 -1.54 1.20 0.00 0.00 173.24 173.73