#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wq5 h LEU 2 N 0.00 0.68 -0.95 -4.53 5.85 -1.23 0.13 115.31 115.26 2wq5 h LEU 2 Ca 0.00 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 2wq5 h LEU 2 Cb 0.00 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2wq5 h LEU 2 CO 0.00 0.35 0.20 1.88 -0.34 0.00 0.00 178.44 180.52 2wq5 h TYR 3 N 0.77 0.98 -0.18 1.25 0.05 -1.99 -1.37 116.97 116.49 2wq5 h TYR 3 Ca 0.45 -0.08 -0.18 0.00 0.05 0.00 0.00 58.73 58.96 2wq5 h TYR 3 Cb 0.51 -0.29 -0.00 0.00 1.01 0.00 0.00 36.73 37.96 2wq5 h TYR 3 CO -0.06 0.79 -0.63 1.96 -1.05 0.00 0.00 178.16 179.17 2wq5 h GLN 4 N 0.93 0.63 -0.37 4.88 4.20 -1.22 -0.38 115.11 123.78 2wq5 h GLN 4 Ca 0.21 -0.44 0.03 0.00 0.06 0.00 0.00 58.65 58.51 2wq5 h GLN 4 Cb 0.27 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 2wq5 h GLN 4 CO -0.01 1.06 0.16 0.35 -0.67 0.00 0.00 178.83 179.72 2wq5 h PHE 5 N 0.46 0.29 -0.59 2.96 3.57 -0.89 0.28 116.94 123.03 2wq5 h PHE 5 Ca -0.01 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.59 2wq5 h PHE 5 Cb 1.21 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.81 2wq5 h PHE 5 CO 0.06 0.14 0.24 -0.22 -2.23 0.00 0.00 178.31 176.30 2wq5 h LYS 6 N 0.33 0.43 -0.10 1.11 3.64 -0.87 -1.76 116.57 119.36 2wq5 h LYS 6 Ca 0.16 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.41 2wq5 h LYS 6 Cb 0.10 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2wq5 h LYS 6 CO -0.14 0.29 -0.41 -0.91 -2.27 0.00 0.00 179.45 176.01 2wq5 h ASN 7 N 0.44 0.23 -0.66 4.20 2.35 -0.60 -0.73 115.58 120.80 2wq5 h ASN 7 Ca 0.29 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.89 2wq5 h ASN 7 Cb 0.32 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.60 2wq5 h ASN 7 CO -0.27 0.62 0.19 0.24 -1.65 0.00 0.00 177.43 176.57 2wq5 h MET 8 N 0.18 1.04 -0.42 0.81 2.86 -0.40 0.53 114.93 119.53 2wq5 h MET 8 Ca 0.02 -0.23 -0.11 0.00 -2.06 0.00 0.00 59.70 57.31 2wq5 h MET 8 Cb 0.81 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 2wq5 h MET 8 CO 0.06 0.92 -0.20 0.82 1.06 0.00 0.00 176.91 179.57 2wq5 h ILE 9 N 0.97 1.27 -0.60 -1.22 2.04 -0.90 -1.70 117.51 117.38 2wq5 h ILE 9 Ca 0.21 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 2wq5 h ILE 9 Cb 0.32 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2wq5 h ILE 9 CO -0.00 0.45 0.32 0.50 0.00 0.00 0.00 178.15 179.41 2wq5 h LYS 10 N 0.73 0.82 -0.01 2.37 1.63 -0.81 0.35 116.57 121.65 2wq5 h LYS 10 Ca 0.10 -0.08 -0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2wq5 h LYS 10 Cb 0.72 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 32.18 2wq5 h LYS 10 CO 0.06 0.61 0.01 0.00 -3.45 0.00 0.00 179.45 176.67 2wq5 n THR 12 N -5.05 0.44 -3.14 0.00 -2.24 -0.86 -4.38 114.28 99.05 2wq5 n THR 12 Ca -0.07 -0.55 -0.24 0.00 -2.27 0.00 0.00 64.05 60.92 2wq5 n THR 12 Cb 0.06 -0.24 -0.05 0.00 -2.10 0.00 0.00 70.33 68.01 2wq5 n THR 12 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2wq5 n VAL 13 N -2.53 1.30 0.28 2.28 0.31 0.12 -4.72 118.33 115.38 2wq5 n VAL 13 Ca -0.04 -4.95 0.16 0.00 -0.01 0.00 0.00 64.34 59.50 2wq5 n VAL 13 Cb 0.60 -1.22 0.81 0.00 -0.91 0.00 0.00 33.84 33.12 2wq5 n VAL 13 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2wq5 h PRO 14 N 3.34 0.00 0.00 5.55 0.13 -1.65 -2.76 132.00 136.61 2wq5 h PRO 14 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2wq5 h PRO 14 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2wq5 h PRO 14 CO 0.66 0.07 0.00 0.43 -0.23 0.00 0.00 178.00 178.93 2wq5 n SER 15 N -3.36 0.27 -4.61 1.44 7.64 -1.26 -4.82 113.62 108.92 2wq5 n SER 15 Ca -0.01 0.53 -0.31 0.00 1.01 0.00 0.00 58.87 60.09 2wq5 n SER 15 Cb 0.23 -0.60 -0.10 0.00 -1.01 0.00 0.00 64.21 62.73 2wq5 n SER 15 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2wq5 s ARG 16 N -3.05 2.45 0.46 1.43 0.52 -1.04 -5.11 118.95 114.60 2wq5 s ARG 16 Ca 0.11 -0.81 -0.22 0.00 -0.52 0.00 0.00 55.73 54.29 2wq5 s ARG 16 Cb 0.15 -2.46 -0.08 0.00 0.52 0.00 0.00 34.95 33.08 2wq5 s ARG 16 CO 0.50 0.57 1.09 0.45 0.02 0.00 0.00 175.30 177.92 2wq5 s SER 17 N -1.76 6.37 0.36 0.23 0.15 -1.26 -4.88 113.70 112.91 2wq5 s SER 17 Ca 0.20 2.09 0.10 0.00 0.70 0.00 0.00 55.95 59.04 2wq5 s SER 17 Cb -0.11 -2.58 0.84 0.00 -1.71 0.00 0.00 66.02 62.46 2wq5 s SER 17 CO 0.11 -0.77 1.85 -0.25 1.20 0.00 0.00 173.24 175.38 2wq5 h TRP 18 N 1.97 0.82 0.00 3.44 2.91 -1.94 -2.40 115.95 120.76 2wq5 h TRP 18 Ca -0.49 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.54 2wq5 h TRP 18 Cb 1.23 -0.26 -0.00 0.00 -0.51 0.00 0.00 29.16 29.62 2wq5 h TRP 18 CO 0.56 0.27 -0.06 -1.49 -1.03 0.00 0.00 178.44 176.69 2wq5 h TRP 19 N 0.66 0.00 0.00 2.65 4.06 -1.99 -1.87 115.95 119.47 2wq5 h TRP 19 Ca 0.48 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.39 2wq5 h TRP 19 Cb 0.83 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.98 2wq5 h TRP 19 CO -0.00 0.06 -0.20 -0.44 -3.56 0.00 0.00 178.44 174.29 2wq5 h ASP 20 N 0.00 0.00 0.05 -3.49 5.19 -1.82 -2.59 116.42 113.76 2wq5 h ASP 20 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2wq5 h ASP 20 Cb 0.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.62 2wq5 h ASP 20 CO 0.01 0.20 -0.66 0.49 -3.12 0.00 0.00 179.24 176.16 2wq5 n PHE 21 N -3.91 0.00 1.13 4.55 3.72 -0.73 -4.40 117.46 117.82 2wq5 n PHE 21 Ca -0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 2wq5 n PHE 21 Cb 0.29 -0.03 0.44 0.00 -0.94 0.00 0.00 39.48 39.24 2wq5 n PHE 21 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wq5 n ALA 22 N -0.74 3.03 -2.86 4.37 0.00 -0.97 -4.09 120.51 119.23 2wq5 n ALA 22 Ca 0.07 -0.28 -0.06 0.00 0.00 0.00 0.00 53.44 53.18 2wq5 n ALA 22 Cb 0.40 -1.25 -0.00 0.00 0.00 0.00 0.00 19.45 18.59 2wq5 n ALA 22 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wq5 s ASP 23 N -2.81 -1.18 -0.07 0.00 2.15 -1.25 -4.37 116.67 109.14 2wq5 s ASP 23 Ca 0.18 -1.76 -0.04 0.00 0.43 0.00 0.00 52.55 51.36 2wq5 s ASP 23 Cb 0.19 1.69 0.03 0.00 -0.30 0.00 0.00 42.92 44.53 2wq5 s ASP 23 CO 0.59 -0.07 0.16 -0.47 -0.17 0.00 0.00 175.17 175.20 2wq5 s TYR 24 N 0.90 -0.18 0.00 -5.34 6.14 -1.07 -0.78 117.35 117.02 2wq5 s TYR 24 Ca 0.29 0.50 0.00 0.00 0.64 0.00 0.00 57.07 58.49 2wq5 s TYR 24 Cb -0.00 -0.04 0.00 0.00 0.42 0.00 0.00 41.96 42.33 2wq5 s TYR 24 CO -0.06 -0.16 0.00 0.41 0.64 0.00 0.00 175.55 176.38 2wq5 n GLY 25 N 3.97 0.94 0.01 8.97 0.00 -0.06 -1.49 105.19 117.53 2wq5 n GLY 25 Ca -0.24 -0.74 0.12 0.00 0.00 0.00 0.00 46.02 45.16 2wq5 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wq5 n TYR 27 N -1.65 0.00 -2.49 0.00 4.02 -1.24 -3.92 117.16 111.89 2wq5 n TYR 27 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.51 2wq5 n TYR 27 Cb 0.36 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.66 2wq5 n TYR 27 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wq5 n GLY 29 N 4.92 0.77 0.00 0.00 0.00 -1.26 -2.60 105.19 107.02 2wq5 n GLY 29 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2wq5 n GLY 29 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wq5 n ARG 30 N -2.43 0.00 0.00 1.61 3.00 -0.29 -4.99 116.66 113.56 2wq5 n ARG 30 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2wq5 n ARG 30 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2wq5 n ARG 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2wq5 n GLY 31 N 0.00 -0.76 3.03 5.14 0.00 -1.25 -4.86 105.19 106.49 2wq5 n GLY 31 Ca 0.00 -1.05 0.02 0.00 0.00 0.00 0.00 46.02 44.99 2wq5 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wq5 n GLY 32 N -0.23 -0.23 2.38 -0.02 0.00 -1.26 -4.83 105.19 101.00 2wq5 n GLY 32 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2wq5 n GLY 32 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wq5 n SER 33 N -4.21 -4.67 0.00 1.61 2.88 -1.26 -4.82 113.62 103.15 2wq5 n SER 33 Ca 0.00 0.84 0.00 0.00 -1.33 0.00 0.00 58.87 58.38 2wq5 n SER 33 Cb 0.06 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.21 2wq5 n SER 33 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wq5 n GLY 34 N 2.21 2.50 3.69 0.46 0.00 -1.13 -4.81 105.19 108.11 2wq5 n GLY 34 Ca 0.00 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 2wq5 n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wq5 s THR 35 N -2.06 4.85 0.25 2.61 2.01 -1.26 -4.99 115.64 117.04 2wq5 s THR 35 Ca 0.00 1.89 -0.31 0.00 0.31 0.00 0.00 61.69 63.58 2wq5 s THR 35 Cb 0.00 -4.24 -0.14 0.00 0.01 0.00 0.00 72.50 68.13 2wq5 s THR 35 CO 0.00 0.06 1.28 -2.65 -0.69 0.00 0.00 174.62 172.62 2wq5 n PRO 36 N 4.75 1.76 0.14 4.92 -0.02 -1.26 -4.82 135.00 140.46 2wq5 n PRO 36 Ca 0.06 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2wq5 n PRO 36 Cb 0.49 -2.19 0.16 0.00 -0.02 0.00 0.00 33.50 31.94 2wq5 n PRO 36 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2wq5 h VAL 37 N 2.72 1.26 -2.51 -1.45 -1.51 -1.94 -3.48 116.25 109.34 2wq5 h VAL 37 Ca -0.44 -2.17 0.07 0.00 -1.23 0.00 0.00 66.70 62.93 2wq5 h VAL 37 Cb 1.30 2.23 -0.01 0.00 -2.13 0.00 0.00 31.29 32.68 2wq5 h VAL 37 CO 0.70 0.59 0.37 -0.90 -1.23 0.00 0.00 177.57 177.10 2wq5 n ASP 38 N -3.58 -1.53 -0.28 4.19 5.68 -1.26 -5.02 116.55 114.75 2wq5 n ASP 38 Ca -0.00 -1.91 -0.04 0.00 -0.50 0.00 0.00 54.79 52.33 2wq5 n ASP 38 Cb 0.65 2.51 0.11 0.00 -1.14 0.00 0.00 41.12 43.25 2wq5 n ASP 38 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2wq5 h ASP 39 N 1.55 1.04 -0.54 -1.12 3.32 -1.92 -1.37 116.42 117.39 2wq5 h ASP 39 Ca -0.23 -0.13 0.02 0.00 0.02 0.00 0.00 57.03 56.70 2wq5 h ASP 39 Cb 0.95 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 2wq5 h ASP 39 CO 0.30 0.89 0.34 0.25 -1.72 0.00 0.00 179.24 179.31 2wq5 h LEU 40 N 1.13 0.57 -1.28 1.55 5.85 -1.91 -1.49 115.31 119.73 2wq5 h LEU 40 Ca 0.27 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 59.04 2wq5 h LEU 40 Cb 0.14 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 2wq5 h LEU 40 CO -0.03 0.40 0.52 -0.78 -0.34 0.00 0.00 178.44 178.21 2wq5 h ASP 41 N 0.68 0.78 -0.69 1.25 3.58 -1.74 -0.63 116.42 119.64 2wq5 h ASP 41 Ca 0.21 -0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.61 2wq5 h ASP 41 Cb -0.02 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 2wq5 h ASP 41 CO -0.07 0.51 0.25 -0.09 -2.88 0.00 0.00 179.24 176.96 2wq5 h ARG 42 N 0.89 1.08 -0.60 0.28 9.65 -0.61 -0.55 114.38 124.52 2wq5 h ARG 42 Ca 0.33 -0.21 0.11 0.00 -1.10 0.00 0.00 59.98 59.11 2wq5 h ARG 42 Cb 0.17 -0.17 -0.08 0.00 -1.39 0.00 0.00 29.97 28.50 2wq5 h ARG 42 CO -0.11 0.90 0.16 0.00 2.80 0.00 0.00 179.97 183.72 2wq5 h GLN 45 N 0.92 0.51 -0.60 0.00 4.15 -0.54 -0.08 115.11 119.48 2wq5 h GLN 45 Ca 0.17 -0.07 0.06 0.00 0.77 0.00 0.00 58.65 59.58 2wq5 h GLN 45 Cb 0.53 -0.09 -0.06 0.00 0.21 0.00 0.00 27.48 28.07 2wq5 h GLN 45 CO 0.03 0.46 0.30 0.28 -1.93 0.00 0.00 178.83 177.96 2wq5 h VAL 46 N 0.44 0.91 -0.41 2.39 2.07 -0.94 -0.87 116.25 119.84 2wq5 h VAL 46 Ca 0.12 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2wq5 h VAL 46 Cb 0.11 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 2wq5 h VAL 46 CO -0.02 0.10 0.22 -0.74 0.02 0.00 0.00 177.57 177.15 2wq5 h HIS 47 N 0.55 0.41 -0.44 1.57 -0.00 -0.73 0.86 115.15 117.37 2wq5 h HIS 47 Ca 0.28 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.68 2wq5 h HIS 47 Cb 0.22 -0.13 -0.03 0.00 -0.00 0.00 0.00 27.41 27.47 2wq5 h HIS 47 CO -0.11 0.23 0.25 -0.44 -0.00 0.00 0.00 177.93 177.86 2wq5 h ASP 48 N 0.45 0.41 -0.96 3.26 3.45 -0.57 -0.55 116.42 121.90 2wq5 h ASP 48 Ca 0.17 0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.65 2wq5 h ASP 48 Cb 0.05 -0.08 -0.05 0.00 -0.56 0.00 0.00 39.33 38.69 2wq5 h ASP 48 CO -0.10 0.29 0.64 0.78 -1.57 0.00 0.00 179.24 179.28 2wq5 h ASN 49 N 0.51 1.10 -0.56 6.45 2.35 -0.73 -0.54 115.58 124.17 2wq5 h ASN 49 Ca 0.18 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 2wq5 h ASN 49 Cb 0.02 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 2wq5 h ASN 49 CO -0.09 0.79 0.20 0.00 -1.65 0.00 0.00 177.43 176.69 2wq5 h TYR 51 N 0.77 1.09 -0.96 0.00 -1.99 -0.77 -1.87 116.97 113.24 2wq5 h TYR 51 Ca 0.18 -0.05 0.06 0.00 2.00 0.00 0.00 58.73 60.92 2wq5 h TYR 51 Cb 0.24 -0.34 -0.06 0.00 2.00 0.00 0.00 36.73 38.57 2wq5 h TYR 51 CO 0.01 0.80 0.62 -0.97 -0.00 0.00 0.00 178.16 178.62 2wq5 h ASN 52 N 1.07 0.99 -0.49 3.88 -1.24 -0.74 -0.49 115.58 118.56 2wq5 h ASN 52 Ca 0.26 0.01 -0.04 0.00 0.71 0.00 0.00 56.30 57.24 2wq5 h ASN 52 Cb 0.11 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 38.94 2wq5 h ASN 52 CO -0.03 0.63 0.13 -0.33 -1.29 0.00 0.00 177.43 176.54 2wq5 h GLU 53 N 1.13 0.78 -0.36 6.67 4.39 -1.04 -2.99 114.58 123.16 2wq5 h GLU 53 Ca 0.41 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.91 2wq5 h GLU 53 Cb 0.15 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2wq5 h GLU 53 CO -0.17 0.75 0.14 0.00 -1.16 0.00 0.00 179.01 178.57 2wq5 h ALA 54 N 1.00 1.57 0.00 3.43 0.00 -0.53 -1.18 119.26 123.55 2wq5 h ALA 54 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wq5 h ALA 54 Cb 0.31 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2wq5 h ALA 54 CO -0.00 0.34 0.00 0.39 0.00 0.00 0.00 179.25 179.98 2wq5 n GLU 55 N -4.39 0.14 0.19 0.00 1.02 -0.27 -1.89 120.64 115.45 2wq5 n GLU 55 Ca 0.02 0.41 0.14 0.00 -0.02 0.00 0.00 57.16 57.71 2wq5 n GLU 55 Cb 0.14 -1.79 0.63 0.00 -0.02 0.00 0.00 31.44 30.39 2wq5 n GLU 55 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2wq5 h LYS 56 N 0.00 0.00 -6.47 3.49 1.57 -1.21 -3.42 116.57 110.53 2wq5 h LYS 56 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2wq5 h LYS 56 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2wq5 h LYS 56 CO 0.00 0.00 0.43 0.42 -0.57 0.00 0.00 179.45 179.73 2wq5 s ILE 57 N -3.52 4.50 0.24 1.86 1.01 -0.79 -4.98 121.20 119.51 2wq5 s ILE 57 Ca 0.01 1.85 -0.31 0.00 0.00 0.00 0.00 60.65 62.21 2wq5 s ILE 57 Cb 0.09 -4.19 -0.11 0.00 0.01 0.00 0.00 42.46 38.27 2wq5 s ILE 57 CO 0.39 0.18 1.56 -0.44 0.00 0.00 0.00 174.94 176.62 2wq5 s SER 58 N 0.80 6.51 -1.84 3.58 0.01 -1.26 -2.02 113.70 119.47 2wq5 s SER 58 Ca 0.53 2.77 0.00 0.00 1.31 0.00 0.00 55.95 60.56 2wq5 s SER 58 Cb -0.24 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.37 2wq5 s SER 58 CO 0.29 -0.83 0.00 0.29 0.41 0.00 0.00 173.24 173.40 2wq5 n LYS 59 N 2.87 -1.41 -3.25 12.44 4.01 -1.26 -4.97 118.16 126.59 2wq5 n LYS 59 Ca 0.10 1.06 -0.42 0.00 -0.51 0.00 0.00 58.31 58.54 2wq5 n LYS 59 Cb 0.38 -5.47 -0.08 0.00 -0.51 0.00 0.00 35.03 29.35 2wq5 n LYS 59 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2wq5 s TRP 61 N 2.37 2.61 0.25 0.00 0.51 -1.26 -4.42 118.94 119.00 2wq5 s TRP 61 Ca 0.17 -2.87 -0.08 0.00 -2.12 0.00 0.00 56.10 51.20 2wq5 s TRP 61 Cb -0.16 -2.17 0.41 0.00 -0.81 0.00 0.00 33.47 30.75 2wq5 s TRP 61 CO 0.14 -0.69 1.60 -1.35 -0.51 0.00 0.00 176.95 176.14 2wq5 h PRO 62 N 6.00 0.03 0.00 4.98 0.11 -1.93 0.99 132.00 142.18 2wq5 h PRO 62 Ca 0.09 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2wq5 h PRO 62 Cb 0.85 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2wq5 h PRO 62 CO 0.58 0.02 0.00 0.74 -0.21 0.00 0.00 178.00 179.13 2wq5 h PHE 63 N 0.03 0.00 0.00 0.65 0.04 -1.95 -2.86 116.94 112.84 2wq5 h PHE 63 Ca 0.42 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.19 2wq5 h PHE 63 Cb 0.70 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.85 2wq5 h PHE 63 CO -0.56 0.00 -1.41 1.19 -0.60 0.00 0.00 178.31 176.93 2wq5 n PHE 64 N -2.48 0.00 -2.89 -0.55 3.72 0.22 -0.85 117.46 114.64 2wq5 n PHE 64 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 2wq5 n PHE 64 Cb 0.28 -0.21 -0.04 0.00 -0.94 0.00 0.00 39.48 38.57 2wq5 n PHE 64 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2wq5 s LYS 65 N -3.17 4.11 0.20 -1.08 2.47 -0.48 -4.79 119.74 117.00 2wq5 s LYS 65 Ca 0.01 0.85 -0.30 0.00 -1.56 0.00 0.00 55.97 54.97 2wq5 s LYS 65 Cb 0.15 -3.68 -0.08 0.00 -1.46 0.00 0.00 37.83 32.76 2wq5 s LYS 65 CO 0.86 -0.59 1.09 0.99 0.16 0.00 0.00 175.35 177.85 2wq5 s THR 66 N 2.93 3.80 0.29 3.43 2.01 -1.26 0.50 115.64 127.34 2wq5 s THR 66 Ca 0.35 1.62 0.02 0.00 0.31 0.00 0.00 61.69 64.00 2wq5 s THR 66 Cb -0.15 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.28 2wq5 s THR 66 CO 0.09 0.31 0.13 -0.72 -0.69 0.00 0.00 174.62 173.74 2wq5 s TYR 67 N -0.51 1.59 -0.17 4.92 -0.85 -1.26 -4.75 117.35 116.32 2wq5 s TYR 67 Ca 0.48 -1.28 -0.02 0.00 -0.52 0.00 0.00 57.07 55.72 2wq5 s TYR 67 Cb -0.30 -0.90 -0.01 0.00 0.38 0.00 0.00 41.96 41.13 2wq5 s TYR 67 CO 0.36 -0.43 -0.09 0.45 -1.52 0.00 0.00 175.55 174.33 2wq5 s SER 68 N -3.36 4.23 0.26 -0.18 0.15 -1.26 -4.95 113.70 108.59 2wq5 s SER 68 Ca 0.36 -0.32 -0.17 0.00 0.70 0.00 0.00 55.95 56.52 2wq5 s SER 68 Cb 0.06 -1.68 0.01 0.00 -1.71 0.00 0.00 66.02 62.70 2wq5 s SER 68 CO 0.16 0.10 0.60 -0.72 1.20 0.00 0.00 173.24 174.57 2wq5 s TYR 69 N 0.76 0.10 -0.01 3.44 1.13 -1.26 -1.13 117.35 120.38 2wq5 s TYR 69 Ca -0.04 -0.52 0.05 0.00 -1.41 0.00 0.00 57.07 55.15 2wq5 s TYR 69 Cb -0.15 0.44 -0.01 0.00 -1.10 0.00 0.00 41.96 41.14 2wq5 s TYR 69 CO 0.02 -1.12 -0.15 0.21 -2.51 0.00 0.00 175.55 172.00 2wq5 s LYS 70 N -3.95 1.18 -0.29 -3.49 2.20 -0.03 -4.91 119.74 110.45 2wq5 s LYS 70 Ca 0.17 -0.53 -0.06 0.00 -0.36 0.00 0.00 55.97 55.19 2wq5 s LYS 70 Cb -0.03 -1.14 0.01 0.00 -1.51 0.00 0.00 37.83 35.16 2wq5 s LYS 70 CO 0.08 0.31 0.06 0.00 -0.36 0.00 0.00 175.35 175.44 2wq5 s SER 72 N 1.47 2.92 -1.49 0.00 0.01 0.10 -4.82 113.70 111.89 2wq5 s SER 72 Ca 0.02 -0.65 -0.08 0.00 1.31 0.00 0.00 55.95 56.55 2wq5 s SER 72 Cb -0.17 -1.10 0.06 0.00 0.21 0.00 0.00 66.02 65.02 2wq5 s SER 72 CO 0.01 -0.13 0.68 0.00 0.41 0.00 0.00 173.24 174.22 2wq5 n GLN 73 N 4.79 -4.01 -0.97 12.44 6.02 -1.26 -0.72 117.38 133.66 2wq5 n GLN 73 Ca -0.14 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 2wq5 n GLN 73 Cb 0.48 -4.98 0.00 0.00 1.02 0.00 0.00 30.24 26.76 2wq5 n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wq5 n GLY 74 N -1.71 0.77 3.54 1.08 0.00 -1.26 -5.03 105.19 102.58 2wq5 n GLY 74 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 2wq5 n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wq5 s THR 75 N -3.15 4.07 -0.16 2.61 2.01 0.10 -4.47 115.64 116.64 2wq5 s THR 75 Ca 0.00 -0.30 -0.09 0.00 0.31 0.00 0.00 61.69 61.61 2wq5 s THR 75 Cb 0.00 -2.78 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 2wq5 s THR 75 CO 0.00 0.51 0.14 -0.76 -0.69 0.00 0.00 174.62 173.82 2wq5 s LEU 76 N 0.17 4.29 -0.05 4.42 1.43 -1.26 -0.72 118.68 126.95 2wq5 s LEU 76 Ca -0.00 0.35 0.02 0.00 -1.03 0.00 0.00 54.13 53.46 2wq5 s LEU 76 Cb -0.13 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.00 2wq5 s LEU 76 CO 0.02 0.27 -0.10 -0.89 0.23 0.00 0.00 176.35 175.89 2wq5 s THR 77 N -0.22 0.95 -0.02 5.49 2.01 -0.39 -4.99 115.64 118.47 2wq5 s THR 77 Ca 0.11 -0.38 -0.24 0.00 0.31 0.00 0.00 61.69 61.49 2wq5 s THR 77 Cb -0.12 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 2wq5 s THR 77 CO 0.01 0.31 0.72 0.00 -0.69 0.00 0.00 174.62 174.97 2wq5 s LYS 79 N 0.43 3.78 0.52 0.00 1.02 -0.28 -4.97 119.74 120.25 2wq5 s LYS 79 Ca 0.38 0.63 0.31 0.00 0.02 0.00 0.00 55.97 57.30 2wq5 s LYS 79 Cb -0.19 -2.27 1.24 0.00 -0.52 0.00 0.00 37.83 36.09 2wq5 s LYS 79 CO 0.20 -0.20 1.94 0.78 -0.92 0.00 0.00 175.35 177.15 2wq5 h GLY 80 N 0.83 0.00 0.14 -3.33 0.00 -1.97 -3.14 103.07 95.60 2wq5 h GLY 80 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2wq5 h GLY 80 CO 0.63 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.78 2wq5 n GLY 81 N 0.07 -0.69 3.75 4.60 0.00 -1.26 -4.87 105.19 106.79 2wq5 n GLY 81 Ca 0.00 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 2wq5 n GLY 81 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wq5 s ASN 82 N -1.45 6.89 1.18 1.61 0.01 -1.19 -5.03 114.94 116.96 2wq5 s ASN 82 Ca 0.24 2.49 -0.19 0.00 -0.71 0.00 0.00 52.86 54.69 2wq5 s ASN 82 Cb 0.11 -2.63 0.28 0.00 0.41 0.00 0.00 41.25 39.43 2wq5 s ASN 82 CO 0.18 -0.49 1.11 0.54 -1.51 0.00 0.00 177.10 176.93 2wq5 s ASN 83 N -0.06 1.07 0.14 -1.22 6.03 -1.26 -4.53 114.94 115.10 2wq5 s ASN 83 Ca 0.53 0.66 -0.18 0.00 -1.03 0.00 0.00 52.86 52.84 2wq5 s ASN 83 Cb -0.37 -0.93 -0.01 0.00 -3.03 0.00 0.00 41.25 36.90 2wq5 s ASN 83 CO 0.43 -4.04 1.75 0.00 -2.03 0.00 0.00 177.10 173.22 2wq5 h ALA 84 N -2.52 0.29 0.36 3.54 0.00 -1.99 0.31 119.26 119.25 2wq5 h ALA 84 Ca -0.46 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2wq5 h ALA 84 Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2wq5 h ALA 84 CO 0.36 -0.31 -0.17 0.00 0.00 0.00 0.00 179.25 179.13 2wq5 h ALA 86 N 0.02 0.71 -0.30 0.00 0.00 -1.78 -0.18 119.26 117.72 2wq5 h ALA 86 Ca -0.05 0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2wq5 h ALA 86 Cb 0.43 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2wq5 h ALA 86 CO 0.08 -0.28 0.19 0.00 0.00 0.00 0.00 179.25 179.24 2wq5 h ALA 87 N 1.45 0.38 -0.23 0.00 0.00 -0.30 0.61 119.26 121.17 2wq5 h ALA 87 Ca 0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2wq5 h ALA 87 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2wq5 h ALA 87 CO -0.37 -0.17 0.08 0.77 0.00 0.00 0.00 179.25 179.55 2wq5 h SER 88 N 0.39 0.33 -0.45 0.00 0.02 -0.81 -1.41 113.55 111.62 2wq5 h SER 88 Ca 0.11 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 60.80 2wq5 h SER 88 Cb -0.03 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2wq5 h SER 88 CO -0.04 0.44 0.02 0.58 -1.14 0.00 0.00 176.83 176.70 2wq5 h VAL 89 N 0.21 1.26 -0.46 2.27 2.07 -0.90 -1.76 116.25 118.93 2wq5 h VAL 89 Ca 0.08 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.63 2wq5 h VAL 89 Cb 0.22 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2wq5 h VAL 89 CO -0.00 0.35 0.24 0.00 0.02 0.00 0.00 177.57 178.18 2wq5 h ASP 91 N 0.48 0.85 -0.14 0.00 3.58 -1.01 -0.26 116.42 119.92 2wq5 h ASP 91 Ca 0.20 -0.22 0.01 0.00 0.42 0.00 0.00 57.03 57.44 2wq5 h ASP 91 Cb 0.09 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 2wq5 h ASP 91 CO -0.13 0.92 0.05 0.00 -2.88 0.00 0.00 179.24 177.19 2wq5 h ASP 93 N 0.12 0.54 -0.03 0.00 5.19 -0.88 -1.90 116.42 119.46 2wq5 h ASP 93 Ca 0.06 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2wq5 h ASP 93 Cb 0.04 -0.13 -0.00 0.00 0.18 0.00 0.00 39.33 39.42 2wq5 h ASP 93 CO -0.07 0.39 0.02 -0.09 -3.12 0.00 0.00 179.24 176.37 2wq5 h ARG 94 N 0.65 0.04 -0.81 3.56 2.43 -0.73 -0.07 114.38 119.45 2wq5 h ARG 94 Ca 0.19 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2wq5 h ARG 94 Cb -0.04 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 2wq5 h ARG 94 CO -0.06 0.10 0.39 -0.07 -1.51 0.00 0.00 179.97 178.82 2wq5 h LEU 95 N -0.03 1.06 -0.30 3.80 3.38 -1.05 -1.35 115.31 120.82 2wq5 h LEU 95 Ca 0.01 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 2wq5 h LEU 95 Cb 0.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2wq5 h LEU 95 CO -0.00 0.89 0.05 0.00 0.09 0.00 0.00 178.44 179.47 2wq5 h ALA 96 N 1.27 0.39 -0.97 1.53 0.00 -1.07 -0.62 119.26 119.80 2wq5 h ALA 96 Ca 0.28 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2wq5 h ALA 96 Cb 0.11 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2wq5 h ALA 96 CO -0.04 0.08 0.62 0.00 0.00 0.00 0.00 179.25 179.92 2wq5 h ALA 97 N 0.88 1.32 -0.22 0.00 0.00 -0.62 0.26 119.26 120.88 2wq5 h ALA 97 Ca 0.09 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2wq5 h ALA 97 Cb 0.34 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wq5 h ALA 97 CO 0.01 0.44 -0.06 0.82 0.00 0.00 0.00 179.25 180.45 2wq5 h ILE 98 N 1.16 1.29 -0.31 0.00 2.04 -1.04 -2.32 117.51 118.33 2wq5 h ILE 98 Ca 0.41 -1.06 0.05 0.00 1.00 0.00 0.00 64.86 65.26 2wq5 h ILE 98 Cb 0.12 1.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 2wq5 h ILE 98 CO -0.16 0.33 0.02 0.00 0.00 0.00 0.00 178.15 178.34 2wq5 h PHE 100 N 0.11 1.02 -0.64 0.00 -1.00 -0.43 -1.80 116.94 114.20 2wq5 h PHE 100 Ca 0.15 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.97 2wq5 h PHE 100 Cb 0.19 -0.33 -0.03 0.00 3.61 0.00 0.00 35.95 39.38 2wq5 h PHE 100 CO -0.21 0.54 0.42 0.00 -1.61 0.00 0.00 178.31 177.46 2wq5 h ALA 101 N 1.39 1.58 0.00 2.45 0.00 -1.08 -3.03 119.26 120.58 2wq5 h ALA 101 Ca 0.37 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 55.06 2wq5 h ALA 101 Cb 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2wq5 h ALA 101 CO -0.15 0.37 -1.07 0.78 0.00 0.00 0.00 179.25 179.18 2wq5 h GLY 102 N 0.83 0.00 -4.27 0.00 0.00 -1.25 -3.47 103.07 94.91 2wq5 h GLY 102 Ca 0.24 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 47.05 2wq5 h GLY 102 CO -0.06 0.00 0.32 0.00 0.00 0.00 0.00 176.54 176.81 2wq5 s ALA 103 N -2.83 3.25 0.29 3.60 0.00 -0.75 -5.02 121.76 120.30 2wq5 s ALA 103 Ca -0.00 0.51 -0.29 0.00 0.00 0.00 0.00 51.96 52.18 2wq5 s ALA 103 Cb 0.09 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.87 2wq5 s ALA 103 CO 0.80 -0.06 1.15 -1.25 0.00 0.00 0.00 175.76 176.39 2wq5 s PRO 104 N 0.25 4.57 -0.26 0.00 0.04 -1.26 -4.90 135.00 133.45 2wq5 s PRO 104 Ca 0.47 1.89 -0.21 0.00 0.04 0.00 0.00 61.00 63.19 2wq5 s PRO 104 Cb -0.22 -3.17 -0.02 0.00 0.04 0.00 0.00 34.50 31.14 2wq5 s PRO 104 CO 0.28 0.11 0.66 -0.47 0.04 0.00 0.00 177.00 177.63 2wq5 s TYR 105 N -1.10 3.28 -0.38 0.56 6.14 -1.26 -4.58 117.35 120.01 2wq5 s TYR 105 Ca 0.46 0.85 -0.13 0.00 0.64 0.00 0.00 57.07 58.88 2wq5 s TYR 105 Cb -0.34 -2.90 0.01 0.00 0.42 0.00 0.00 41.96 39.16 2wq5 s TYR 105 CO 0.43 -0.36 0.25 1.21 0.64 0.00 0.00 175.55 177.73 2wq5 s ASN 106 N 1.47 5.98 0.52 4.32 3.84 -1.26 -4.97 114.94 124.84 2wq5 s ASN 106 Ca 0.28 -0.75 0.22 0.00 0.21 0.00 0.00 52.86 52.82 2wq5 s ASN 106 Cb -0.15 -2.12 1.34 0.00 -0.55 0.00 0.00 41.25 39.77 2wq5 s ASN 106 CO 0.09 -0.36 2.03 0.44 -2.79 0.00 0.00 177.10 176.52 2wq5 h ASP 107 N 8.53 0.03 0.50 -4.21 3.32 -1.98 0.33 116.42 122.93 2wq5 h ASP 107 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2wq5 h ASP 107 Cb 1.13 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 2wq5 h ASP 107 CO 0.68 0.02 0.00 0.59 -1.72 0.00 0.00 179.24 178.81 2wq5 n ASN 108 N -4.43 0.39 -0.99 6.45 3.02 -1.26 -2.56 115.26 115.88 2wq5 n ASN 108 Ca 0.06 0.61 0.11 0.00 -0.03 0.00 0.00 54.58 55.34 2wq5 n ASN 108 Cb 0.46 -0.69 0.16 0.00 -0.61 0.00 0.00 39.78 39.09 2wq5 n ASN 108 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2wq5 n ASN 109 N -1.95 3.13 -4.72 6.41 3.02 0.10 -4.87 115.26 116.38 2wq5 n ASN 109 Ca 0.02 -1.94 -0.41 0.00 -0.03 0.00 0.00 54.58 52.22 2wq5 n ASN 109 Cb 0.16 -0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 39.16 2wq5 n ASN 109 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wq5 s TYR 110 N -1.56 3.68 -1.24 3.10 5.04 -1.06 -0.88 117.35 124.43 2wq5 s TYR 110 Ca 0.32 1.64 -0.01 0.00 -2.44 0.00 0.00 57.07 56.58 2wq5 s TYR 110 Cb 0.20 -3.05 -0.01 0.00 0.35 0.00 0.00 41.96 39.45 2wq5 s TYR 110 CO 0.28 0.06 0.82 -1.71 -1.34 0.00 0.00 175.55 173.66 2wq5 n ASN 111 N 3.63 -2.03 -4.91 4.32 4.05 0.04 -4.95 115.26 115.41 2wq5 n ASN 111 Ca 0.04 -0.75 -0.27 0.00 0.45 0.00 0.00 54.58 54.05 2wq5 n ASN 111 Cb 0.51 -4.49 0.02 0.00 1.23 0.00 0.00 39.78 37.05 2wq5 n ASN 111 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 2wq5 s ILE 112 N -3.53 3.98 -0.34 -1.44 -5.25 -1.26 -5.01 121.20 108.35 2wq5 s ILE 112 Ca 0.05 0.10 -0.29 0.00 -0.99 0.00 0.00 60.65 59.53 2wq5 s ILE 112 Cb -0.01 -3.57 0.01 0.00 2.95 0.00 0.00 42.46 41.84 2wq5 s ILE 112 CO 0.78 -0.59 1.28 -0.62 -1.79 0.00 0.00 174.94 174.00 2wq5 s ASP 113 N -4.26 6.63 0.31 4.36 -1.08 -1.26 -4.90 116.67 116.48 2wq5 s ASP 113 Ca 0.53 1.05 0.04 0.00 -0.52 0.00 0.00 52.55 53.65 2wq5 s ASP 113 Cb -0.11 -2.54 0.52 0.00 -1.46 0.00 0.00 42.92 39.34 2wq5 s ASP 113 CO 0.46 -1.14 1.79 -0.07 0.52 0.00 0.00 175.17 176.73 2wq5 h LEU 114 N 11.08 0.44 -1.20 -1.34 -0.00 -1.94 -1.87 115.31 120.47 2wq5 h LEU 114 Ca -0.26 -0.12 -0.06 0.00 -0.00 0.00 0.00 57.88 57.44 2wq5 h LEU 114 Cb 1.09 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.62 2wq5 h LEU 114 CO 1.05 0.62 -0.10 0.11 -0.00 0.00 0.00 178.44 180.13 2wq5 h LYS 115 N 0.41 0.43 0.03 1.13 1.57 -1.94 0.23 116.57 118.43 2wq5 h LYS 115 Ca 0.07 -0.11 -0.22 0.00 -1.87 0.00 0.00 60.65 58.52 2wq5 h LYS 115 Cb 0.53 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2wq5 h LYS 115 CO 0.03 0.54 -0.99 0.00 -0.57 0.00 0.00 179.45 178.47 2wq5 h ALA 116 N 1.50 0.38 0.00 3.86 0.00 -1.77 -3.41 119.26 119.82 2wq5 h ALA 116 Ca 0.08 -0.78 -0.14 0.00 0.00 0.00 0.00 54.91 54.07 2wq5 h ALA 116 Cb 0.43 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2wq5 h ALA 116 CO 0.02 0.95 -1.54 0.54 0.00 0.00 0.00 179.25 179.23 2wq5 n ARG 117 N -3.61 2.67 -0.22 0.00 5.12 -0.86 -4.83 116.66 114.93 2wq5 n ARG 117 Ca -0.05 -0.01 0.08 0.00 -1.93 0.00 0.00 57.85 55.95 2wq5 n ARG 117 Cb 0.88 -1.20 0.18 0.00 -1.16 0.00 0.00 32.46 31.15 2wq5 n ARG 117 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70