#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wb1 s HIS 0 N 0.00 3.58 -0.36 0.54 2.46 -1.26 -5.04 115.29 115.20 1wb1 s HIS 0 Ca 0.00 -2.41 -0.28 0.00 0.47 0.00 0.00 55.06 52.84 1wb1 s HIS 0 Cb 0.00 -3.48 -0.07 0.00 -0.13 0.00 0.00 32.58 28.90 1wb1 s HIS 0 CO 0.00 -0.90 2.32 -0.12 -2.47 0.00 0.00 174.74 173.56 1wb1 n MET 1 N 3.65 1.45 -2.64 2.88 1.56 -1.26 -4.95 117.12 117.82 1wb1 n MET 1 Ca 0.11 0.27 -0.34 0.00 -0.27 0.00 0.00 57.70 57.48 1wb1 n MET 1 Cb 0.42 -3.22 -0.05 0.00 2.15 0.00 0.00 33.22 32.52 1wb1 n MET 1 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1wb1 s ASP 2 N 9.93 6.56 0.64 6.12 -0.00 -1.26 -5.06 116.67 133.60 1wb1 s ASP 2 Ca 1.01 1.84 -0.01 0.00 -0.00 0.00 0.00 52.55 55.40 1wb1 s ASP 2 Cb -0.33 -2.55 0.10 0.00 -0.00 0.00 0.00 42.92 40.13 1wb1 s ASP 2 CO 0.33 -0.63 0.70 0.49 -0.00 0.00 0.00 175.17 176.06 1wb1 n PHE 3 N -0.85 -3.11 -3.69 4.23 3.01 -1.26 -4.95 117.46 110.83 1wb1 n PHE 3 Ca 0.08 -1.20 -0.12 0.00 1.01 0.00 0.00 57.45 57.22 1wb1 n PHE 3 Cb 0.53 -0.51 -0.12 0.00 -0.01 0.00 0.00 39.48 39.36 1wb1 n PHE 3 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1wb1 s LYS 4 N -4.29 0.22 -0.06 -1.08 2.47 -0.78 -5.01 119.74 111.21 1wb1 s LYS 4 Ca 0.46 0.70 -0.23 0.00 -1.56 0.00 0.00 55.97 55.34 1wb1 s LYS 4 Cb -0.03 -0.03 -0.04 0.00 -1.46 0.00 0.00 37.83 36.28 1wb1 s LYS 4 CO 0.31 -0.22 0.68 -0.80 0.16 0.00 0.00 175.35 175.48 1wb1 s ASN 5 N 1.87 6.98 0.02 1.43 0.01 -1.26 0.72 114.94 124.70 1wb1 s ASN 5 Ca -0.05 1.17 -0.06 0.00 -0.71 0.00 0.00 52.86 53.22 1wb1 s ASN 5 Cb -0.11 -2.40 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 1wb1 s ASN 5 CO -0.10 -0.09 0.10 -0.63 -1.51 0.00 0.00 177.10 174.88 1wb1 s ILE 6 N 0.69 0.11 0.06 0.60 -1.09 -0.65 -4.94 121.20 115.97 1wb1 s ILE 6 Ca 0.36 -0.89 0.08 0.00 -2.23 0.00 0.00 60.65 57.98 1wb1 s ILE 6 Cb -0.18 -0.61 -0.03 0.00 -1.58 0.00 0.00 42.46 40.06 1wb1 s ILE 6 CO 0.18 -0.49 -0.22 0.20 -1.23 0.00 0.00 174.94 173.38 1wb1 s ASN 7 N -1.71 3.56 -0.03 3.58 -0.87 -1.26 -0.87 114.94 117.33 1wb1 s ASN 7 Ca -0.11 -0.52 -0.01 0.00 -1.57 0.00 0.00 52.86 50.65 1wb1 s ASN 7 Cb -0.05 -0.47 0.02 0.00 -0.02 0.00 0.00 41.25 40.73 1wb1 s ASN 7 CO -0.01 0.24 0.07 -0.22 -2.57 0.00 0.00 177.10 174.61 1wb1 s LEU 8 N -1.48 1.32 -0.03 0.60 0.20 -1.11 -2.70 118.68 115.47 1wb1 s LEU 8 Ca 0.14 0.13 -0.04 0.00 0.69 0.00 0.00 54.13 55.04 1wb1 s LEU 8 Cb -0.10 0.14 -0.04 0.00 -0.43 0.00 0.00 46.19 45.76 1wb1 s LEU 8 CO 0.05 -0.08 0.19 -0.83 -0.29 0.00 0.00 176.35 175.38 1wb1 s GLY 9 N 0.63 2.19 -0.81 7.98 0.00 -1.16 -1.66 107.32 114.49 1wb1 s GLY 9 Ca -0.05 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 43.99 1wb1 s GLY 9 CO -0.02 -0.54 0.82 1.39 0.00 0.00 0.00 173.10 174.75 1wb1 n ILE 10 N 1.23 2.90 -2.04 0.90 2.08 -1.26 -1.03 119.36 122.13 1wb1 n ILE 10 Ca -0.13 -5.23 -0.30 0.00 0.56 0.00 0.00 62.75 57.65 1wb1 n ILE 10 Cb 0.53 -2.21 0.01 0.00 -0.75 0.00 0.00 39.64 37.22 1wb1 n ILE 10 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1wb1 s PHE 11 N -1.96 3.61 0.00 1.39 0.40 -0.37 -4.85 117.98 116.20 1wb1 s PHE 11 Ca 0.32 1.18 0.00 0.00 -0.60 0.00 0.00 56.93 57.82 1wb1 s PHE 11 Cb 0.02 -2.63 0.00 0.00 0.51 0.00 0.00 43.02 40.92 1wb1 s PHE 11 CO -0.06 -0.61 0.00 0.41 0.70 0.00 0.00 175.22 175.66 1wb1 n GLY 12 N -2.64 2.91 3.78 4.36 0.00 -1.26 0.22 105.19 112.56 1wb1 n GLY 12 Ca 0.05 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 1wb1 n GLY 12 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1wb1 s HIS 13 N -2.00 2.75 0.35 1.61 2.46 -1.25 -4.80 115.29 114.41 1wb1 s HIS 13 Ca 0.00 1.55 -0.26 0.00 0.47 0.00 0.00 55.06 56.82 1wb1 s HIS 13 Cb 0.00 -3.18 -0.13 0.00 -0.13 0.00 0.00 32.58 29.14 1wb1 s HIS 13 CO 0.00 -1.42 0.96 1.51 -2.47 0.00 0.00 174.74 173.32 1wb1 n ILE 14 N -1.65 2.14 -0.55 0.89 3.06 -1.26 -1.93 119.36 120.05 1wb1 n ILE 14 Ca 0.10 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.85 1wb1 n ILE 14 Cb 0.52 -1.01 0.00 0.00 0.54 0.00 0.00 39.64 39.68 1wb1 n ILE 14 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1wb1 n ASP 15 N 0.95 0.00 0.14 9.51 2.03 -1.26 -4.87 116.55 123.06 1wb1 n ASP 15 Ca 0.10 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.44 1wb1 n ASP 15 Cb 0.36 -1.16 0.43 0.00 -0.72 0.00 0.00 41.12 40.03 1wb1 n ASP 15 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 1wb1 h HIS 16 N 0.00 0.20 0.00 -0.67 3.86 -1.75 -3.46 115.15 113.33 1wb1 h HIS 16 Ca 0.00 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1wb1 h HIS 16 Cb 0.00 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.41 1wb1 h HIS 16 CO 0.00 0.30 0.00 0.41 0.86 0.00 0.00 177.93 179.50 1wb1 n GLY 17 N -1.00 0.24 0.44 2.45 0.00 -1.26 -4.32 105.19 101.75 1wb1 n GLY 17 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1wb1 n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wb1 h LYS 18 N 0.00 -0.57 0.00 1.61 1.57 -1.88 -2.74 116.57 114.56 1wb1 h LYS 18 Ca 0.00 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1wb1 h LYS 18 Cb 0.00 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1wb1 h LYS 18 CO 0.00 -0.38 0.00 2.41 -0.57 0.00 0.00 179.45 180.91 1wb1 n THR 19 N -5.25 0.00 -0.03 -0.16 -1.04 -1.26 -3.19 114.28 103.35 1wb1 n THR 19 Ca -0.06 0.93 -0.01 0.00 -2.04 0.00 0.00 64.05 62.87 1wb1 n THR 19 Cb 0.36 -1.65 -0.01 0.00 -1.82 0.00 0.00 70.33 67.22 1wb1 n THR 19 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1wb1 n THR 20 N -0.67 -0.04 0.00 12.58 -1.04 -1.24 -0.82 114.28 123.04 1wb1 n THR 20 Ca 0.00 0.71 0.00 0.00 -2.04 0.00 0.00 64.05 62.72 1wb1 n THR 20 Cb 0.00 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 1wb1 n THR 20 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1wb1 n LEU 21 N -2.75 0.00 -0.33 -4.42 7.94 -1.03 0.13 117.00 116.53 1wb1 n LEU 21 Ca 0.00 0.59 0.25 0.00 -1.11 0.00 0.00 56.01 55.74 1wb1 n LEU 21 Cb 0.02 -0.29 0.55 0.00 0.53 0.00 0.00 43.42 44.22 1wb1 n LEU 21 CO -0.01 -0.29 1.23 0.77 -1.11 0.00 0.00 177.39 177.98 1wb1 h SER 22 N 0.00 0.38 -0.05 1.96 4.64 -0.94 0.44 113.55 119.99 1wb1 h SER 22 Ca 0.00 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1wb1 h SER 22 Cb 0.00 0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1wb1 h SER 22 CO 0.00 0.05 0.03 0.11 -0.87 0.00 0.00 176.83 176.15 1wb1 h LYS 23 N 0.32 0.07 0.00 4.77 1.57 0.16 -0.24 116.57 123.22 1wb1 h LYS 23 Ca 0.61 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 1wb1 h LYS 23 Cb 1.68 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.98 1wb1 h LYS 23 CO -0.28 0.12 0.00 0.28 -0.57 0.00 0.00 179.45 179.00 1wb1 h VAL 24 N -0.00 0.00 0.00 0.50 2.07 0.13 -1.80 116.25 117.15 1wb1 h VAL 24 Ca 0.02 -0.20 -0.25 0.00 0.82 0.00 0.00 66.70 67.09 1wb1 h VAL 24 Cb 0.07 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1wb1 h VAL 24 CO -0.00 0.00 -1.54 -0.07 0.02 0.00 0.00 177.57 175.98 1wb1 h LEU 25 N 0.00 0.00 0.00 2.57 3.38 0.05 -3.42 115.31 117.90 1wb1 h LEU 25 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wb1 h LEU 25 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1wb1 h LEU 25 CO 0.00 0.90 -0.12 0.41 0.09 0.00 0.00 178.44 179.73 1wb1 n THR 26 N -3.05 0.28 -0.30 0.22 -1.04 -0.20 -4.30 114.28 105.89 1wb1 n THR 26 Ca -0.13 0.28 0.05 0.00 -2.04 0.00 0.00 64.05 62.21 1wb1 n THR 26 Cb 0.99 -1.44 0.13 0.00 -1.82 0.00 0.00 70.33 68.19 1wb1 n THR 26 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 1wb1 h GLU 27 N -0.12 0.01 0.00 -2.82 4.11 -1.55 0.16 114.58 114.37 1wb1 h GLU 27 Ca 0.00 -0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.33 1wb1 h GLU 27 Cb 0.12 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1wb1 h GLU 27 CO 0.00 0.01 -0.49 0.82 0.07 0.00 0.00 179.01 179.42 1wb1 h ILE 28 N 0.01 1.18 0.00 -1.06 2.04 -1.80 -3.51 117.51 114.36 1wb1 h ILE 28 Ca 0.43 -1.77 -0.40 0.00 1.00 0.00 0.00 64.86 64.11 1wb1 h ILE 28 Cb 0.69 2.00 -0.06 0.00 -0.74 0.00 0.00 36.82 38.71 1wb1 h ILE 28 CO -0.87 0.48 -2.41 0.00 0.00 0.00 0.00 178.15 175.35 1wb1 n ALA 29 N -2.37 1.40 0.00 1.87 0.00 0.55 -5.12 120.51 116.84 1wb1 n ALA 29 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1wb1 n ALA 29 Cb 0.55 0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1wb1 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wb1 n GLY 50 N 1.79 0.51 3.65 0.00 0.00 -1.26 -4.93 105.19 104.94 1wb1 n GLY 50 Ca -0.47 0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 1wb1 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wb1 s PHE 51 N 0.00 2.58 -0.29 1.61 0.40 -1.26 -4.90 117.98 116.12 1wb1 s PHE 51 Ca 0.00 -0.42 -0.16 0.00 -0.60 0.00 0.00 56.93 55.75 1wb1 s PHE 51 Cb 0.00 -1.50 0.15 0.00 0.51 0.00 0.00 43.02 42.18 1wb1 s PHE 51 CO 0.00 0.46 1.00 -1.12 0.70 0.00 0.00 175.22 176.26 1wb1 s SER 52 N -3.73 -0.47 0.18 1.36 0.01 -1.26 -5.04 113.70 104.75 1wb1 s SER 52 Ca 0.35 0.76 -0.04 0.00 1.31 0.00 0.00 55.95 58.33 1wb1 s SER 52 Cb -0.01 1.18 -0.03 0.00 0.21 0.00 0.00 66.02 67.37 1wb1 s SER 52 CO 0.20 -0.12 0.17 0.00 0.41 0.00 0.00 173.24 173.90 1wb1 s ALA 53 N 1.28 0.70 -0.29 1.44 0.00 -1.26 -0.51 121.76 123.12 1wb1 s ALA 53 Ca -0.09 -1.39 -0.15 0.00 0.00 0.00 0.00 51.96 50.34 1wb1 s ALA 53 Cb -0.04 1.10 0.13 0.00 0.00 0.00 0.00 23.12 24.31 1wb1 s ALA 53 CO -0.14 -0.60 0.84 -0.59 0.00 0.00 0.00 175.76 175.27 1wb1 s PHE 54 N -4.07 -0.85 0.37 0.00 -0.00 -1.14 -4.60 117.98 107.68 1wb1 s PHE 54 Ca 0.29 1.62 -0.24 0.00 -0.00 0.00 0.00 56.93 58.60 1wb1 s PHE 54 Cb 0.06 0.51 -0.10 0.00 -0.00 0.00 0.00 43.02 43.48 1wb1 s PHE 54 CO 0.06 -0.42 0.94 0.15 -0.00 0.00 0.00 175.22 175.95 1wb1 s LYS 55 N 1.81 4.41 -0.29 1.99 1.02 -1.26 -2.72 119.74 124.71 1wb1 s LYS 55 Ca -0.08 1.22 -0.03 0.00 0.02 0.00 0.00 55.97 57.10 1wb1 s LYS 55 Cb -0.06 -2.51 0.10 0.00 -0.52 0.00 0.00 37.83 34.84 1wb1 s LYS 55 CO -0.17 0.14 0.12 -0.51 -0.92 0.00 0.00 175.35 174.00 1wb1 s LEU 56 N -2.58 1.10 -0.51 3.17 1.43 0.21 -4.95 118.68 116.56 1wb1 s LEU 56 Ca 0.55 -1.38 -0.22 0.00 -1.03 0.00 0.00 54.13 52.06 1wb1 s LEU 56 Cb -0.14 -0.52 0.03 0.00 0.03 0.00 0.00 46.19 45.59 1wb1 s LEU 56 CO 0.19 -0.43 0.56 1.21 0.23 0.00 0.00 176.35 178.11 1wb1 n GLU 57 N 5.12 -1.55 0.00 1.70 2.13 -1.26 -0.47 120.64 126.30 1wb1 n GLU 57 Ca -0.05 1.01 0.00 0.00 0.66 0.00 0.00 57.16 58.78 1wb1 n GLU 57 Cb 0.42 -1.79 0.00 0.00 0.27 0.00 0.00 31.44 30.34 1wb1 n GLU 57 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1wb1 n ASN 58 N -0.84 0.00 -4.71 4.31 2.85 -1.26 -4.98 115.26 110.64 1wb1 n ASN 58 Ca -0.15 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 53.95 1wb1 n ASN 58 Cb 0.60 -0.13 -0.08 0.00 1.24 0.00 0.00 39.78 41.41 1wb1 n ASN 58 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1wb1 s TYR 59 N -1.82 3.41 -0.62 1.20 1.51 0.38 -1.87 117.35 119.54 1wb1 s TYR 59 Ca 0.00 0.49 -0.09 0.00 -1.01 0.00 0.00 57.07 56.45 1wb1 s TYR 59 Cb 0.00 -2.32 0.16 0.00 -0.11 0.00 0.00 41.96 39.69 1wb1 s TYR 59 CO 0.00 0.19 0.50 0.50 -1.11 0.00 0.00 175.55 175.63 1wb1 s ARG 60 N 0.66 2.85 0.52 -0.62 3.52 0.22 0.67 118.95 126.77 1wb1 s ARG 60 Ca 0.14 -2.18 -0.17 0.00 -0.13 0.00 0.00 55.73 53.39 1wb1 s ARG 60 Cb -0.13 -4.03 -0.08 0.00 -1.56 0.00 0.00 34.95 29.15 1wb1 s ARG 60 CO 0.03 -1.22 0.99 0.42 -0.81 0.00 0.00 175.30 174.71 1wb1 s ILE 61 N 0.62 4.47 -0.32 4.11 1.01 -1.10 -1.64 121.20 128.34 1wb1 s ILE 61 Ca 0.12 1.19 -0.00 0.00 0.00 0.00 0.00 60.65 61.96 1wb1 s ILE 61 Cb -0.20 -3.69 0.13 0.00 0.01 0.00 0.00 42.46 38.71 1wb1 s ILE 61 CO -0.04 -0.67 0.27 -0.89 0.00 0.00 0.00 174.94 173.62 1wb1 s THR 62 N -2.60 -0.22 0.07 2.92 2.01 -0.05 -2.89 115.64 114.87 1wb1 s THR 62 Ca 0.59 -0.90 -0.37 0.00 0.31 0.00 0.00 61.69 61.32 1wb1 s THR 62 Cb -0.10 -0.92 -0.18 0.00 0.01 0.00 0.00 72.50 71.30 1wb1 s THR 62 CO 0.31 -0.65 1.21 0.18 -0.69 0.00 0.00 174.62 174.98 1wb1 n LEU 63 N 4.78 0.98 -2.34 4.42 4.32 0.34 -2.75 117.00 126.75 1wb1 n LEU 63 Ca 0.03 1.14 -0.26 0.00 -0.02 0.00 0.00 56.01 56.90 1wb1 n LEU 63 Cb 0.43 -1.09 0.01 0.00 -1.62 0.00 0.00 43.42 41.15 1wb1 n LEU 63 CO 0.06 -1.42 0.19 0.55 -1.22 0.00 0.00 177.39 175.54 1wb1 n VAL 64 N 2.00 2.42 -2.51 4.08 3.14 -0.66 -4.13 118.33 122.66 1wb1 n VAL 64 Ca 0.19 -4.71 -0.27 0.00 -2.96 0.00 0.00 64.34 56.59 1wb1 n VAL 64 Cb 0.16 -1.22 0.01 0.00 -1.06 0.00 0.00 33.84 31.73 1wb1 n VAL 64 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1wb1 s ASP 65 N -3.56 5.95 -0.03 6.55 -1.08 -1.26 -4.83 116.67 118.41 1wb1 s ASP 65 Ca 0.49 0.82 -0.10 0.00 -0.52 0.00 0.00 52.55 53.24 1wb1 s ASP 65 Cb 0.40 -1.99 0.02 0.00 -1.46 0.00 0.00 42.92 39.89 1wb1 s ASP 65 CO -0.12 -0.81 0.23 0.00 0.52 0.00 0.00 175.17 174.99 1wb1 s ALA 66 N -2.86 -0.56 0.05 3.66 0.00 -1.26 -4.92 121.76 115.87 1wb1 s ALA 66 Ca 0.51 0.26 -0.23 0.00 0.00 0.00 0.00 51.96 52.50 1wb1 s ALA 66 Cb -0.10 -0.05 -0.15 0.00 0.00 0.00 0.00 23.12 22.81 1wb1 s ALA 66 CO 0.45 -0.20 1.52 -1.00 0.00 0.00 0.00 175.76 176.53 1wb1 h PRO 67 N 4.57 0.11 -7.31 0.00 0.13 -1.99 -3.42 132.00 124.10 1wb1 h PRO 67 Ca -0.29 -0.03 -0.50 0.00 -0.87 0.00 0.00 66.00 64.31 1wb1 h PRO 67 Cb 1.19 -0.01 0.07 0.00 0.13 0.00 0.00 31.00 32.37 1wb1 h PRO 67 CO 0.39 0.33 0.39 0.20 -0.23 0.00 0.00 178.00 179.07 1wb1 s GLY 68 N -2.77 1.79 0.01 1.56 0.00 -1.26 -4.94 107.32 101.71 1wb1 s GLY 68 Ca -0.14 0.07 -0.07 0.00 0.00 0.00 0.00 44.72 44.58 1wb1 s GLY 68 CO 0.69 0.36 1.11 0.84 0.00 0.00 0.00 173.10 176.10 1wb1 h HIS 69 N -0.17 -0.26 -0.43 1.90 2.76 -1.95 -1.80 115.15 115.20 1wb1 h HIS 69 Ca -0.45 -0.00 0.12 0.00 -2.20 0.00 0.00 60.37 57.85 1wb1 h HIS 69 Cb 1.20 0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.24 1wb1 h HIS 69 CO 0.63 -0.14 0.43 0.00 -1.30 0.00 0.00 177.93 177.56 1wb1 h ALA 70 N -1.69 2.17 -0.61 5.26 0.00 -2.00 -2.48 119.26 119.91 1wb1 h ALA 70 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1wb1 h ALA 70 Cb 0.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wb1 h ALA 70 CO 0.01 -0.65 0.00 -0.25 0.00 0.00 0.00 179.25 178.36 1wb1 n ASP 71 N -3.81 0.00 -0.13 0.00 8.00 -0.83 -2.57 116.55 117.21 1wb1 n ASP 71 Ca 0.08 0.89 -0.08 0.00 0.71 0.00 0.00 54.79 56.39 1wb1 n ASP 71 Cb 0.62 -0.40 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 1wb1 n ASP 71 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wb1 h LEU 72 N 0.00 -1.14 -0.24 0.64 4.07 -0.91 -1.86 115.31 115.86 1wb1 h LEU 72 Ca 0.00 0.20 0.02 0.00 0.08 0.00 0.00 57.88 58.18 1wb1 h LEU 72 Cb 0.00 0.53 -0.03 0.00 1.08 0.00 0.00 40.66 42.24 1wb1 h LEU 72 CO 0.00 -0.33 -0.14 -0.38 -1.08 0.00 0.00 178.44 176.51 1wb1 n ILE 73 N -5.42 -0.17 -0.26 1.22 5.41 -1.02 0.21 119.36 119.34 1wb1 n ILE 73 Ca 0.01 1.50 0.32 0.00 1.00 0.00 0.00 62.75 65.58 1wb1 n ILE 73 Cb 0.34 -1.94 0.74 0.00 -0.71 0.00 0.00 39.64 38.07 1wb1 n ILE 73 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1wb1 h ARG 74 N 0.00 0.00 -0.13 0.38 3.08 -1.12 0.54 114.38 117.12 1wb1 h ARG 74 Ca 0.04 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 1wb1 h ARG 74 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1wb1 h ARG 74 CO -0.23 0.00 -0.41 0.00 -1.07 0.00 0.00 179.97 178.26 1wb1 h ALA 75 N 1.46 0.23 0.41 0.04 0.00 0.33 -2.22 119.26 119.51 1wb1 h ALA 75 Ca 0.50 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1wb1 h ALA 75 Cb 2.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1wb1 h ALA 75 CO -0.01 0.34 -0.37 0.28 0.00 0.00 0.00 179.25 179.49 1wb1 h VAL 76 N 0.12 0.00 -0.96 0.00 2.07 0.41 -0.23 116.25 117.65 1wb1 h VAL 76 Ca -0.01 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.75 1wb1 h VAL 76 Cb 1.03 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.67 1wb1 h VAL 76 CO 0.09 0.00 0.52 -0.37 0.02 0.00 0.00 177.57 177.82 1wb1 h VAL 77 N -0.77 0.50 0.22 2.57 -1.51 -1.31 1.49 116.25 117.44 1wb1 h VAL 77 Ca -0.05 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.24 1wb1 h VAL 77 Cb 0.66 -0.04 0.00 0.00 -2.13 0.00 0.00 31.29 29.78 1wb1 h VAL 77 CO -0.03 0.09 -0.11 -1.28 -1.23 0.00 0.00 177.57 175.02 1wb1 h SER 78 N 0.50 -0.25 1.24 4.19 0.87 -1.02 -3.39 113.55 115.68 1wb1 h SER 78 Ca 0.62 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 61.06 1wb1 h SER 78 Cb 1.18 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.19 1wb1 h SER 78 CO -0.50 -0.10 -0.80 0.00 -0.53 0.00 0.00 176.83 174.90 1wb1 h ALA 79 N -1.70 0.66 0.00 6.23 0.00 -0.90 -3.44 119.26 120.11 1wb1 h ALA 79 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1wb1 h ALA 79 Cb 0.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1wb1 h ALA 79 CO 0.05 0.70 0.00 0.00 0.00 0.00 0.00 179.25 180.00 1wb1 n ALA 80 N -2.28 0.00 0.53 0.00 0.00 0.51 0.25 120.51 119.52 1wb1 n ALA 80 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1wb1 n ALA 80 Cb 0.76 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.23 1wb1 n ALA 80 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1wb1 n ASP 81 N 0.00 0.00 0.01 0.00 5.75 -1.26 -2.90 116.55 118.15 1wb1 n ASP 81 Ca 0.00 -0.51 -0.02 0.00 -0.01 0.00 0.00 54.79 54.25 1wb1 n ASP 81 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 1wb1 n ASP 81 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1wb1 n ILE 82 N -0.54 1.04 -1.40 2.12 5.41 0.68 -4.80 119.36 121.88 1wb1 n ILE 82 Ca 0.01 0.30 -0.14 0.00 1.00 0.00 0.00 62.75 63.92 1wb1 n ILE 82 Cb 0.00 -1.63 -0.13 0.00 -0.71 0.00 0.00 39.64 37.17 1wb1 n ILE 82 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1wb1 n ILE 83 N -3.47 0.00 0.31 1.39 5.41 -1.14 -4.53 119.36 117.32 1wb1 n ILE 83 Ca -0.03 -0.44 0.18 0.00 1.00 0.00 0.00 62.75 63.46 1wb1 n ILE 83 Cb 0.09 -0.61 0.99 0.00 -0.71 0.00 0.00 39.64 39.40 1wb1 n ILE 83 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1wb1 h ASP 84 N 10.91 0.00 -3.60 4.38 5.19 -1.77 -3.44 116.42 128.08 1wb1 h ASP 84 Ca 0.02 0.00 0.18 0.00 -0.62 0.00 0.00 57.03 56.61 1wb1 h ASP 84 Cb 1.06 0.00 -0.25 0.00 0.18 0.00 0.00 39.33 40.32 1wb1 h ASP 84 CO 1.28 0.02 0.79 -0.22 -3.12 0.00 0.00 179.24 177.99 1wb1 s LEU 85 N -6.94 -0.17 0.07 1.55 2.96 -1.25 -4.56 118.68 110.34 1wb1 s LEU 85 Ca -0.04 0.17 -0.15 0.00 -0.22 0.00 0.00 54.13 53.89 1wb1 s LEU 85 Cb 0.14 1.41 0.02 0.00 0.50 0.00 0.00 46.19 48.26 1wb1 s LEU 85 CO 0.50 -0.17 0.34 0.00 -1.32 0.00 0.00 176.35 175.69 1wb1 s ALA 86 N -1.19 -0.75 0.11 5.97 0.00 -1.01 -2.96 121.76 121.92 1wb1 s ALA 86 Ca 0.05 -0.03 0.07 0.00 0.00 0.00 0.00 51.96 52.05 1wb1 s ALA 86 Cb -0.01 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.51 1wb1 s ALA 86 CO -0.04 -0.49 -0.08 -0.48 0.00 0.00 0.00 175.76 174.67 1wb1 s LEU 87 N -2.34 3.13 -0.40 0.00 2.34 -0.20 -2.73 118.68 118.48 1wb1 s LEU 87 Ca -0.02 -0.36 -0.09 0.00 0.06 0.00 0.00 54.13 53.72 1wb1 s LEU 87 Cb 0.01 -1.90 0.07 0.00 -0.56 0.00 0.00 46.19 43.80 1wb1 s LEU 87 CO -0.06 0.17 0.24 -0.63 -1.06 0.00 0.00 176.35 175.00 1wb1 s ILE 88 N -1.29 4.24 0.25 1.48 1.01 -1.24 -1.24 121.20 124.41 1wb1 s ILE 88 Ca 0.23 -1.30 -0.30 0.00 0.00 0.00 0.00 60.65 59.28 1wb1 s ILE 88 Cb -0.11 -3.54 -0.09 0.00 0.01 0.00 0.00 42.46 38.72 1wb1 s ILE 88 CO 0.15 -0.44 1.18 -0.69 0.00 0.00 0.00 174.94 175.14 1wb1 s VAL 89 N 1.44 3.36 -0.24 2.92 1.01 0.61 -1.41 120.40 128.08 1wb1 s VAL 89 Ca 0.02 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.23 1wb1 s VAL 89 Cb -0.22 -3.81 0.13 0.00 0.00 0.00 0.00 36.38 32.48 1wb1 s VAL 89 CO 0.03 0.26 0.45 0.54 0.00 0.00 0.00 175.10 176.38 1wb1 s VAL 90 N -0.72 -0.72 0.24 2.92 0.11 -0.27 -3.96 120.40 118.01 1wb1 s VAL 90 Ca 0.49 0.03 -0.30 0.00 -2.93 0.00 0.00 61.98 59.26 1wb1 s VAL 90 Cb -0.34 -0.81 -0.10 0.00 -1.53 0.00 0.00 36.38 33.59 1wb1 s VAL 90 CO 0.42 -0.03 1.52 -0.62 -3.33 0.00 0.00 175.10 173.05 1wb1 s ASP 91 N 2.65 6.55 0.09 3.54 3.68 -1.26 -1.40 116.67 130.52 1wb1 s ASP 91 Ca 0.08 2.74 -0.36 0.00 2.13 0.00 0.00 52.55 57.14 1wb1 s ASP 91 Cb -0.14 -2.62 -0.17 0.00 -1.45 0.00 0.00 42.92 38.54 1wb1 s ASP 91 CO -0.16 -0.79 1.57 0.00 0.13 0.00 0.00 175.17 175.91 1wb1 h ALA 92 N 5.37 -1.12 -2.48 3.66 0.00 -1.74 0.13 119.26 123.07 1wb1 h ALA 92 Ca -0.46 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1wb1 h ALA 92 Cb 1.22 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1wb1 h ALA 92 CO 0.81 -1.17 0.00 1.63 0.00 0.00 0.00 179.25 180.52 1wb1 n LYS 93 N -5.56 0.00 -0.35 0.00 4.76 -1.26 -2.45 118.16 113.29 1wb1 n LYS 93 Ca -0.12 0.49 0.12 0.00 -2.87 0.00 0.00 58.31 55.93 1wb1 n LYS 93 Cb 0.46 -1.09 0.31 0.00 -1.84 0.00 0.00 35.03 32.88 1wb1 n LYS 93 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1wb1 h GLU 94 N 0.00 0.76 0.00 1.97 4.39 -1.98 -3.48 114.58 116.25 1wb1 h GLU 94 Ca 0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1wb1 h GLU 94 Cb 0.00 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 1wb1 h GLU 94 CO 0.00 0.51 0.00 0.41 -1.16 0.00 0.00 179.01 178.77 1wb1 n GLY 95 N -1.33 -1.36 3.39 -3.84 0.00 0.46 -4.87 105.19 97.63 1wb1 n GLY 95 Ca 0.23 -1.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.28 1wb1 n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wb1 n PRO 96 N -1.69 0.31 -4.21 1.61 -0.04 -1.26 -4.68 135.00 125.03 1wb1 n PRO 96 Ca 0.00 0.13 -0.12 0.00 -0.04 0.00 0.00 63.50 63.47 1wb1 n PRO 96 Cb 0.00 -1.53 -0.10 0.00 -0.04 0.00 0.00 33.50 31.83 1wb1 n PRO 96 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1wb1 s LYS 97 N -2.00 1.00 0.06 0.54 -0.14 -1.26 -5.00 119.74 112.94 1wb1 s LYS 97 Ca 0.64 -1.45 -0.08 0.00 -1.36 0.00 0.00 55.97 53.71 1wb1 s LYS 97 Cb -0.42 -0.23 0.01 0.00 -1.68 0.00 0.00 37.83 35.51 1wb1 s LYS 97 CO 0.59 -0.09 0.49 0.25 -0.76 0.00 0.00 175.35 175.84 1wb1 n THR 98 N -0.16 -0.20 -0.26 2.17 -2.24 -1.26 0.24 114.28 112.57 1wb1 n THR 98 Ca -0.09 0.76 -0.06 0.00 -2.27 0.00 0.00 64.05 62.39 1wb1 n THR 98 Cb 0.62 -0.97 0.05 0.00 -2.10 0.00 0.00 70.33 67.94 1wb1 n THR 98 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1wb1 h GLN 99 N 0.00 1.09 -0.38 -0.78 4.20 -1.89 -2.90 115.11 114.45 1wb1 h GLN 99 Ca 0.07 -0.20 0.04 0.00 0.06 0.00 0.00 58.65 58.62 1wb1 h GLN 99 Cb 0.15 -0.17 -0.07 0.00 0.30 0.00 0.00 27.48 27.69 1wb1 h GLN 99 CO -0.31 0.90 -0.45 1.15 -0.67 0.00 0.00 178.83 179.46 1wb1 h THR 100 N 1.05 0.00 -0.69 -0.54 2.02 0.28 0.39 112.91 115.42 1wb1 h THR 100 Ca 0.24 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.56 1wb1 h THR 100 Cb 0.22 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.50 1wb1 h THR 100 CO -0.02 0.00 -0.14 1.23 0.37 0.00 0.00 175.52 176.96 1wb1 h GLY 101 N -0.28 0.54 0.00 2.16 0.00 -1.38 0.19 103.07 104.31 1wb1 h GLY 101 Ca 0.07 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1wb1 h GLY 101 CO -0.51 -0.26 0.00 1.18 0.00 0.00 0.00 176.54 176.95 1wb1 n GLU 102 N -5.44 0.00 -0.27 4.80 -0.58 0.13 0.84 120.64 120.12 1wb1 n GLU 102 Ca 0.09 0.50 -0.00 0.00 -0.42 0.00 0.00 57.16 57.33 1wb1 n GLU 102 Cb 0.37 -1.05 0.07 0.00 -0.57 0.00 0.00 31.44 30.26 1wb1 n GLU 102 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1wb1 h HIS 103 N 0.00 -0.63 -0.66 -0.32 3.86 -0.80 0.16 115.15 116.76 1wb1 h HIS 103 Ca 0.00 0.08 0.10 0.00 -1.16 0.00 0.00 60.37 59.39 1wb1 h HIS 103 Cb 0.00 0.39 -0.12 0.00 1.06 0.00 0.00 27.41 28.75 1wb1 h HIS 103 CO -0.08 -0.36 -0.39 1.98 0.86 0.00 0.00 177.93 179.95 1wb1 h MET 104 N -0.04 -0.15 0.04 2.45 1.85 0.52 -1.22 114.93 118.38 1wb1 h MET 104 Ca 0.34 0.01 0.01 0.00 -0.61 0.00 0.00 59.70 59.44 1wb1 h MET 104 Cb 0.57 0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.61 1wb1 h MET 104 CO -0.80 -0.10 -0.25 -0.07 -0.40 0.00 0.00 176.91 175.28 1wb1 h LEU 105 N -0.16 -0.77 0.00 3.39 3.38 0.25 -2.71 115.31 118.69 1wb1 h LEU 105 Ca 0.23 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1wb1 h LEU 105 Cb 0.56 0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1wb1 h LEU 105 CO -0.74 -0.26 0.00 -0.38 0.09 0.00 0.00 178.44 177.15 1wb1 n ILE 106 N -3.90 0.00 -0.49 1.22 5.41 -0.68 0.18 119.36 121.11 1wb1 n ILE 106 Ca -0.04 0.90 0.37 0.00 1.00 0.00 0.00 62.75 64.99 1wb1 n ILE 106 Cb 0.20 -1.31 0.58 0.00 -0.71 0.00 0.00 39.64 38.40 1wb1 n ILE 106 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1wb1 n LEU 107 N -1.38 0.04 0.10 1.39 4.77 -0.55 0.14 117.00 121.50 1wb1 n LEU 107 Ca 0.00 0.80 -0.08 0.00 -0.03 0.00 0.00 56.01 56.70 1wb1 n LEU 107 Cb 0.00 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 40.64 1wb1 n LEU 107 CO 0.00 -0.82 0.26 -0.78 -1.33 0.00 0.00 177.39 174.72 1wb1 h ASP 108 N 0.00 -0.29 -0.00 -1.43 3.58 0.23 0.33 116.42 118.84 1wb1 h ASP 108 Ca 0.69 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.99 1wb1 h ASP 108 Cb 2.64 0.07 -0.00 0.00 1.72 0.00 0.00 39.33 43.76 1wb1 h ASP 108 CO -0.08 0.21 0.06 0.45 -2.88 0.00 0.00 179.24 177.00 1wb1 h HIS 109 N -1.02 0.00 -0.03 0.28 -0.00 0.56 0.49 115.15 115.44 1wb1 h HIS 109 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 1wb1 h HIS 109 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.83 1wb1 h HIS 109 CO 0.04 0.00 -0.14 1.19 -0.00 0.00 0.00 177.93 179.02 1wb1 n PHE 110 N -3.08 0.00 -3.94 2.45 0.99 0.15 -4.98 117.46 109.05 1wb1 n PHE 110 Ca -0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.16 1wb1 n PHE 110 Cb 0.13 -0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 38.60 1wb1 n PHE 110 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 1wb1 n ASN 111 N 0.90 -1.16 -4.33 4.37 2.85 0.17 -4.91 115.26 113.14 1wb1 n ASN 111 Ca 0.13 -0.96 -0.46 0.00 -0.11 0.00 0.00 54.58 53.18 1wb1 n ASN 111 Cb 0.55 -3.25 -0.05 0.00 1.24 0.00 0.00 39.78 38.27 1wb1 n ASN 111 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1wb1 s ILE 112 N -3.78 5.13 0.40 -1.44 -1.09 0.84 -5.03 121.20 116.24 1wb1 s ILE 112 Ca 0.14 -1.42 -0.22 0.00 -2.23 0.00 0.00 60.65 56.92 1wb1 s ILE 112 Cb -0.08 -4.39 -0.14 0.00 -1.58 0.00 0.00 42.46 36.27 1wb1 s ILE 112 CO 0.88 -0.95 0.31 -0.81 -1.23 0.00 0.00 174.94 173.14 1wb1 n PRO 113 N 5.47 0.25 -4.35 2.79 -0.04 -1.26 -4.69 135.00 133.17 1wb1 n PRO 113 Ca -0.11 0.09 -0.18 0.00 -0.04 0.00 0.00 63.50 63.26 1wb1 n PRO 113 Cb 0.41 -1.23 -0.10 0.00 -0.04 0.00 0.00 33.50 32.54 1wb1 n PRO 113 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1wb1 s ILE 114 N -1.55 0.99 -0.43 0.52 -5.25 -1.26 -2.42 121.20 111.80 1wb1 s ILE 114 Ca 0.61 -2.02 0.03 0.00 -0.99 0.00 0.00 60.65 58.28 1wb1 s ILE 114 Cb -0.63 -2.48 0.16 0.00 2.95 0.00 0.00 42.46 42.45 1wb1 s ILE 114 CO 0.60 -0.21 0.32 -0.63 -1.79 0.00 0.00 174.94 173.23 1wb1 s ILE 115 N -3.45 0.60 -0.15 8.37 1.01 -1.10 -4.38 121.20 122.10 1wb1 s ILE 115 Ca 0.32 -2.57 -0.39 0.00 0.00 0.00 0.00 60.65 58.00 1wb1 s ILE 115 Cb 0.07 -1.42 -0.19 0.00 0.01 0.00 0.00 42.46 40.92 1wb1 s ILE 115 CO 0.11 -1.13 1.16 0.52 0.00 0.00 0.00 174.94 175.59 1wb1 n VAL 116 N 3.10 0.00 -5.11 2.92 0.31 -0.83 -3.72 118.33 115.01 1wb1 n VAL 116 Ca 0.23 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.26 1wb1 n VAL 116 Cb 0.43 -0.15 -0.17 0.00 -0.91 0.00 0.00 33.84 33.05 1wb1 n VAL 116 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1wb1 s VAL 117 N 0.88 1.87 -0.46 2.52 1.01 -0.50 -2.80 120.40 122.91 1wb1 s VAL 117 Ca 0.89 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.77 1wb1 s VAL 117 Cb -1.26 -1.61 0.05 0.00 0.00 0.00 0.00 36.38 33.56 1wb1 s VAL 117 CO 0.61 0.52 0.48 -0.63 0.00 0.00 0.00 175.10 176.08 1wb1 s ILE 118 N 0.23 5.07 0.73 2.22 -1.09 -1.17 -1.11 121.20 126.08 1wb1 s ILE 118 Ca -0.13 -0.59 -0.05 0.00 -2.23 0.00 0.00 60.65 57.65 1wb1 s ILE 118 Cb -0.16 -4.14 0.11 0.00 -1.58 0.00 0.00 42.46 36.69 1wb1 s ILE 118 CO 0.06 -0.58 1.03 0.42 -1.23 0.00 0.00 174.94 174.64 1wb1 s THR 119 N 2.14 2.23 -1.62 2.92 -4.23 -0.50 -1.39 115.64 115.20 1wb1 s THR 119 Ca 0.11 -0.40 -0.09 0.00 -1.18 0.00 0.00 61.69 60.12 1wb1 s THR 119 Cb -0.20 -2.83 0.09 0.00 1.34 0.00 0.00 72.50 70.90 1wb1 s THR 119 CO 0.11 0.00 0.40 0.29 -0.54 0.00 0.00 174.62 174.89 1wb1 n LYS 120 N -2.95 -1.98 0.00 3.99 5.02 -1.26 -2.52 118.16 118.46 1wb1 n LYS 120 Ca 0.12 0.24 0.08 0.00 -2.02 0.00 0.00 58.31 56.73 1wb1 n LYS 120 Cb 0.60 -4.39 0.50 0.00 -0.02 0.00 0.00 35.03 31.71 1wb1 n LYS 120 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1wb1 n SER 121 N -2.77 0.00 -0.06 4.39 7.64 -1.23 -2.14 113.62 119.44 1wb1 n SER 121 Ca -0.14 -0.75 0.10 0.00 1.01 0.00 0.00 58.87 59.09 1wb1 n SER 121 Cb 0.60 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.70 1wb1 n SER 121 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1wb1 n ASP 122 N -0.91 1.12 -1.20 6.43 5.75 -1.26 -4.12 116.55 122.36 1wb1 n ASP 122 Ca 0.13 -1.06 0.08 0.00 -0.01 0.00 0.00 54.79 53.93 1wb1 n ASP 122 Cb 0.06 0.92 0.29 0.00 -1.03 0.00 0.00 41.12 41.37 1wb1 n ASP 122 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1wb1 n ASN 123 N -1.31 4.28 -4.20 -1.12 5.03 -0.91 -4.96 115.26 112.06 1wb1 n ASN 123 Ca 0.05 -2.68 -0.15 0.00 0.87 0.00 0.00 54.58 52.66 1wb1 n ASN 123 Cb 0.35 -0.52 -0.11 0.00 -1.02 0.00 0.00 39.78 38.48 1wb1 n ASN 123 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1wb1 s ALA 124 N -2.25 1.25 0.17 5.41 0.00 -1.26 -4.88 121.76 120.19 1wb1 s ALA 124 Ca 0.43 -1.27 0.04 0.00 0.00 0.00 0.00 51.96 51.16 1wb1 s ALA 124 Cb 0.31 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 1wb1 s ALA 124 CO 0.15 -0.03 0.20 0.20 0.00 0.00 0.00 175.76 176.29 1wb1 s GLY 125 N -2.61 1.67 0.00 0.00 0.00 -1.26 -4.89 107.32 100.23 1wb1 s GLY 125 Ca 0.09 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.64 1wb1 s GLY 125 CO 0.01 -1.17 0.57 2.41 0.00 0.00 0.00 173.10 174.91 1wb1 n THR 126 N -0.52 0.00 -0.10 0.90 -1.04 -1.26 -0.43 114.28 111.83 1wb1 n THR 126 Ca -0.08 0.86 -0.02 0.00 -2.04 0.00 0.00 64.05 62.76 1wb1 n THR 126 Cb 0.55 -1.14 -0.02 0.00 -1.82 0.00 0.00 70.33 67.89 1wb1 n THR 126 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1wb1 n GLU 127 N -2.51 -0.10 0.17 -2.82 -0.58 -1.26 0.62 120.64 114.15 1wb1 n GLU 127 Ca 0.00 0.39 -0.07 0.00 -0.42 0.00 0.00 57.16 57.07 1wb1 n GLU 127 Cb 0.00 -0.58 -0.03 0.00 -0.57 0.00 0.00 31.44 30.26 1wb1 n GLU 127 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1wb1 h GLU 128 N 0.00 -0.41 -0.29 3.49 5.08 -1.14 0.57 114.58 121.88 1wb1 h GLU 128 Ca 0.04 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1wb1 h GLU 128 Cb 0.09 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1wb1 h GLU 128 CO -0.21 -0.27 -0.23 0.82 -1.00 0.00 0.00 179.01 178.11 1wb1 h ILE 129 N -0.43 0.00 -0.90 3.13 2.04 0.04 0.79 117.51 122.19 1wb1 h ILE 129 Ca -0.04 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.01 1wb1 h ILE 129 Cb 0.33 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.24 1wb1 h ILE 129 CO 0.07 0.00 -0.18 0.50 0.00 0.00 0.00 178.15 178.54 1wb1 h LYS 130 N -0.07 0.01 0.66 2.37 3.64 0.13 0.76 116.57 124.07 1wb1 h LYS 130 Ca 0.05 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1wb1 h LYS 130 Cb 0.20 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1wb1 h LYS 130 CO -0.32 0.01 -0.32 -0.09 -2.27 0.00 0.00 179.45 176.46 1wb1 h ARG 131 N 0.01 -0.86 0.00 1.90 1.12 0.20 0.15 114.38 116.90 1wb1 h ARG 131 Ca 0.45 0.06 0.00 0.00 -1.11 0.00 0.00 59.98 59.38 1wb1 h ARG 131 Cb 0.73 0.19 0.00 0.00 -0.01 0.00 0.00 29.97 30.88 1wb1 h ARG 131 CO -0.91 -0.57 0.24 1.15 -3.11 0.00 0.00 179.97 176.77 1wb1 h THR 132 N -1.16 0.00 0.23 0.20 2.02 0.98 0.53 112.91 115.71 1wb1 h THR 132 Ca -0.09 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1wb1 h THR 132 Cb 0.68 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1wb1 h THR 132 CO 0.15 0.00 -0.11 -0.08 0.37 0.00 0.00 175.52 175.85 1wb1 h GLU 133 N 0.00 -0.29 -1.04 6.66 4.81 0.11 -2.94 114.58 121.89 1wb1 h GLU 133 Ca 0.00 0.02 0.27 0.00 -0.13 0.00 0.00 59.36 59.52 1wb1 h GLU 133 Cb 0.47 0.07 -0.11 0.00 0.63 0.00 0.00 28.75 29.81 1wb1 h GLU 133 CO 0.00 0.03 0.65 0.52 -0.73 0.00 0.00 179.01 179.47 1wb1 h MET 134 N -0.97 0.44 0.79 1.92 2.86 0.28 -1.38 114.93 118.87 1wb1 h MET 134 Ca -0.03 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1wb1 h MET 134 Cb 0.46 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 32.03 1wb1 h MET 134 CO 0.05 0.29 -0.38 0.82 1.06 0.00 0.00 176.91 178.75 1wb1 h ILE 135 N 0.45 0.00 -0.40 -1.22 2.04 -0.93 -1.70 117.51 115.76 1wb1 h ILE 135 Ca 0.62 -0.09 0.12 0.00 1.00 0.00 0.00 64.86 66.51 1wb1 h ILE 135 Cb 1.45 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1wb1 h ILE 135 CO -0.37 0.00 0.56 0.24 0.00 0.00 0.00 178.15 178.58 1wb1 h MET 136 N -1.15 0.00 0.10 2.37 2.86 -1.17 1.50 114.93 119.43 1wb1 h MET 136 Ca -0.11 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1wb1 h MET 136 Cb 0.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.47 1wb1 h MET 136 CO 0.18 0.00 -0.05 -0.22 1.06 0.00 0.00 176.91 177.88 1wb1 h LYS 137 N 0.00 -0.12 0.51 1.72 1.63 -0.40 -2.39 116.57 117.52 1wb1 h LYS 137 Ca 0.19 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.98 1wb1 h LYS 137 Cb 1.31 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.95 1wb1 h LYS 137 CO -0.00 0.07 -0.49 1.03 -3.45 0.00 0.00 179.45 176.60 1wb1 h SER 138 N -0.30 -1.33 0.00 4.20 0.87 0.27 -2.70 113.55 114.57 1wb1 h SER 138 Ca -0.01 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1wb1 h SER 138 Cb 0.25 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1wb1 h SER 138 CO 0.02 -0.66 0.00 -0.38 -0.53 0.00 0.00 176.83 175.28 1wb1 n ILE 139 N -5.56 0.00 -0.53 2.23 2.08 -0.87 -0.17 119.36 116.53 1wb1 n ILE 139 Ca -0.12 1.35 0.41 0.00 0.56 0.00 0.00 62.75 64.95 1wb1 n ILE 139 Cb 0.46 -1.95 0.65 0.00 -0.75 0.00 0.00 39.64 38.04 1wb1 n ILE 139 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1wb1 n LEU 140 N -2.21 0.06 0.25 1.39 4.77 -0.90 0.37 117.00 120.73 1wb1 n LEU 140 Ca 0.00 0.93 0.13 0.00 -0.03 0.00 0.00 56.01 57.04 1wb1 n LEU 140 Cb 0.00 -0.46 0.65 0.00 -2.33 0.00 0.00 43.42 41.28 1wb1 n LEU 140 CO 0.00 -0.96 0.93 1.56 -1.33 0.00 0.00 177.39 177.58 1wb1 h GLN 141 N 0.00 0.00 0.07 3.23 1.08 -0.21 -2.24 115.11 117.04 1wb1 h GLN 141 Ca 0.77 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.96 1wb1 h GLN 141 Cb 2.90 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 30.33 1wb1 h GLN 141 CO -0.13 0.14 -0.03 0.77 -0.95 0.00 0.00 178.83 178.62 1wb1 h SER 142 N 0.00 -0.08 -1.29 1.46 0.02 0.69 -3.46 113.55 110.89 1wb1 h SER 142 Ca -0.00 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.58 1wb1 h SER 142 Cb 0.49 0.02 0.13 0.00 0.14 0.00 0.00 62.40 63.18 1wb1 h SER 142 CO 0.02 0.23 -0.95 0.35 -1.14 0.00 0.00 176.83 175.34 1wb1 n THR 143 N -3.81 0.00 1.59 -2.27 -2.24 -1.22 -4.81 114.28 101.52 1wb1 n THR 143 Ca -0.01 -0.32 0.06 0.00 -2.27 0.00 0.00 64.05 61.51 1wb1 n THR 143 Cb 0.04 0.00 0.27 0.00 -2.10 0.00 0.00 70.33 68.54 1wb1 n THR 143 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1wb1 n HIS 144 N -1.25 0.15 0.17 4.78 -0.00 -1.26 -4.34 115.22 113.46 1wb1 n HIS 144 Ca 0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 57.72 57.67 1wb1 n HIS 144 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.32 1wb1 n HIS 144 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1wb1 n ASN 145 N -0.19 -1.21 0.00 0.41 3.02 -1.26 -4.91 115.26 111.13 1wb1 n ASN 145 Ca 0.10 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 55.25 1wb1 n ASN 145 Cb 0.15 1.30 0.00 0.00 -0.61 0.00 0.00 39.78 40.63 1wb1 n ASN 145 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1wb1 n LEU 146 N -3.46 0.00 -0.23 3.41 4.77 -1.26 -3.71 117.00 116.52 1wb1 n LEU 146 Ca 0.00 0.11 0.03 0.00 -0.03 0.00 0.00 56.01 56.12 1wb1 n LEU 146 Cb 0.00 -0.11 0.13 0.00 -2.33 0.00 0.00 43.42 41.11 1wb1 n LEU 146 CO 0.00 -0.11 0.84 0.11 -1.33 0.00 0.00 177.39 176.91 1wb1 h LYS 147 N 0.00 0.13 -2.00 3.23 1.57 -1.59 -1.39 116.57 116.51 1wb1 h LYS 147 Ca 0.00 -0.01 -0.55 0.00 -1.87 0.00 0.00 60.65 58.22 1wb1 h LYS 147 Cb 0.04 -0.03 -0.19 0.00 0.08 0.00 0.00 32.23 32.13 1wb1 h LYS 147 CO 0.00 0.09 0.53 -1.71 -0.57 0.00 0.00 179.45 177.78 1wb1 n ASN 148 N -5.28 6.67 0.00 0.86 5.15 -1.24 -4.60 115.26 116.82 1wb1 n ASN 148 Ca 0.11 -3.32 0.00 0.00 -0.60 0.00 0.00 54.58 50.77 1wb1 n ASN 148 Cb 0.41 -1.20 0.00 0.00 -0.53 0.00 0.00 39.78 38.45 1wb1 n ASN 148 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1wb1 n SER 149 N 0.63 0.00 -3.55 1.20 3.41 -0.53 -5.12 113.62 109.66 1wb1 n SER 149 Ca 0.50 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.95 1wb1 n SER 149 Cb 0.49 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 1wb1 n SER 149 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1wb1 s SER 150 N -1.00 -0.62 -0.03 4.04 0.01 -1.26 -5.07 113.70 109.77 1wb1 s SER 150 Ca 0.00 0.78 0.01 0.00 1.31 0.00 0.00 55.95 58.05 1wb1 s SER 150 Cb 0.00 0.65 0.02 0.00 0.21 0.00 0.00 66.02 66.90 1wb1 s SER 150 CO 0.00 -0.50 -0.03 -0.63 0.41 0.00 0.00 173.24 172.49 1wb1 s ILE 151 N -0.91 0.36 -0.23 1.44 1.01 -1.26 -1.97 121.20 119.64 1wb1 s ILE 151 Ca -0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.47 1wb1 s ILE 151 Cb -0.01 -0.39 0.12 0.00 0.01 0.00 0.00 42.46 42.19 1wb1 s ILE 151 CO 0.07 0.17 0.43 0.27 0.00 0.00 0.00 174.94 175.87 1wb1 s ILE 152 N 0.72 -0.68 0.38 2.92 -4.36 -1.12 -5.03 121.20 114.02 1wb1 s ILE 152 Ca -0.08 0.03 -0.25 0.00 -0.26 0.00 0.00 60.65 60.09 1wb1 s ILE 152 Cb -0.11 -0.78 -0.09 0.00 1.25 0.00 0.00 42.46 42.72 1wb1 s ILE 152 CO -0.01 -0.03 1.02 -2.16 0.24 0.00 0.00 174.94 174.01 1wb1 s PRO 153 N 2.62 4.30 -0.08 0.37 0.04 -1.26 -3.01 135.00 137.97 1wb1 s PRO 153 Ca 0.07 1.47 -0.31 0.00 0.04 0.00 0.00 61.00 62.27 1wb1 s PRO 153 Cb -0.14 -2.62 0.09 0.00 0.04 0.00 0.00 34.50 31.86 1wb1 s PRO 153 CO -0.15 -0.01 0.76 0.96 0.04 0.00 0.00 177.00 178.60 1wb1 s ILE 154 N -1.65 0.00 -0.46 0.56 -0.00 -0.48 -4.38 121.20 114.80 1wb1 s ILE 154 Ca 0.55 0.00 -0.10 0.00 -0.00 0.00 0.00 60.65 61.10 1wb1 s ILE 154 Cb -0.21 -1.00 0.10 0.00 -0.00 0.00 0.00 42.46 41.35 1wb1 s ILE 154 CO 0.27 0.00 0.33 -0.55 -0.00 0.00 0.00 174.94 174.99 1wb1 s SER 155 N -1.19 5.75 0.59 4.36 0.15 -0.80 -3.56 113.70 119.01 1wb1 s SER 155 Ca -0.08 -1.71 0.29 0.00 0.70 0.00 0.00 55.95 55.15 1wb1 s SER 155 Cb -0.00 -2.03 1.56 0.00 -1.71 0.00 0.00 66.02 63.83 1wb1 s SER 155 CO 0.08 -0.65 1.98 0.00 1.20 0.00 0.00 173.24 175.85 1wb1 h ALA 156 N 8.49 2.00 -0.29 5.45 0.00 -1.88 3.36 119.26 136.39 1wb1 h ALA 156 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1wb1 h ALA 156 Cb 1.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1wb1 h ALA 156 CO 0.84 -0.52 0.00 1.17 0.00 0.00 0.00 179.25 180.73 1wb1 n LYS 157 N -3.73 0.00 -0.01 0.00 4.81 -1.26 -4.05 118.16 113.91 1wb1 n LYS 157 Ca 0.05 0.45 -0.04 0.00 -0.87 0.00 0.00 58.31 57.90 1wb1 n LYS 157 Cb 0.51 -1.23 0.17 0.00 0.02 0.00 0.00 35.03 34.51 1wb1 n LYS 157 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1wb1 h THR 158 N 0.00 1.27 0.00 3.15 1.35 -1.86 -3.47 112.91 113.35 1wb1 h THR 158 Ca 0.00 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 1wb1 h THR 158 Cb 0.00 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1wb1 h THR 158 CO 0.00 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 1wb1 n GLY 159 N -0.34 2.15 1.71 5.82 0.00 1.11 -5.01 105.19 110.64 1wb1 n GLY 159 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1wb1 n GLY 159 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wb1 n PHE 160 N -0.77 -0.38 0.00 1.61 7.35 -1.19 -1.44 117.46 122.64 1wb1 n PHE 160 Ca 0.00 0.46 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 1wb1 n PHE 160 Cb 0.00 -0.98 0.00 0.00 0.35 0.00 0.00 39.48 38.85 1wb1 n PHE 160 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1wb1 n GLY 161 N 1.04 0.16 0.00 7.13 0.00 -1.26 -1.90 105.19 110.36 1wb1 n GLY 161 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1wb1 n GLY 161 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wb1 n VAL 162 N 0.00 0.00 -0.12 1.61 0.31 -0.52 0.17 118.33 119.78 1wb1 n VAL 162 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 1wb1 n VAL 162 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1wb1 n VAL 162 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1wb1 n ASP 163 N -1.82 -0.31 -0.28 4.52 8.00 -1.26 0.32 116.55 125.72 1wb1 n ASP 163 Ca 0.00 1.03 0.09 0.00 0.71 0.00 0.00 54.79 56.62 1wb1 n ASP 163 Cb 0.00 -0.32 0.23 0.00 -0.02 0.00 0.00 41.12 41.01 1wb1 n ASP 163 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1wb1 h GLU 164 N 0.00 0.17 0.00 -1.24 4.57 0.14 -0.84 114.58 117.38 1wb1 h GLU 164 Ca 0.05 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1wb1 h GLU 164 Cb 0.12 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1wb1 h GLU 164 CO -0.28 0.11 0.00 -0.11 -1.18 0.00 0.00 179.01 177.55 1wb1 n LEU 165 N -5.27 0.00 -0.21 1.64 7.94 0.95 0.34 117.00 122.39 1wb1 n LEU 165 Ca 0.18 0.37 0.05 0.00 -1.11 0.00 0.00 56.01 55.51 1wb1 n LEU 165 Cb 0.58 0.00 0.12 0.00 0.53 0.00 0.00 43.42 44.65 1wb1 n LEU 165 CO 0.06 0.00 0.42 2.29 -1.11 0.00 0.00 177.39 179.05 1wb1 n LYS 166 N -0.43 -0.05 0.20 1.96 2.85 0.52 0.51 118.16 123.71 1wb1 n LYS 166 Ca 0.00 0.91 0.05 0.00 -1.05 0.00 0.00 58.31 58.21 1wb1 n LYS 166 Cb 0.00 -1.38 0.49 0.00 -0.65 0.00 0.00 35.03 33.48 1wb1 n LYS 166 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 177.40 176.38 1wb1 h ASN 167 N 0.00 0.06 -0.68 -5.58 -0.73 -0.98 -1.21 115.58 106.45 1wb1 h ASN 167 Ca 0.31 -0.01 -0.05 0.00 1.87 0.00 0.00 56.30 58.42 1wb1 h ASN 167 Cb 0.54 -0.02 -0.03 0.00 0.27 0.00 0.00 38.32 39.09 1wb1 h ASN 167 CO -0.59 0.21 0.23 0.25 -0.37 0.00 0.00 177.43 177.17 1wb1 h LEU 168 N 0.07 0.98 -0.45 0.34 5.85 1.68 -2.73 115.31 121.05 1wb1 h LEU 168 Ca 0.01 -0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.63 1wb1 h LEU 168 Cb 0.29 -0.26 -0.10 0.00 0.37 0.00 0.00 40.66 40.97 1wb1 h LEU 168 CO 0.02 0.92 -0.25 0.40 -0.34 0.00 0.00 178.44 179.19 1wb1 h ILE 169 N 0.99 0.32 -0.44 4.05 2.04 -0.38 -2.26 117.51 121.84 1wb1 h ILE 169 Ca 0.22 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.12 1wb1 h ILE 169 Cb 0.27 0.32 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 1wb1 h ILE 169 CO -0.01 0.00 -0.26 -0.38 0.00 0.00 0.00 178.15 177.50 1wb1 n ILE 170 N -5.41 -0.30 -0.03 -0.67 2.08 -1.03 -1.46 119.36 112.55 1wb1 n ILE 170 Ca 0.03 1.81 -0.13 0.00 0.56 0.00 0.00 62.75 65.02 1wb1 n ILE 170 Cb 0.32 -2.30 -0.07 0.00 -0.75 0.00 0.00 39.64 36.83 1wb1 n ILE 170 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 1wb1 h THR 171 N 0.00 0.09 -0.98 1.39 1.35 -1.45 0.18 112.91 113.48 1wb1 h THR 171 Ca 0.07 0.00 0.17 0.00 -0.55 0.00 0.00 66.41 66.10 1wb1 h THR 171 Cb 0.18 0.09 -0.09 0.00 -1.73 0.00 0.00 68.15 66.60 1wb1 h THR 171 CO -0.41 0.00 0.61 0.71 -0.25 0.00 0.00 175.52 176.18 1wb1 h THR 172 N -0.49 0.76 0.12 6.82 1.35 -1.21 0.45 112.91 120.71 1wb1 h THR 172 Ca 0.07 -0.26 -0.01 0.00 -0.55 0.00 0.00 66.41 65.67 1wb1 h THR 172 Cb 0.64 -0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.01 1wb1 h THR 172 CO -0.44 0.14 -0.06 -0.07 -0.25 0.00 0.00 175.52 174.83 1wb1 h LEU 173 N 0.75 -0.13 -1.92 3.87 -0.00 -0.36 0.35 115.31 117.86 1wb1 h LEU 173 Ca 0.53 -0.29 0.17 0.00 -0.00 0.00 0.00 57.88 58.30 1wb1 h LEU 173 Cb 0.85 0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.52 1wb1 h LEU 173 CO -0.31 0.23 0.55 0.78 -0.00 0.00 0.00 178.44 179.68 1wb1 h ASN 174 N -0.51 0.00 0.00 -0.43 2.35 0.19 -3.29 115.58 113.89 1wb1 h ASN 174 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1wb1 h ASN 174 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1wb1 h ASN 174 CO 0.03 0.00 0.00 -3.20 -1.65 0.00 0.00 177.43 172.61 1wb1 n ASN 175 N -3.84 0.00 -4.44 5.81 2.85 0.13 -4.91 115.26 110.86 1wb1 n ASN 175 Ca 0.11 0.00 -0.49 0.00 -0.11 0.00 0.00 54.58 54.09 1wb1 n ASN 175 Cb 0.77 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.75 1wb1 n ASN 175 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wb1 n ALA 176 N -2.31 -2.57 -2.88 5.20 0.00 0.11 -4.92 120.51 113.14 1wb1 n ALA 176 Ca 0.00 0.46 -0.35 0.00 0.00 0.00 0.00 53.44 53.55 1wb1 n ALA 176 Cb 0.00 -1.70 -0.11 0.00 0.00 0.00 0.00 19.45 17.64 1wb1 n ALA 176 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1wb1 s GLU 177 N -0.90 3.85 -0.02 0.00 -1.05 -1.26 -4.76 118.70 114.56 1wb1 s GLU 177 Ca 0.67 -0.40 0.01 0.00 -0.15 0.00 0.00 54.97 55.10 1wb1 s GLU 177 Cb -0.94 -3.20 -0.03 0.00 -0.44 0.00 0.00 34.13 29.51 1wb1 s GLU 177 CO 0.56 0.15 -0.01 0.96 0.95 0.00 0.00 175.26 177.88 1wb1 s ILE 178 N 0.68 4.10 -0.42 1.83 -4.36 -1.26 -5.08 121.20 116.69 1wb1 s ILE 178 Ca 0.03 -0.53 0.02 0.00 -0.26 0.00 0.00 60.65 59.90 1wb1 s ILE 178 Cb -0.13 -2.79 0.14 0.00 1.25 0.00 0.00 42.46 40.93 1wb1 s ILE 178 CO 0.02 0.45 0.24 -0.63 0.24 0.00 0.00 174.94 175.25 1wb1 s ILE 179 N -1.01 1.02 0.09 8.37 1.01 -1.26 -5.10 121.20 124.32 1wb1 s ILE 179 Ca 0.17 -2.34 -0.30 0.00 0.00 0.00 0.00 60.65 58.18 1wb1 s ILE 179 Cb -0.11 -1.72 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 1wb1 s ILE 179 CO 0.07 -0.94 0.94 0.00 0.00 0.00 0.00 174.94 175.02 1wb1 s ARG 180 N 0.52 4.67 0.02 2.79 3.03 -1.26 -5.00 118.95 123.71 1wb1 s ARG 180 Ca 0.19 1.41 -0.27 0.00 2.03 0.00 0.00 55.73 59.09 1wb1 s ARG 180 Cb -0.22 -3.38 -0.04 0.00 -1.03 0.00 0.00 34.95 30.27 1wb1 s ARG 180 CO -0.01 0.19 0.86 0.54 -1.13 0.00 0.00 175.30 175.76 1wb1 s ASN 181 N 0.09 7.27 -0.04 -2.89 2.20 -1.26 -4.92 114.94 115.39 1wb1 s ASN 181 Ca 0.47 1.53 -0.08 0.00 -0.94 0.00 0.00 52.86 53.84 1wb1 s ASN 181 Cb -0.23 -2.51 -0.04 0.00 -2.00 0.00 0.00 41.25 36.47 1wb1 s ASN 181 CO 0.29 -0.12 0.41 0.74 -2.94 0.00 0.00 177.10 175.48 1wb1 h THR 182 N 4.48 0.00 -0.04 0.54 2.02 -1.95 -2.99 112.91 114.97 1wb1 h THR 182 Ca -0.42 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.28 1wb1 h THR 182 Cb 1.21 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1wb1 h THR 182 CO 0.73 0.00 -0.05 -0.33 0.37 0.00 0.00 175.52 176.25 1wb1 h GLU 183 N -0.76 -0.03 -4.23 6.66 5.08 -1.94 -3.21 114.58 116.15 1wb1 h GLU 183 Ca -0.03 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.97 1wb1 h GLU 183 Cb 0.21 0.01 0.18 0.00 0.50 0.00 0.00 28.75 29.65 1wb1 h GLU 183 CO 0.05 -0.02 -1.70 0.43 -1.00 0.00 0.00 179.01 176.77 1wb1 n SER 184 N -2.97 -2.95 -4.67 1.42 7.64 -1.26 -4.69 113.62 106.14 1wb1 n SER 184 Ca -0.00 0.05 -0.42 0.00 1.01 0.00 0.00 58.87 59.50 1wb1 n SER 184 Cb 0.03 -0.42 -0.03 0.00 -1.01 0.00 0.00 64.21 62.78 1wb1 n SER 184 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1wb1 s TYR 185 N -1.41 2.37 -0.48 1.43 -0.85 -1.26 -3.71 117.35 113.43 1wb1 s TYR 185 Ca 0.26 0.48 -0.33 0.00 -0.52 0.00 0.00 57.07 56.96 1wb1 s TYR 185 Cb -0.00 -3.80 -0.13 0.00 0.38 0.00 0.00 41.96 38.41 1wb1 s TYR 185 CO 0.51 -3.19 2.31 0.34 -1.52 0.00 0.00 175.55 174.00 1wb1 n PHE 186 N 6.46 1.38 -4.08 -3.49 7.35 -1.24 -4.38 117.46 119.46 1wb1 n PHE 186 Ca 0.16 0.29 -0.33 0.00 -0.76 0.00 0.00 57.45 56.81 1wb1 n PHE 186 Cb 0.43 -2.51 -0.15 0.00 0.35 0.00 0.00 39.48 37.59 1wb1 n PHE 186 CO 0.00 0.00 0.00 -1.59 -0.76 0.00 0.00 176.76 174.41 1wb1 s LYS 187 N 7.02 2.70 -0.30 -4.13 -2.85 0.97 -1.91 119.74 121.24 1wb1 s LYS 187 Ca 1.12 -1.03 -0.03 0.00 -1.00 0.00 0.00 55.97 55.03 1wb1 s LYS 187 Cb -0.83 -2.73 0.10 0.00 -2.06 0.00 0.00 37.83 32.31 1wb1 s LYS 187 CO 0.46 -0.36 0.13 1.41 0.10 0.00 0.00 175.35 177.09 1wb1 s MET 188 N 1.22 0.30 1.21 1.78 1.75 -1.26 -1.88 119.30 122.42 1wb1 s MET 188 Ca -0.01 -0.67 -0.14 0.00 -1.25 0.00 0.00 55.69 53.62 1wb1 s MET 188 Cb -0.16 -1.29 0.29 0.00 2.84 0.00 0.00 34.83 36.50 1wb1 s MET 188 CO -0.09 -1.03 0.88 -0.35 -0.65 0.00 0.00 175.02 173.78 1wb1 n PRO 189 N 5.10 -2.65 -5.15 4.11 -0.04 -1.26 -3.13 135.00 131.98 1wb1 n PRO 189 Ca -0.04 -0.75 -0.30 0.00 -0.04 0.00 0.00 63.50 62.37 1wb1 n PRO 189 Cb 0.42 -2.09 -0.16 0.00 -0.04 0.00 0.00 33.50 31.63 1wb1 n PRO 189 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1wb1 s LEU 190 N -6.62 2.03 -0.08 1.53 1.43 -1.26 -4.19 118.68 111.51 1wb1 s LEU 190 Ca 0.67 -0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 53.26 1wb1 s LEU 190 Cb -0.24 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 1wb1 s LEU 190 CO 0.66 0.23 -0.11 -0.90 0.23 0.00 0.00 176.35 176.46 1wb1 n ASP 191 N 2.89 1.00 -4.17 2.29 5.68 -1.26 -4.40 116.55 118.58 1wb1 n ASP 191 Ca -0.17 0.41 -0.27 0.00 -0.50 0.00 0.00 54.79 54.26 1wb1 n ASP 191 Cb 0.52 -0.69 -0.16 0.00 -1.14 0.00 0.00 41.12 39.65 1wb1 n ASP 191 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1wb1 s HIS 192 N -1.74 1.88 -0.45 2.11 3.76 -1.26 -4.77 115.29 114.81 1wb1 s HIS 192 Ca -0.09 -0.54 0.04 0.00 -0.15 0.00 0.00 55.06 54.32 1wb1 s HIS 192 Cb 0.01 -1.26 0.17 0.00 1.11 0.00 0.00 32.58 32.62 1wb1 s HIS 192 CO 0.14 -0.17 0.37 0.00 -0.85 0.00 0.00 174.74 174.22 1wb1 n ALA 193 N 3.08 2.93 -2.26 -1.40 0.00 -1.09 -2.41 120.51 119.36 1wb1 n ALA 193 Ca -0.18 -3.31 -0.21 0.00 0.00 0.00 0.00 53.44 49.75 1wb1 n ALA 193 Cb 0.53 -0.79 0.01 0.00 0.00 0.00 0.00 19.45 19.20 1wb1 n ALA 193 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1wb1 s PHE 194 N -0.19 3.07 0.02 0.00 0.40 -1.01 -4.47 117.98 115.80 1wb1 s PHE 194 Ca 0.32 -0.03 0.06 0.00 -0.60 0.00 0.00 56.93 56.68 1wb1 s PHE 194 Cb 0.03 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.21 1wb1 s PHE 194 CO -0.19 -0.37 -0.16 -1.25 0.70 0.00 0.00 175.22 173.95 1wb1 s PRO 195 N -4.46 2.22 -0.46 0.24 0.04 -1.13 -0.79 135.00 130.66 1wb1 s PRO 195 Ca 0.50 -0.90 0.06 0.00 0.04 0.00 0.00 61.00 60.70 1wb1 s PRO 195 Cb -0.10 -2.27 0.31 0.00 0.04 0.00 0.00 34.50 32.48 1wb1 s PRO 195 CO 0.35 0.56 1.10 1.51 0.04 0.00 0.00 177.00 180.56 1wb1 n ILE 196 N 1.66 0.00 -3.01 0.56 3.06 -0.02 -4.90 119.36 116.71 1wb1 n ILE 196 Ca -0.16 -1.48 -0.01 0.00 -2.50 0.00 0.00 62.75 58.61 1wb1 n ILE 196 Cb 0.52 1.49 -0.00 0.00 0.54 0.00 0.00 39.64 42.19 1wb1 n ILE 196 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1wb1 n LYS 197 N 0.53 -1.57 -0.03 9.51 5.02 -1.26 -3.92 118.16 126.44 1wb1 n LYS 197 Ca 0.06 1.41 0.00 0.00 -2.02 0.00 0.00 58.31 57.76 1wb1 n LYS 197 Cb 0.69 -1.19 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 1wb1 n LYS 197 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wb1 n GLY 198 N 2.46 0.56 2.36 0.72 0.00 -1.26 -4.92 105.19 105.10 1wb1 n GLY 198 Ca -0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 1wb1 n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wb1 n ALA 199 N -1.60 1.24 0.04 4.61 0.00 -1.25 -5.01 120.51 118.54 1wb1 n ALA 199 Ca 0.00 -2.80 -0.20 0.00 0.00 0.00 0.00 53.44 50.44 1wb1 n ALA 199 Cb 0.00 -0.98 -0.11 0.00 0.00 0.00 0.00 19.45 18.36 1wb1 n ALA 199 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1wb1 h GLY 200 N 3.71 0.70 -7.48 0.00 0.00 -1.89 -0.02 103.07 98.09 1wb1 h GLY 200 Ca 0.01 -1.26 -0.80 0.00 0.00 0.00 0.00 47.33 45.29 1wb1 h GLY 200 CO 0.41 1.11 0.47 2.41 0.00 0.00 0.00 176.54 180.94 1wb1 n THR 201 N -3.94 4.59 -2.60 4.70 -1.04 -1.25 -2.82 114.28 111.92 1wb1 n THR 201 Ca -0.11 -5.43 -0.43 0.00 -2.04 0.00 0.00 64.05 56.03 1wb1 n THR 201 Cb 0.85 -2.53 0.00 0.00 -1.82 0.00 0.00 70.33 66.83 1wb1 n THR 201 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1wb1 n VAL 202 N 2.52 4.34 -3.01 12.58 0.31 0.03 -2.98 118.33 132.11 1wb1 n VAL 202 Ca 0.24 -4.58 -0.41 0.00 -0.01 0.00 0.00 64.34 59.58 1wb1 n VAL 202 Cb 0.38 -2.39 -0.06 0.00 -0.91 0.00 0.00 33.84 30.87 1wb1 n VAL 202 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1wb1 s VAL 203 N 0.72 4.86 0.00 2.52 1.01 0.28 -2.41 120.40 127.37 1wb1 s VAL 203 Ca 0.40 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.48 1wb1 s VAL 203 Cb 0.05 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1wb1 s VAL 203 CO 0.01 -0.18 0.00 0.35 0.00 0.00 0.00 175.10 175.28 1wb1 n THR 204 N 5.44 0.00 0.00 3.92 -2.24 -1.01 0.25 114.28 120.63 1wb1 n THR 204 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1wb1 n THR 204 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1wb1 n THR 204 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wb1 n GLY 205 N 5.00 -1.22 3.23 3.38 0.00 -1.26 -4.65 105.19 109.68 1wb1 n GLY 205 Ca 0.00 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 1wb1 n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wb1 s THR 206 N -1.03 1.89 -0.86 2.61 2.01 -1.26 -3.11 115.64 115.90 1wb1 s THR 206 Ca 0.00 -0.97 -0.23 0.00 0.31 0.00 0.00 61.69 60.79 1wb1 s THR 206 Cb 0.00 -1.60 -0.18 0.00 0.01 0.00 0.00 72.50 70.73 1wb1 s THR 206 CO 0.00 0.53 2.23 -0.38 -0.69 0.00 0.00 174.62 176.31 1wb1 n ILE 207 N 3.00 0.00 0.00 1.82 -0.00 -1.21 -4.42 119.36 118.54 1wb1 n ILE 207 Ca -0.18 -0.35 0.00 0.00 -0.00 0.00 0.00 62.75 62.22 1wb1 n ILE 207 Cb 0.52 -1.69 0.00 0.00 -0.00 0.00 0.00 39.64 38.47 1wb1 n ILE 207 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1wb1 n ASN 208 N 17.09 0.00 -4.36 4.38 4.13 -0.79 -0.47 115.26 135.24 1wb1 n ASN 208 Ca 0.45 0.17 -0.28 0.00 1.68 0.00 0.00 54.58 56.60 1wb1 n ASN 208 Cb 0.42 0.00 -0.13 0.00 -1.54 0.00 0.00 39.78 38.52 1wb1 n ASN 208 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1wb1 s LYS 209 N -0.34 1.39 0.00 3.52 1.02 -1.07 -4.27 119.74 119.99 1wb1 s LYS 209 Ca 0.00 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 54.71 1wb1 s LYS 209 Cb 0.00 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.50 1wb1 s LYS 209 CO 0.00 0.43 0.00 0.41 -0.92 0.00 0.00 175.35 175.27 1wb1 n GLY 210 N 1.04 -1.10 3.27 -3.33 0.00 -1.13 -0.02 105.19 103.93 1wb1 n GLY 210 Ca -0.18 -2.12 -0.18 0.00 0.00 0.00 0.00 46.02 43.54 1wb1 n GLY 210 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wb1 s ILE 211 N 0.00 0.02 0.09 -0.61 1.01 -1.21 -3.34 121.20 117.16 1wb1 s ILE 211 Ca 0.00 -2.00 -0.11 0.00 0.00 0.00 0.00 60.65 58.54 1wb1 s ILE 211 Cb 0.00 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.98 1wb1 s ILE 211 CO 0.00 0.00 0.26 0.54 0.00 0.00 0.00 174.94 175.74 1wb1 s VAL 212 N -3.58 0.12 0.12 2.92 0.11 -1.23 -4.27 120.40 114.58 1wb1 s VAL 212 Ca 0.40 -0.96 0.02 0.00 -2.93 0.00 0.00 61.98 58.51 1wb1 s VAL 212 Cb 0.03 -1.25 -0.01 0.00 -1.53 0.00 0.00 36.38 33.63 1wb1 s VAL 212 CO 0.24 -0.53 0.06 0.29 -3.33 0.00 0.00 175.10 171.83 1wb1 n LYS 213 N -0.05 0.56 -3.16 1.54 4.76 -1.26 -3.72 118.16 116.83 1wb1 n LYS 213 Ca -0.16 -1.05 -0.39 0.00 -2.87 0.00 0.00 58.31 53.84 1wb1 n LYS 213 Cb 0.62 0.68 -0.06 0.00 -1.84 0.00 0.00 35.03 34.44 1wb1 n LYS 213 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1wb1 s VAL 214 N -2.16 5.08 -1.63 -0.18 0.11 -1.26 -4.28 120.40 116.07 1wb1 s VAL 214 Ca 0.09 1.18 0.00 0.00 -2.93 0.00 0.00 61.98 60.32 1wb1 s VAL 214 Cb 0.00 -3.93 0.00 0.00 -1.53 0.00 0.00 36.38 30.92 1wb1 s VAL 214 CO 0.06 0.21 0.00 0.61 -3.33 0.00 0.00 175.10 172.65 1wb1 n GLY 215 N 3.46 1.45 3.75 6.54 0.00 0.21 -4.88 105.19 115.72 1wb1 n GLY 215 Ca -0.03 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 1wb1 n GLY 215 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wb1 s ASP 216 N -2.80 7.41 0.21 1.61 -0.00 -1.10 -4.40 116.67 117.60 1wb1 s ASP 216 Ca 0.00 1.67 -0.20 0.00 -0.00 0.00 0.00 52.55 54.02 1wb1 s ASP 216 Cb 0.00 -2.53 -0.08 0.00 -0.00 0.00 0.00 42.92 40.31 1wb1 s ASP 216 CO 0.00 0.06 0.72 -0.70 -0.00 0.00 0.00 175.17 175.26 1wb1 s GLU 217 N -0.49 4.27 -0.01 8.23 -6.30 -1.25 -2.78 118.70 120.37 1wb1 s GLU 217 Ca 0.41 0.89 -0.28 0.00 -2.50 0.00 0.00 54.97 53.48 1wb1 s GLU 217 Cb -0.23 -2.92 0.10 0.00 0.00 0.00 0.00 34.13 31.08 1wb1 s GLU 217 CO 0.27 0.41 0.85 -0.51 0.02 0.00 0.00 175.26 176.30 1wb1 s LEU 218 N -1.89 -0.42 1.12 2.70 2.01 0.27 -4.85 118.68 117.62 1wb1 s LEU 218 Ca 0.42 0.11 -0.17 0.00 0.01 0.00 0.00 54.13 54.50 1wb1 s LEU 218 Cb -0.17 2.12 0.16 0.00 0.01 0.00 0.00 46.19 48.31 1wb1 s LEU 218 CO 0.21 -0.63 0.22 0.29 1.01 0.00 0.00 176.35 177.45 1wb1 n LYS 219 N -0.04 -2.23 -2.85 1.70 5.02 -1.26 -1.81 118.16 116.69 1wb1 n LYS 219 Ca -0.11 -0.65 -0.11 0.00 -2.02 0.00 0.00 58.31 55.42 1wb1 n LYS 219 Cb 0.61 -1.65 0.06 0.00 -0.02 0.00 0.00 35.03 34.03 1wb1 n LYS 219 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1wb1 n VAL 220 N -4.59 -0.03 0.00 -0.18 0.31 -1.23 -4.46 118.33 108.15 1wb1 n VAL 220 Ca 0.04 -2.35 0.00 0.00 -0.01 0.00 0.00 64.34 62.02 1wb1 n VAL 220 Cb 0.52 1.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.45 1wb1 n VAL 220 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1wb1 n LEU 221 N 0.30 0.00 0.00 7.52 7.99 -1.06 -0.74 117.00 131.01 1wb1 n LEU 221 Ca 0.11 0.00 0.02 0.00 -0.01 0.00 0.00 56.01 56.13 1wb1 n LEU 221 Cb 0.70 0.00 0.12 0.00 -0.11 0.00 0.00 43.42 44.12 1wb1 n LEU 221 CO 0.08 0.00 0.50 -0.81 -1.51 0.00 0.00 177.39 175.65 1wb1 n PRO 222 N -2.35 0.06 0.00 3.23 -0.04 -1.26 -3.72 135.00 130.93 1wb1 n PRO 222 Ca 0.00 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1wb1 n PRO 222 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1wb1 n PRO 222 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wb1 n ILE 223 N -1.30 0.00 -1.79 0.52 5.41 0.08 -5.06 119.36 117.21 1wb1 n ILE 223 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1wb1 n ILE 223 Cb 0.04 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.86 1wb1 n ILE 223 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1wb1 n ASN 224 N -1.53 -1.33 -4.70 4.38 3.02 -0.72 -4.99 115.26 109.39 1wb1 n ASN 224 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 1wb1 n ASN 224 Cb 0.09 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 38.74 1wb1 n ASN 224 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1wb1 s MET 225 N -3.59 4.48 0.23 3.52 -1.94 -1.26 -4.72 119.30 116.01 1wb1 s MET 225 Ca 0.00 1.34 -0.30 0.00 -1.71 0.00 0.00 55.69 55.02 1wb1 s MET 225 Cb 0.00 -3.50 -0.09 0.00 2.01 0.00 0.00 34.83 33.26 1wb1 s MET 225 CO 0.00 -0.16 1.17 -1.54 -0.01 0.00 0.00 175.02 174.48 1wb1 s SER 226 N 1.03 7.13 -0.07 3.03 1.04 -1.26 -3.47 113.70 121.13 1wb1 s SER 226 Ca 0.48 2.28 -0.07 0.00 0.48 0.00 0.00 55.95 59.12 1wb1 s SER 226 Cb -0.19 -2.62 0.02 0.00 0.10 0.00 0.00 66.02 63.33 1wb1 s SER 226 CO 0.22 -0.30 0.20 0.42 0.98 0.00 0.00 173.24 174.76 1wb1 s THR 227 N -0.51 0.00 0.09 2.02 -4.23 -0.75 -4.75 115.64 107.52 1wb1 s THR 227 Ca 0.50 -0.01 0.03 0.00 -1.18 0.00 0.00 61.69 61.02 1wb1 s THR 227 Cb -0.33 -0.28 -0.04 0.00 1.34 0.00 0.00 72.50 73.19 1wb1 s THR 227 CO 0.39 -0.00 0.13 -0.54 -0.54 0.00 0.00 174.62 174.06 1wb1 s LYS 228 N 0.09 3.05 -0.22 3.99 1.02 -1.24 0.94 119.74 127.36 1wb1 s LYS 228 Ca -0.00 -0.66 -0.04 0.00 0.02 0.00 0.00 55.97 55.29 1wb1 s LYS 228 Cb -0.01 -2.80 0.12 0.00 -0.52 0.00 0.00 37.83 34.61 1wb1 s LYS 228 CO 0.00 0.56 0.40 0.08 -0.92 0.00 0.00 175.35 175.47 1wb1 s VAL 229 N -1.50 -0.63 -0.08 3.17 1.01 -1.12 -0.40 120.40 120.85 1wb1 s VAL 229 Ca 0.31 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 1wb1 s VAL 229 Cb -0.12 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 1wb1 s VAL 229 CO 0.24 -0.04 0.14 -0.09 0.00 0.00 0.00 175.10 175.35 1wb1 h ARG 230 N 8.18 -0.11 -6.13 2.72 2.43 -1.84 0.62 114.38 120.24 1wb1 h ARG 230 Ca -0.18 0.01 -0.56 0.00 -0.81 0.00 0.00 59.98 58.44 1wb1 h ARG 230 Cb 1.14 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.68 1wb1 h ARG 230 CO 0.21 -0.07 -0.39 0.45 -1.51 0.00 0.00 179.97 178.66 1wb1 s SER 231 N -5.20 6.39 -0.29 -3.80 0.15 -1.26 -2.00 113.70 107.68 1wb1 s SER 231 Ca -0.02 0.36 0.02 0.00 0.70 0.00 0.00 55.95 57.01 1wb1 s SER 231 Cb 0.00 -1.99 0.08 0.00 -1.71 0.00 0.00 66.02 62.40 1wb1 s SER 231 CO 0.05 0.03 0.02 -0.63 1.20 0.00 0.00 173.24 173.91 1wb1 s ILE 232 N -1.75 1.65 0.00 6.45 1.09 0.37 -4.22 121.20 124.79 1wb1 s ILE 232 Ca 0.37 -1.68 -0.01 0.00 -1.10 0.00 0.00 60.65 58.23 1wb1 s ILE 232 Cb -0.11 -2.10 -0.05 0.00 -1.06 0.00 0.00 42.46 39.13 1wb1 s ILE 232 CO 0.28 -0.42 1.61 1.67 -0.10 0.00 0.00 174.94 177.98 1wb1 n GLN 233 N 4.56 0.81 -1.93 2.79 7.27 -0.94 -1.50 117.38 128.45 1wb1 n GLN 233 Ca -0.04 -0.19 -0.42 0.00 0.07 0.00 0.00 57.00 56.42 1wb1 n GLN 233 Cb 0.43 -1.38 -0.03 0.00 2.41 0.00 0.00 30.24 31.67 1wb1 n GLN 233 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 1wb1 s TYR 234 N 1.06 3.02 -1.26 3.69 5.04 -1.20 -2.69 117.35 125.01 1wb1 s TYR 234 Ca 0.13 0.74 -0.02 0.00 -2.44 0.00 0.00 57.07 55.47 1wb1 s TYR 234 Cb 0.06 -3.92 -0.01 0.00 0.35 0.00 0.00 41.96 38.44 1wb1 s TYR 234 CO 0.00 -3.27 0.75 0.34 -1.34 0.00 0.00 175.55 172.03 1wb1 n PHE 235 N 3.37 -1.98 -0.99 4.97 7.35 -1.26 -2.32 117.46 126.60 1wb1 n PHE 235 Ca 0.12 0.82 -0.04 0.00 -0.76 0.00 0.00 57.45 57.58 1wb1 n PHE 235 Cb 0.39 -4.36 -0.02 0.00 0.35 0.00 0.00 39.48 35.84 1wb1 n PHE 235 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1wb1 n LYS 236 N -4.17 -1.26 -4.36 -4.13 5.02 -1.10 -4.89 118.16 103.28 1wb1 n LYS 236 Ca -0.26 0.26 -0.21 0.00 -2.02 0.00 0.00 58.31 56.07 1wb1 n LYS 236 Cb 0.67 -4.16 -0.16 0.00 -0.02 0.00 0.00 35.03 31.36 1wb1 n LYS 236 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1wb1 s GLU 237 N -2.08 1.09 0.04 1.97 -1.05 -0.98 -5.08 118.70 112.61 1wb1 s GLU 237 Ca 0.00 -0.26 -0.30 0.00 -0.15 0.00 0.00 54.97 54.26 1wb1 s GLU 237 Cb 0.00 -0.99 -0.07 0.00 -0.44 0.00 0.00 34.13 32.62 1wb1 s GLU 237 CO 0.00 0.03 1.60 -1.54 0.95 0.00 0.00 175.26 176.29 1wb1 s SER 238 N 0.55 6.67 0.00 0.83 1.04 -1.26 -3.26 113.70 118.27 1wb1 s SER 238 Ca -0.09 2.38 0.00 0.00 0.48 0.00 0.00 55.95 58.72 1wb1 s SER 238 Cb -0.12 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1wb1 s SER 238 CO 0.01 -0.85 0.00 0.52 0.98 0.00 0.00 173.24 173.90 1wb1 n VAL 239 N 4.79 0.00 0.04 5.02 0.31 -0.56 -4.97 118.33 122.96 1wb1 n VAL 239 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 1wb1 n VAL 239 Cb 0.41 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.34 1wb1 n VAL 239 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1wb1 n MET 240 N 0.00 0.00 -1.51 5.55 2.81 -1.26 0.14 117.12 122.85 1wb1 n MET 240 Ca 0.00 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.69 1wb1 n MET 240 Cb 0.00 0.00 -0.19 0.00 -0.71 0.00 0.00 33.22 32.32 1wb1 n MET 240 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1wb1 n GLU 241 N -2.73 0.13 -3.92 0.03 4.71 -1.26 -4.68 120.64 112.92 1wb1 n GLU 241 Ca 0.00 -0.21 -0.34 0.00 -0.01 0.00 0.00 57.16 56.60 1wb1 n GLU 241 Cb 0.00 -1.65 -0.14 0.00 -1.01 0.00 0.00 31.44 28.65 1wb1 n GLU 241 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1wb1 s ALA 242 N 3.57 2.84 0.85 0.62 0.00 -1.24 -4.97 121.76 123.42 1wb1 s ALA 242 Ca 1.21 -1.96 0.00 0.00 0.00 0.00 0.00 51.96 51.22 1wb1 s ALA 242 Cb -0.67 -1.96 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1wb1 s ALA 242 CO 0.45 -1.38 0.00 1.63 0.00 0.00 0.00 175.76 176.45 1wb1 n LYS 243 N 4.55 2.17 -3.76 0.00 5.02 -1.26 -3.55 118.16 121.33 1wb1 n LYS 243 Ca -0.10 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.84 1wb1 n LYS 243 Cb 0.43 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.36 1wb1 n LYS 243 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wb1 s ALA 244 N -2.02 3.73 0.00 7.82 0.00 -1.21 -4.55 121.76 125.52 1wb1 s ALA 244 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.29 1wb1 s ALA 244 Cb 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.99 1wb1 s ALA 244 CO 0.00 0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.43 1wb1 n GLY 245 N 3.19 1.47 2.81 0.00 0.00 0.38 -4.86 105.19 108.19 1wb1 n GLY 245 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 1wb1 n GLY 245 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1wb1 s ASP 246 N -2.00 2.28 -0.88 1.61 -4.77 -1.26 -4.64 116.67 107.00 1wb1 s ASP 246 Ca 0.00 -0.43 -0.16 0.00 -3.30 0.00 0.00 52.55 48.66 1wb1 s ASP 246 Cb 0.00 -0.64 -0.11 0.00 -1.09 0.00 0.00 42.92 41.08 1wb1 s ASP 246 CO 0.00 -0.21 2.02 -1.14 0.70 0.00 0.00 175.17 176.54 1wb1 n ARG 247 N 5.03 1.82 -1.68 2.11 0.63 -1.26 -3.34 116.66 119.98 1wb1 n ARG 247 Ca -0.09 -1.80 -0.29 0.00 -0.92 0.00 0.00 57.85 54.75 1wb1 n ARG 247 Cb 0.49 -2.81 0.11 0.00 0.45 0.00 0.00 32.46 30.70 1wb1 n ARG 247 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 1wb1 s VAL 248 N 4.34 2.14 0.07 5.15 -7.23 -1.18 -4.62 120.40 119.06 1wb1 s VAL 248 Ca 0.51 0.04 0.06 0.00 -1.81 0.00 0.00 61.98 60.79 1wb1 s VAL 248 Cb 0.13 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.14 1wb1 s VAL 248 CO 0.05 -0.06 -0.11 -0.83 -0.31 0.00 0.00 175.10 173.85 1wb1 s GLY 249 N -4.22 1.74 -0.04 2.32 0.00 -1.25 -4.02 107.32 101.85 1wb1 s GLY 249 Ca 0.63 -1.18 0.01 0.00 0.00 0.00 0.00 44.72 44.18 1wb1 s GLY 249 CO 0.52 -1.11 -0.04 1.06 0.00 0.00 0.00 173.10 173.53 1wb1 s MET 250 N -1.86 0.69 -0.21 2.90 -1.94 0.69 -2.20 119.30 117.37 1wb1 s MET 250 Ca 0.19 -0.08 -0.05 0.00 -1.71 0.00 0.00 55.69 54.04 1wb1 s MET 250 Cb -0.11 -0.73 -0.02 0.00 2.01 0.00 0.00 34.83 35.98 1wb1 s MET 250 CO 0.11 -0.07 -0.00 0.00 -0.01 0.00 0.00 175.02 175.04 1wb1 s ALA 251 N 0.83 2.99 0.16 3.03 0.00 -1.24 0.99 121.76 128.51 1wb1 s ALA 251 Ca -0.10 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 50.89 1wb1 s ALA 251 Cb -0.13 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 21.16 1wb1 s ALA 251 CO -0.00 -0.24 -0.18 0.42 0.00 0.00 0.00 175.76 175.76 1wb1 s ILE 252 N 1.16 1.75 0.09 0.00 1.01 -1.16 -4.39 121.20 119.67 1wb1 s ILE 252 Ca 0.03 -1.87 -0.06 0.00 0.00 0.00 0.00 60.65 58.75 1wb1 s ILE 252 Cb -0.14 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 1wb1 s ILE 252 CO 0.01 -0.32 0.34 -1.10 0.00 0.00 0.00 174.94 173.88 1wb1 s GLN 253 N -2.74 3.62 -1.09 2.79 -0.21 0.46 -4.41 119.66 118.09 1wb1 s GLN 253 Ca 0.14 -0.06 -0.04 0.00 0.02 0.00 0.00 55.36 55.42 1wb1 s GLN 253 Cb -0.06 -2.95 -0.05 0.00 1.00 0.00 0.00 33.01 30.96 1wb1 s GLN 253 CO 0.06 0.54 0.94 0.41 -2.12 0.00 0.00 175.29 175.12 1wb1 n GLY 254 N 0.51 -0.89 3.64 3.09 0.00 -1.26 -3.62 105.19 106.65 1wb1 n GLY 254 Ca -0.06 0.43 -0.07 0.00 0.00 0.00 0.00 46.02 46.31 1wb1 n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wb1 s VAL 255 N -3.38 0.00 0.71 1.61 1.01 -1.26 -4.74 120.40 114.35 1wb1 s VAL 255 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1wb1 s VAL 255 Cb -0.04 -1.00 0.13 0.00 0.00 0.00 0.00 36.38 35.47 1wb1 s VAL 255 CO 0.73 0.00 0.98 -1.81 0.00 0.00 0.00 175.10 175.00 1wb1 s ASP 256 N 1.49 4.38 -0.09 3.32 1.01 -1.26 -4.63 116.67 120.89 1wb1 s ASP 256 Ca -0.09 -0.43 -0.27 0.00 0.71 0.00 0.00 52.55 52.47 1wb1 s ASP 256 Cb -0.05 0.06 -0.23 0.00 1.01 0.00 0.00 42.92 43.71 1wb1 s ASP 256 CO -0.18 -1.84 0.96 0.00 0.21 0.00 0.00 175.17 174.32 1wb1 h ALA 257 N -0.48 -0.01 -0.72 5.23 0.00 -1.85 -3.32 119.26 118.11 1wb1 h ALA 257 Ca -0.35 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1wb1 h ALA 257 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1wb1 h ALA 257 CO 0.40 -0.12 0.00 1.63 0.00 0.00 0.00 179.25 181.16 1wb1 n LYS 258 N -4.73 2.97 -0.29 0.00 4.76 -1.26 -4.16 118.16 115.45 1wb1 n LYS 258 Ca -0.09 -2.72 0.03 0.00 -2.87 0.00 0.00 58.31 52.66 1wb1 n LYS 258 Cb 0.37 -1.66 0.15 0.00 -1.84 0.00 0.00 35.03 32.05 1wb1 n LYS 258 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1wb1 n GLN 259 N 1.54 2.26 -3.81 1.97 1.13 -1.25 -4.74 117.38 114.49 1wb1 n GLN 259 Ca 0.25 -1.19 -0.36 0.00 -1.94 0.00 0.00 57.00 53.76 1wb1 n GLN 259 Cb 0.69 -1.61 -0.13 0.00 0.11 0.00 0.00 30.24 29.30 1wb1 n GLN 259 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1wb1 s ILE 260 N -1.67 4.21 -2.19 5.09 -4.36 -1.26 -4.78 121.20 116.25 1wb1 s ILE 260 Ca 0.21 -0.21 0.28 0.00 -0.26 0.00 0.00 60.65 60.67 1wb1 s ILE 260 Cb 0.14 -2.96 0.51 0.00 1.25 0.00 0.00 42.46 41.40 1wb1 s ILE 260 CO 0.09 0.36 1.76 0.00 0.24 0.00 0.00 174.94 177.39 1wb1 n TYR 261 N 4.79 0.00 -1.19 1.37 9.36 -1.26 -4.94 117.16 125.30 1wb1 n TYR 261 Ca -0.16 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 60.99 1wb1 n TYR 261 Cb 0.51 -0.05 -0.03 0.00 -0.63 0.00 0.00 39.34 39.15 1wb1 n TYR 261 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1wb1 n ARG 262 N -0.25 -0.51 -0.94 2.98 0.63 -1.26 -5.18 116.66 112.13 1wb1 n ARG 262 Ca 0.17 0.69 0.00 0.00 -0.92 0.00 0.00 57.85 57.80 1wb1 n ARG 262 Cb 0.32 -4.46 -0.01 0.00 0.45 0.00 0.00 32.46 28.76 1wb1 n ARG 262 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1wb1 n GLY 263 N -2.08 0.75 3.26 5.14 0.00 -1.26 -4.95 105.19 106.05 1wb1 n GLY 263 Ca -0.06 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 1wb1 n GLY 263 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wb1 s ILE 265 N 0.00 -0.54 -0.56 -0.61 1.01 -1.26 -4.60 121.20 114.64 1wb1 s ILE 265 Ca 0.12 0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.93 1wb1 s ILE 265 Cb 0.14 -0.65 0.00 0.00 0.01 0.00 0.00 42.46 41.96 1wb1 s ILE 265 CO -0.06 0.07 0.71 -0.11 0.00 0.00 0.00 174.94 175.54 1wb1 n LEU 266 N 5.20 1.84 -4.73 2.97 7.94 -1.18 -2.55 117.00 126.49 1wb1 n LEU 266 Ca -0.11 -0.92 -0.42 0.00 -1.11 0.00 0.00 56.01 53.45 1wb1 n LEU 266 Cb 0.50 -0.49 -0.02 0.00 0.53 0.00 0.00 43.42 43.94 1wb1 n LEU 266 CO 0.01 0.35 1.25 -0.89 -1.11 0.00 0.00 177.39 177.00 1wb1 s THR 267 N -0.55 2.33 0.00 1.96 2.01 -1.26 -4.65 115.64 115.48 1wb1 s THR 267 Ca 0.00 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.26 1wb1 s THR 267 Cb 0.00 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.35 1wb1 s THR 267 CO 0.00 0.03 0.00 -1.54 -0.69 0.00 0.00 174.62 172.42 1wb1 n SER 268 N 3.22 1.38 0.00 3.53 3.41 -0.80 -4.12 113.62 120.24 1wb1 n SER 268 Ca 0.12 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 1wb1 n SER 268 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1wb1 n SER 268 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wb1 n LYS 269 N 0.00 0.00 0.00 4.33 5.02 -1.26 -3.02 118.16 123.23 1wb1 n LYS 269 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1wb1 n LYS 269 Cb 0.00 0.00 0.80 0.00 -0.02 0.00 0.00 35.03 35.81 1wb1 n LYS 269 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1wb1 n ASP 270 N 0.74 0.00 0.00 4.39 -0.08 -1.26 -4.92 116.55 115.42 1wb1 n ASP 270 Ca 0.00 -1.13 0.00 0.00 -1.51 0.00 0.00 54.79 52.15 1wb1 n ASP 270 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1wb1 n ASP 270 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1wb1 n THR 271 N -0.93 0.00 1.31 5.18 5.66 -1.17 -4.85 114.28 119.49 1wb1 n THR 271 Ca 0.20 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.33 1wb1 n THR 271 Cb 0.09 0.00 0.68 0.00 -1.55 0.00 0.00 70.33 69.55 1wb1 n THR 271 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1wb1 n LYS 272 N 0.00 0.47 -1.37 1.09 5.02 -1.26 -4.86 118.16 117.25 1wb1 n LYS 272 Ca 0.00 0.04 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 1wb1 n LYS 272 Cb 0.00 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.58 1wb1 n LYS 272 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wb1 n LEU 273 N -1.22 2.54 -3.21 -0.35 4.77 -1.26 -4.66 117.00 113.60 1wb1 n LEU 273 Ca 0.14 0.67 -0.01 0.00 -0.03 0.00 0.00 56.01 56.78 1wb1 n LEU 273 Cb 0.18 -1.33 -0.02 0.00 -2.33 0.00 0.00 43.42 39.92 1wb1 n LEU 273 CO 0.18 -2.42 0.04 -1.58 -1.33 0.00 0.00 177.39 172.29 1wb1 s GLN 274 N -3.00 0.56 -0.38 3.23 0.74 -0.75 -4.88 119.66 115.19 1wb1 s GLN 274 Ca 0.71 0.25 -0.45 0.00 0.05 0.00 0.00 55.36 55.92 1wb1 s GLN 274 Cb -0.36 0.03 -0.20 0.00 1.10 0.00 0.00 33.01 33.58 1wb1 s GLN 274 CO 0.52 -1.07 1.47 2.41 -0.55 0.00 0.00 175.29 178.06 1wb1 n THR 275 N 5.20 0.00 -4.46 -0.34 -1.04 -1.26 -4.10 114.28 108.29 1wb1 n THR 275 Ca 0.05 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.77 1wb1 n THR 275 Cb 0.53 -0.38 -0.07 0.00 -1.82 0.00 0.00 70.33 68.59 1wb1 n THR 275 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1wb1 s VAL 276 N 2.27 1.63 0.00 12.58 1.01 0.21 -4.80 120.40 133.30 1wb1 s VAL 276 Ca 1.01 -1.85 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1wb1 s VAL 276 Cb -1.44 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1wb1 s VAL 276 CO 0.76 0.00 0.00 -0.67 0.00 0.00 0.00 175.10 175.19 1wb1 n ASP 277 N -1.29 0.00 -3.96 3.32 2.03 -1.26 -1.68 116.55 113.71 1wb1 n ASP 277 Ca -0.10 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.91 1wb1 n ASP 277 Cb 0.66 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.91 1wb1 n ASP 277 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1wb1 s LYS 278 N -1.00 1.69 0.07 -0.67 -0.14 -1.26 0.84 119.74 119.28 1wb1 s LYS 278 Ca 0.00 -1.05 0.02 0.00 -1.36 0.00 0.00 55.97 53.58 1wb1 s LYS 278 Cb 0.00 -2.63 -0.03 0.00 -1.68 0.00 0.00 37.83 33.48 1wb1 s LYS 278 CO 0.00 -0.61 -0.07 0.96 -0.76 0.00 0.00 175.35 174.87 1wb1 s ILE 279 N 1.35 0.64 -0.06 2.17 -5.25 0.07 -3.34 121.20 116.78 1wb1 s ILE 279 Ca -0.06 -1.56 -0.04 0.00 -0.99 0.00 0.00 60.65 58.00 1wb1 s ILE 279 Cb -0.19 -1.22 0.03 0.00 2.95 0.00 0.00 42.46 44.03 1wb1 s ILE 279 CO -0.06 -0.65 0.15 -0.69 -1.79 0.00 0.00 174.94 171.90 1wb1 s VAL 280 N -2.63 -0.03 0.34 8.37 1.01 -1.03 0.30 120.40 126.73 1wb1 s VAL 280 Ca 0.02 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.15 1wb1 s VAL 280 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 1wb1 s VAL 280 CO -0.02 0.04 0.21 0.00 0.00 0.00 0.00 175.10 175.33 1wb1 s ALA 281 N 0.68 2.09 -0.85 5.51 0.00 -1.26 -2.09 121.76 125.85 1wb1 s ALA 281 Ca -0.05 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 49.97 1wb1 s ALA 281 Cb -0.07 1.24 0.18 0.00 0.00 0.00 0.00 23.12 24.47 1wb1 s ALA 281 CO -0.03 -0.55 0.89 0.21 0.00 0.00 0.00 175.76 176.27 1wb1 s LYS 282 N -3.62 3.56 0.53 0.00 2.20 -1.26 -4.47 119.74 116.68 1wb1 s LYS 282 Ca 0.36 -2.13 -0.12 0.00 -0.36 0.00 0.00 55.97 53.71 1wb1 s LYS 282 Cb 0.03 -4.59 -0.06 0.00 -1.51 0.00 0.00 37.83 31.70 1wb1 s LYS 282 CO 0.22 -1.48 0.94 0.42 -0.36 0.00 0.00 175.35 175.09 1wb1 s ILE 283 N 1.23 4.69 -0.29 5.43 -1.09 -1.26 -3.97 121.20 125.95 1wb1 s ILE 283 Ca 0.23 0.85 -0.01 0.00 -2.23 0.00 0.00 60.65 59.49 1wb1 s ILE 283 Cb -0.09 -3.80 0.13 0.00 -1.58 0.00 0.00 42.46 37.12 1wb1 s ILE 283 CO -0.08 -0.85 0.28 -0.54 -1.23 0.00 0.00 174.94 172.52 1wb1 s LYS 284 N -4.54 0.31 0.46 2.79 1.02 -1.18 -4.38 119.74 114.22 1wb1 s LYS 284 Ca 0.55 -0.15 -0.24 0.00 0.02 0.00 0.00 55.97 56.15 1wb1 s LYS 284 Cb -0.10 -0.70 -0.08 0.00 -0.52 0.00 0.00 37.83 36.42 1wb1 s LYS 284 CO 0.42 -1.01 1.21 0.44 -0.92 0.00 0.00 175.35 175.48 1wb1 n ILE 285 N 5.31 2.88 -1.87 2.17 -5.35 -1.26 -3.40 119.36 117.84 1wb1 n ILE 285 Ca -0.02 -0.50 -0.41 0.00 -0.27 0.00 0.00 62.75 61.55 1wb1 n ILE 285 Cb 0.46 -1.47 -0.01 0.00 -1.74 0.00 0.00 39.64 36.88 1wb1 n ILE 285 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1wb1 s SER 286 N -0.71 6.44 0.03 7.28 1.04 -1.26 -4.83 113.70 121.68 1wb1 s SER 286 Ca 0.65 2.96 -0.01 0.00 0.48 0.00 0.00 55.95 60.03 1wb1 s SER 286 Cb -0.49 -2.66 0.04 0.00 0.10 0.00 0.00 66.02 63.01 1wb1 s SER 286 CO 0.55 -0.81 0.14 -0.67 0.98 0.00 0.00 173.24 173.43 1wb1 n ASP 287 N 0.78 -0.03 -4.55 7.02 2.03 -1.26 -3.93 116.55 116.60 1wb1 n ASP 287 Ca 0.02 0.15 -0.35 0.00 0.52 0.00 0.00 54.79 55.13 1wb1 n ASP 287 Cb 0.40 -0.05 -0.03 0.00 -0.72 0.00 0.00 41.12 40.72 1wb1 n ASP 287 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wb1 s ILE 288 N -5.11 3.12 -0.40 5.18 1.01 -1.26 -4.77 121.20 118.96 1wb1 s ILE 288 Ca -0.01 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.64 1wb1 s ILE 288 Cb 0.02 -3.31 -0.12 0.00 0.01 0.00 0.00 42.46 39.07 1wb1 s ILE 288 CO 0.07 -0.30 2.29 0.49 0.00 0.00 0.00 174.94 177.49 1wb1 n PHE 289 N 15.11 0.60 -0.60 3.97 3.01 -1.25 -4.39 117.46 133.90 1wb1 n PHE 289 Ca 0.32 -1.37 0.03 0.00 1.01 0.00 0.00 57.45 57.44 1wb1 n PHE 289 Cb 0.53 -1.37 0.32 0.00 -0.01 0.00 0.00 39.48 38.95 1wb1 n PHE 289 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1wb1 n LYS 290 N 3.30 4.01 -4.46 -1.08 3.00 -1.26 -4.90 118.16 116.77 1wb1 n LYS 290 Ca 0.35 -2.60 -0.29 0.00 -0.00 0.00 0.00 58.31 55.76 1wb1 n LYS 290 Cb 0.38 -2.12 -0.17 0.00 0.00 0.00 0.00 35.03 33.12 1wb1 n LYS 290 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1wb1 s TYR 291 N -2.49 2.08 0.31 5.64 1.51 -1.26 -5.12 117.35 118.02 1wb1 s TYR 291 Ca 0.46 -1.00 -0.29 0.00 -1.01 0.00 0.00 57.07 55.22 1wb1 s TYR 291 Cb 0.35 -1.49 -0.11 0.00 -0.11 0.00 0.00 41.96 40.61 1wb1 s TYR 291 CO 0.13 -0.51 1.46 1.21 -1.11 0.00 0.00 175.55 176.73 1wb1 s ASN 292 N 1.00 6.53 -0.33 2.29 3.84 -1.26 -4.92 114.94 122.09 1wb1 s ASN 292 Ca -0.06 2.84 -0.01 0.00 0.21 0.00 0.00 52.86 55.84 1wb1 s ASN 292 Cb -0.15 -2.64 0.20 0.00 -0.55 0.00 0.00 41.25 38.11 1wb1 s ASN 292 CO -0.02 -0.76 2.09 0.18 -2.79 0.00 0.00 177.10 175.80 1wb1 n LEU 293 N 1.43 6.49 -4.75 3.21 4.77 -1.26 -4.95 117.00 121.93 1wb1 n LEU 293 Ca 0.04 -3.38 -0.40 0.00 -0.03 0.00 0.00 56.01 52.23 1wb1 n LEU 293 Cb 0.40 -1.07 -0.05 0.00 -2.33 0.00 0.00 43.42 40.37 1wb1 n LEU 293 CO 0.62 1.28 0.75 -0.89 -1.33 0.00 0.00 177.39 177.82 1wb1 s THR 294 N -2.31 3.72 0.51 -5.08 2.01 -1.26 -4.80 115.64 108.42 1wb1 s THR 294 Ca 0.34 1.67 -0.19 0.00 0.31 0.00 0.00 61.69 63.82 1wb1 s THR 294 Cb 0.26 -4.07 -0.07 0.00 0.01 0.00 0.00 72.50 68.63 1wb1 s THR 294 CO -0.02 0.38 1.05 -2.84 -0.69 0.00 0.00 174.62 172.50 1wb1 s PRO 295 N -1.16 3.67 -0.13 4.92 0.02 -1.26 -4.60 135.00 136.46 1wb1 s PRO 295 Ca 0.44 1.36 -0.09 0.00 0.02 0.00 0.00 61.00 62.73 1wb1 s PRO 295 Cb -0.30 -2.07 0.03 0.00 0.02 0.00 0.00 34.50 32.18 1wb1 s PRO 295 CO 0.38 -0.54 0.18 1.63 -0.33 0.00 0.00 177.00 178.31 1wb1 n LYS 296 N -1.19 -4.34 -3.82 5.54 5.02 0.66 -4.94 118.16 115.08 1wb1 n LYS 296 Ca 0.09 3.28 -0.13 0.00 -2.02 0.00 0.00 58.31 59.54 1wb1 n LYS 296 Cb 0.52 -4.64 -0.14 0.00 -0.02 0.00 0.00 35.03 30.76 1wb1 n LYS 296 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1wb1 s MET 297 N -0.71 0.05 -0.77 1.97 -1.94 -0.97 -4.87 119.30 112.05 1wb1 s MET 297 Ca -0.21 0.14 -0.18 0.00 -1.71 0.00 0.00 55.69 53.73 1wb1 s MET 297 Cb 0.01 -0.05 0.14 0.00 2.01 0.00 0.00 34.83 36.94 1wb1 s MET 297 CO 0.56 -0.06 0.89 0.15 -0.01 0.00 0.00 175.02 176.56 1wb1 s LYS 298 N 0.39 3.37 0.00 2.03 -0.14 -1.26 -2.37 119.74 121.75 1wb1 s LYS 298 Ca -0.03 -1.68 0.00 0.00 -1.36 0.00 0.00 55.97 52.90 1wb1 s LYS 298 Cb -0.04 -4.53 0.00 0.00 -1.68 0.00 0.00 37.83 31.57 1wb1 s LYS 298 CO -0.01 -1.60 0.00 1.33 -0.76 0.00 0.00 175.35 174.31 1wb1 n VAL 299 N 5.23 0.00 -4.98 3.17 0.24 -1.23 -5.00 118.33 115.75 1wb1 n VAL 299 Ca 0.08 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.09 1wb1 n VAL 299 Cb 0.46 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.66 1wb1 n VAL 299 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1wb1 s HIS 300 N -1.09 2.08 0.15 6.34 0.09 -1.17 -2.50 115.29 119.19 1wb1 s HIS 300 Ca 0.00 -0.76 0.03 0.00 -0.00 0.00 0.00 55.06 54.33 1wb1 s HIS 300 Cb 0.00 -1.41 -0.04 0.00 -0.00 0.00 0.00 32.58 31.13 1wb1 s HIS 300 CO 0.00 -0.30 0.27 -1.17 -0.00 0.00 0.00 174.74 173.53 1wb1 s LEU 301 N 0.29 4.28 -0.08 0.89 2.96 -0.28 -1.41 118.68 125.32 1wb1 s LEU 301 Ca -0.13 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 1wb1 s LEU 301 Cb -0.16 -2.85 0.02 0.00 0.50 0.00 0.00 46.19 43.70 1wb1 s LEU 301 CO 0.05 0.06 -0.11 0.20 -1.32 0.00 0.00 176.35 175.23 1wb1 s ASN 302 N -3.21 1.96 -0.06 3.68 0.01 -0.43 -2.53 114.94 114.35 1wb1 s ASN 302 Ca 0.34 -0.31 -0.13 0.00 -0.71 0.00 0.00 52.86 52.05 1wb1 s ASN 302 Cb -0.11 -0.85 0.03 0.00 0.41 0.00 0.00 41.25 40.72 1wb1 s ASN 302 CO 0.28 -0.02 0.31 -0.69 -1.51 0.00 0.00 177.10 175.47 1wb1 s VAL 303 N 1.03 0.03 -0.55 1.60 1.01 -0.53 -3.61 120.40 119.38 1wb1 s VAL 303 Ca -0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 1wb1 s VAL 303 Cb -0.15 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.70 1wb1 s VAL 303 CO -0.01 -0.14 0.42 0.61 0.00 0.00 0.00 175.10 175.98 1wb1 n GLY 304 N 2.04 -0.79 3.89 4.51 0.00 -1.26 0.11 105.19 113.70 1wb1 n GLY 304 Ca -0.18 0.47 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 1wb1 n GLY 304 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1wb1 n MET 305 N -1.77 -1.33 -4.99 1.61 -0.00 -1.24 -4.87 117.12 104.52 1wb1 n MET 305 Ca -0.21 0.10 -0.30 0.00 -0.00 0.00 0.00 57.70 57.29 1wb1 n MET 305 Cb 0.49 -4.50 -0.17 0.00 -0.00 0.00 0.00 33.22 29.03 1wb1 n MET 305 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1wb1 s LEU 306 N -6.43 1.97 -0.69 3.17 1.43 0.31 -4.83 118.68 113.61 1wb1 s LEU 306 Ca 0.59 -0.50 0.05 0.00 -1.03 0.00 0.00 54.13 53.24 1wb1 s LEU 306 Cb -0.34 -1.27 0.17 0.00 0.03 0.00 0.00 46.19 44.78 1wb1 s LEU 306 CO 0.72 0.12 0.48 -0.63 0.23 0.00 0.00 176.35 177.26 1wb1 s ILE 307 N 0.49 2.83 0.17 -0.59 1.01 -1.26 -1.45 121.20 122.40 1wb1 s ILE 307 Ca -0.16 -4.19 0.07 0.00 0.00 0.00 0.00 60.65 56.37 1wb1 s ILE 307 Cb -0.17 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 1wb1 s ILE 307 CO 0.06 -0.99 0.02 0.68 0.00 0.00 0.00 174.94 174.71 1wb1 s VAL 308 N -1.35 3.82 0.68 2.92 -7.23 -1.05 -4.91 120.40 113.28 1wb1 s VAL 308 Ca 0.24 -1.37 -0.11 0.00 -1.81 0.00 0.00 61.98 58.93 1wb1 s VAL 308 Cb -0.06 -2.92 0.17 0.00 0.56 0.00 0.00 36.38 34.13 1wb1 s VAL 308 CO -0.15 -0.11 0.59 -2.65 -0.31 0.00 0.00 175.10 172.47 1wb1 n PRO 309 N -0.14 -2.24 -3.41 4.82 -0.02 -1.26 -1.13 135.00 131.62 1wb1 n PRO 309 Ca -0.09 -0.95 0.00 0.00 -2.02 0.00 0.00 63.50 60.43 1wb1 n PRO 309 Cb 0.55 -0.90 0.00 0.00 -0.02 0.00 0.00 33.50 33.13 1wb1 n PRO 309 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wb1 n ALA 310 N -4.05 0.00 -3.31 3.55 0.00 -1.04 -3.37 120.51 112.29 1wb1 n ALA 310 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.20 1wb1 n ALA 310 Cb 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.66 1wb1 n ALA 310 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1wb1 s VAL 311 N -3.00 -0.01 -0.10 0.00 -7.23 -1.18 -3.53 120.40 105.35 1wb1 s VAL 311 Ca 0.00 0.03 -0.05 0.00 -1.81 0.00 0.00 61.98 60.15 1wb1 s VAL 311 Cb 0.00 -0.41 -0.04 0.00 0.56 0.00 0.00 36.38 36.49 1wb1 s VAL 311 CO 0.00 0.01 0.11 0.00 -0.31 0.00 0.00 175.10 174.92 1wb1 s ALA 312 N 0.44 3.76 -0.40 1.32 0.00 -1.00 -1.45 121.76 124.43 1wb1 s ALA 312 Ca -0.02 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.28 1wb1 s ALA 312 Cb -0.04 -1.85 0.16 0.00 0.00 0.00 0.00 23.12 21.39 1wb1 s ALA 312 CO -0.02 0.62 0.32 0.08 0.00 0.00 0.00 175.76 176.77 1wb1 s VAL 313 N -1.03 0.19 0.90 0.00 1.01 -0.65 0.24 120.40 121.07 1wb1 s VAL 313 Ca 0.16 -2.25 -0.14 0.00 0.00 0.00 0.00 61.98 59.75 1wb1 s VAL 313 Cb -0.12 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.14 1wb1 s VAL 313 CO 0.05 -1.09 0.40 -0.81 0.00 0.00 0.00 175.10 173.65 1wb1 n PRO 314 N 3.23 -0.15 0.00 2.72 -0.04 -1.26 -2.53 135.00 136.97 1wb1 n PRO 314 Ca 0.24 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 1wb1 n PRO 314 Cb 0.45 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 1wb1 n PRO 314 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1wb1 n PHE 315 N -3.30 0.00 -3.90 0.54 1.16 -1.24 -3.45 117.46 107.26 1wb1 n PHE 315 Ca 0.07 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.41 1wb1 n PHE 315 Cb 0.53 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.36 1wb1 n PHE 315 CO 0.00 0.00 0.00 -1.59 -1.87 0.00 0.00 176.76 173.30 1wb1 s LYS 316 N -2.00 2.32 -0.35 3.97 -2.85 0.15 -3.15 119.74 117.83 1wb1 s LYS 316 Ca 0.00 -1.83 0.03 0.00 -1.00 0.00 0.00 55.97 53.17 1wb1 s LYS 316 Cb 0.00 -2.12 0.10 0.00 -2.06 0.00 0.00 37.83 33.75 1wb1 s LYS 316 CO 0.00 -0.31 0.08 0.21 0.10 0.00 0.00 175.35 175.43 1wb1 s LYS 317 N -4.09 1.37 -0.07 1.78 2.20 -1.26 -1.74 119.74 117.92 1wb1 s LYS 317 Ca 0.40 -1.79 0.03 0.00 -0.36 0.00 0.00 55.97 54.25 1wb1 s LYS 317 Cb -0.00 -2.97 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 1wb1 s LYS 317 CO 0.23 -0.97 -0.15 0.08 -0.36 0.00 0.00 175.35 174.18 1wb1 s VAL 318 N 0.93 1.35 -0.10 4.02 1.01 -1.11 -5.00 120.40 121.51 1wb1 s VAL 318 Ca 0.11 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 1wb1 s VAL 318 Cb -0.19 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1wb1 s VAL 318 CO -0.10 0.40 0.10 -0.89 0.00 0.00 0.00 175.10 174.61 1wb1 s THR 319 N 0.48 5.12 0.00 3.92 2.01 -1.26 -3.96 115.64 121.95 1wb1 s THR 319 Ca -0.13 0.02 0.00 0.00 0.31 0.00 0.00 61.69 61.88 1wb1 s THR 319 Cb -0.15 -3.23 0.00 0.00 0.01 0.00 0.00 72.50 69.13 1wb1 s THR 319 CO 0.04 0.58 0.00 2.22 -0.69 0.00 0.00 174.62 176.77 1wb1 n PHE 320 N 1.90 0.00 -2.38 4.92 1.16 -1.25 -4.89 117.46 116.92 1wb1 n PHE 320 Ca -0.19 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.31 1wb1 n PHE 320 Cb 0.54 0.00 0.05 0.00 -1.61 0.00 0.00 39.48 38.46 1wb1 n PHE 320 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1wb1 n GLY 321 N 0.00 3.84 3.39 4.97 0.00 -1.26 -4.91 105.19 111.22 1wb1 n GLY 321 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1wb1 n GLY 321 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wb1 n LYS 322 N -0.59 -0.40 -3.88 1.61 0.00 -1.26 -4.91 118.16 108.73 1wb1 n LYS 322 Ca 0.23 0.10 -0.27 0.00 0.00 0.00 0.00 58.31 58.37 1wb1 n LYS 322 Cb 0.89 -4.02 -0.17 0.00 0.00 0.00 0.00 35.03 31.74 1wb1 n LYS 322 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1wb1 s THR 323 N -1.76 0.97 -1.68 3.15 2.01 -1.26 -4.97 115.64 112.10 1wb1 s THR 323 Ca 0.00 -0.41 0.00 0.00 0.31 0.00 0.00 61.69 61.59 1wb1 s THR 323 Cb 0.00 -1.10 0.00 0.00 0.01 0.00 0.00 72.50 71.41 1wb1 s THR 323 CO 0.00 0.22 0.66 -0.62 -0.69 0.00 0.00 174.62 174.19 1wb1 n GLU 324 N 4.94 0.79 0.00 4.92 4.71 -1.26 -3.96 120.64 130.78 1wb1 n GLU 324 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.04 1wb1 n GLU 324 Cb 0.49 -1.13 0.00 0.00 -1.01 0.00 0.00 31.44 29.79 1wb1 n GLU 324 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1wb1 n GLU 325 N -0.30 0.00 -1.56 3.49 2.13 -1.25 -2.75 120.64 120.39 1wb1 n GLU 325 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 1wb1 n GLU 325 Cb 0.06 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.74 1wb1 n GLU 325 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1wb1 n ASN 326 N 0.00 2.55 -4.59 4.31 4.13 -1.24 -4.21 115.26 116.21 1wb1 n ASN 326 Ca 0.00 -0.23 -0.39 0.00 1.68 0.00 0.00 54.58 55.63 1wb1 n ASN 326 Cb 0.00 -1.55 -0.09 0.00 -1.54 0.00 0.00 39.78 36.60 1wb1 n ASN 326 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1wb1 s ILE 327 N 10.74 5.18 1.02 2.41 1.01 -0.71 -0.62 121.20 140.23 1wb1 s ILE 327 Ca 1.01 0.42 -0.15 0.00 0.00 0.00 0.00 60.65 61.93 1wb1 s ILE 327 Cb -0.28 -3.71 0.07 0.00 0.01 0.00 0.00 42.46 38.55 1wb1 s ILE 327 CO 0.31 0.11 0.31 -0.38 0.00 0.00 0.00 174.94 175.29 1wb1 n ILE 328 N 5.14 0.00 -0.50 2.92 -0.00 -1.26 0.30 119.36 125.97 1wb1 n ILE 328 Ca -0.09 -0.23 -0.17 0.00 -0.00 0.00 0.00 62.75 62.25 1wb1 n ILE 328 Cb 0.51 -0.64 0.02 0.00 -0.00 0.00 0.00 39.64 39.52 1wb1 n ILE 328 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1wb1 n LEU 329 N -1.69 -2.58 -0.28 1.39 -0.00 -1.22 -4.40 117.00 108.22 1wb1 n LEU 329 Ca 0.05 0.14 0.11 0.00 -0.00 0.00 0.00 56.01 56.31 1wb1 n LEU 329 Cb 0.57 -0.37 0.04 0.00 -0.00 0.00 0.00 43.42 43.66 1wb1 n LEU 329 CO 0.51 -2.72 0.27 -3.20 -0.00 0.00 0.00 177.39 172.26 1wb1 n ASN 330 N 1.54 1.46 0.00 1.45 4.05 -1.26 -4.92 115.26 117.57 1wb1 n ASN 330 Ca 0.00 -1.17 0.00 0.00 0.45 0.00 0.00 54.58 53.86 1wb1 n ASN 330 Cb 0.25 0.56 0.00 0.00 1.23 0.00 0.00 39.78 41.82 1wb1 n ASN 330 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 1wb1 n GLU 331 N -0.66 0.00 -4.41 1.20 0.00 -1.26 -4.92 120.64 110.60 1wb1 n GLU 331 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 57.16 57.03 1wb1 n GLU 331 Cb 0.40 -1.45 -0.16 0.00 0.00 0.00 0.00 31.44 30.24 1wb1 n GLU 331 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1wb1 s VAL 332 N -1.39 0.81 -0.68 6.31 1.01 -1.26 -4.77 120.40 120.43 1wb1 s VAL 332 Ca 0.00 -0.37 -0.27 0.00 0.00 0.00 0.00 61.98 61.34 1wb1 s VAL 332 Cb 0.00 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.68 1wb1 s VAL 332 CO 0.00 0.26 1.36 -0.63 0.00 0.00 0.00 175.10 176.09 1wb1 s ILE 333 N 0.24 3.72 -0.19 2.22 1.01 -1.26 -5.01 121.20 121.92 1wb1 s ILE 333 Ca -0.04 0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.99 1wb1 s ILE 333 Cb -0.09 -4.70 -0.05 0.00 0.01 0.00 0.00 42.46 37.63 1wb1 s ILE 333 CO 0.01 -1.58 0.15 -0.44 0.00 0.00 0.00 174.94 173.08 1wb1 s SER 334 N 4.31 6.25 0.00 3.58 0.01 -1.26 -4.96 113.70 121.63 1wb1 s SER 334 Ca 0.43 0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.97 1wb1 s SER 334 Cb -0.09 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 64.04 1wb1 s SER 334 CO 0.18 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.63 1wb1 n GLY 335 N 3.38 0.08 1.43 3.44 0.00 -1.26 -4.64 105.19 107.62 1wb1 n GLY 335 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 1wb1 n GLY 335 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wb1 n ASN 336 N 0.99 1.04 -4.07 1.61 4.05 -1.26 -5.25 115.26 112.37 1wb1 n ASN 336 Ca 0.00 -1.93 -0.36 0.00 0.45 0.00 0.00 54.58 52.74 1wb1 n ASN 336 Cb 0.00 0.45 0.06 0.00 1.23 0.00 0.00 39.78 41.51 1wb1 n ASN 336 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 177.26 172.37 1wb1 n GLU 337 N -0.39 -0.11 0.00 1.20 -0.00 -1.26 -5.06 120.64 115.02 1wb1 n GLU 337 Ca -0.02 -0.03 0.00 0.00 -0.00 0.00 0.00 57.16 57.11 1wb1 n GLU 337 Cb 0.26 -1.16 0.00 0.00 -0.00 0.00 0.00 31.44 30.54 1wb1 n GLU 337 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1wb1 n TYR 339 N -2.92 0.00 -3.78 -1.84 4.02 -1.19 -4.51 117.16 106.94 1wb1 n TYR 339 Ca -0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.62 1wb1 n TYR 339 Cb 0.59 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.75 1wb1 n TYR 339 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wb1 s ALA 341 N -1.00 1.01 -0.24 -0.72 0.00 -1.05 -3.70 121.76 116.06 1wb1 s ALA 341 Ca 0.00 -0.53 -0.08 0.00 0.00 0.00 0.00 51.96 51.35 1wb1 s ALA 341 Cb 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1wb1 s ALA 341 CO 0.00 -0.84 0.09 -0.06 0.00 0.00 0.00 175.76 174.95 1wb1 s PHE 342 N 1.85 3.14 -0.72 0.00 0.40 0.15 -1.63 117.98 121.17 1wb1 s PHE 342 Ca 0.01 -0.21 -0.06 0.00 -0.60 0.00 0.00 56.93 56.08 1wb1 s PHE 342 Cb -0.15 -2.23 0.19 0.00 0.51 0.00 0.00 43.02 41.34 1wb1 s PHE 342 CO -0.07 -0.21 0.58 -1.21 0.70 0.00 0.00 175.22 175.00 1wb1 s GLU 343 N 1.37 2.95 0.34 0.44 2.02 -0.53 -0.75 118.70 124.54 1wb1 s GLU 343 Ca 0.06 -2.62 -0.29 0.00 0.02 0.00 0.00 54.97 52.14 1wb1 s GLU 343 Cb -0.15 -3.95 -0.12 0.00 0.10 0.00 0.00 34.13 30.01 1wb1 s GLU 343 CO 0.04 -1.22 1.41 1.28 0.02 0.00 0.00 175.26 176.80 1wb1 n LEU 344 N 3.46 4.03 -2.16 1.80 4.77 0.25 -3.11 117.00 126.03 1wb1 n LEU 344 Ca 0.11 1.20 -0.24 0.00 -0.03 0.00 0.00 56.01 57.05 1wb1 n LEU 344 Cb 0.40 -1.54 0.15 0.00 -2.33 0.00 0.00 43.42 40.10 1wb1 n LEU 344 CO 0.34 -0.18 1.26 -1.84 -1.33 0.00 0.00 177.39 175.64 1wb1 n GLU 345 N 0.88 2.22 -3.60 3.23 0.28 -1.22 -4.66 120.64 117.77 1wb1 n GLU 345 Ca 0.05 -2.83 -0.07 0.00 -0.16 0.00 0.00 57.16 54.14 1wb1 n GLU 345 Cb 0.37 -2.11 -0.05 0.00 1.43 0.00 0.00 31.44 31.08 1wb1 n GLU 345 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1wb1 s GLU 346 N -3.14 0.39 0.15 3.44 2.02 -1.26 -4.93 118.70 115.38 1wb1 s GLU 346 Ca 0.54 0.10 -0.26 0.00 0.02 0.00 0.00 54.97 55.37 1wb1 s GLU 346 Cb 0.45 0.19 -0.08 0.00 0.10 0.00 0.00 34.13 34.79 1wb1 s GLU 346 CO 0.08 -0.12 0.80 0.15 0.02 0.00 0.00 175.26 176.19 1wb1 s LYS 347 N -1.04 4.60 -0.05 1.61 -0.14 -1.24 -4.46 119.74 119.01 1wb1 s LYS 347 Ca 0.02 1.19 -0.06 0.00 -1.36 0.00 0.00 55.97 55.77 1wb1 s LYS 347 Cb -0.01 -3.28 0.01 0.00 -1.68 0.00 0.00 37.83 32.87 1wb1 s LYS 347 CO -0.02 0.51 0.16 0.08 -0.76 0.00 0.00 175.35 175.32 1wb1 s VAL 348 N -0.95 0.02 0.63 3.17 1.01 -0.68 -4.86 120.40 118.74 1wb1 s VAL 348 Ca 0.37 -0.14 -0.17 0.00 0.00 0.00 0.00 61.98 62.04 1wb1 s VAL 348 Cb -0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 36.38 35.86 1wb1 s VAL 348 CO 0.27 -0.08 1.19 -0.76 0.00 0.00 0.00 175.10 175.72 1wb1 s LEU 349 N -0.21 3.55 0.00 3.92 2.01 -1.26 -0.62 118.68 126.07 1wb1 s LEU 349 Ca -0.03 2.31 0.00 0.00 0.01 0.00 0.00 54.13 56.42 1wb1 s LEU 349 Cb -0.02 -4.59 0.00 0.00 0.01 0.00 0.00 46.19 41.59 1wb1 s LEU 349 CO 0.00 -1.73 0.00 0.00 1.01 0.00 0.00 176.35 175.64 1wb1 n ALA 350 N -1.95 0.00 -2.26 4.21 0.00 -1.26 -4.82 120.51 114.43 1wb1 n ALA 350 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1wb1 n ALA 350 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1wb1 n ALA 350 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1wb1 n GLU 351 N -0.07 2.49 -4.10 0.00 2.13 -1.26 -1.81 120.64 118.03 1wb1 n GLU 351 Ca 0.00 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.55 1wb1 n GLU 351 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 1wb1 n GLU 351 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1wb1 s VAL 352 N 1.74 4.36 -0.37 6.31 1.01 -1.26 -4.44 120.40 127.75 1wb1 s VAL 352 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1wb1 s VAL 352 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1wb1 s VAL 352 CO 0.00 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.66 1wb1 n GLY 353 N -0.12 0.58 3.36 4.51 0.00 -0.64 -5.00 105.19 107.87 1wb1 n GLY 353 Ca -0.09 -0.88 -0.45 0.00 0.00 0.00 0.00 46.02 44.60 1wb1 n GLY 353 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wb1 s ASP 354 N -2.94 6.17 0.17 1.61 1.01 -1.26 -4.82 116.67 116.61 1wb1 s ASP 354 Ca 0.00 -1.52 -0.33 0.00 0.71 0.00 0.00 52.55 51.41 1wb1 s ASP 354 Cb 0.00 -2.20 -0.15 0.00 1.01 0.00 0.00 42.92 41.58 1wb1 s ASP 354 CO 0.00 -0.76 1.40 0.54 0.21 0.00 0.00 175.17 176.55 1wb1 n ARG 355 N 5.30 1.72 -3.97 8.23 1.74 -1.26 -2.35 116.66 126.07 1wb1 n ARG 355 Ca -0.13 0.62 -0.22 0.00 -0.77 0.00 0.00 57.85 57.35 1wb1 n ARG 355 Cb 0.42 -2.27 -0.17 0.00 -1.02 0.00 0.00 32.46 29.42 1wb1 n ARG 355 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1wb1 s VAL 356 N 0.30 0.54 0.28 1.55 1.01 -1.08 -4.76 120.40 118.25 1wb1 s VAL 356 Ca 0.75 -0.05 -0.19 0.00 0.00 0.00 0.00 61.98 62.49 1wb1 s VAL 356 Cb -0.76 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.91 1wb1 s VAL 356 CO 0.46 0.26 0.77 -0.22 0.00 0.00 0.00 175.10 176.38 1wb1 s LEU 357 N 1.46 4.23 -0.19 3.92 2.96 -1.24 0.17 118.68 129.99 1wb1 s LEU 357 Ca -0.02 1.45 0.01 0.00 -0.22 0.00 0.00 54.13 55.35 1wb1 s LEU 357 Cb -0.13 -3.86 0.04 0.00 0.50 0.00 0.00 46.19 42.74 1wb1 s LEU 357 CO -0.03 -0.08 -0.12 -0.51 -1.32 0.00 0.00 176.35 174.29 1wb1 s ILE 358 N -1.72 1.70 0.26 6.68 2.07 -0.90 -1.32 121.20 127.97 1wb1 s ILE 358 Ca 0.49 -0.96 0.03 0.00 -1.41 0.00 0.00 60.65 58.80 1wb1 s ILE 358 Cb -0.14 -1.72 0.03 0.00 0.13 0.00 0.00 42.46 40.76 1wb1 s ILE 358 CO 0.20 0.25 0.28 0.35 -1.91 0.00 0.00 174.94 174.11 1wb1 n THR 359 N 4.68 0.00 -2.75 4.00 -2.24 -0.50 -3.24 114.28 114.23 1wb1 n THR 359 Ca -0.16 -0.95 -0.09 0.00 -2.27 0.00 0.00 64.05 60.58 1wb1 n THR 359 Cb 0.47 -0.54 0.06 0.00 -2.10 0.00 0.00 70.33 68.22 1wb1 n THR 359 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1wb1 n ARG 360 N -1.35 1.13 0.28 -0.78 3.00 -1.26 -3.03 116.66 114.65 1wb1 n ARG 360 Ca 0.03 -2.63 0.16 0.00 -0.00 0.00 0.00 57.85 55.41 1wb1 n ARG 360 Cb 0.28 -0.86 0.84 0.00 0.00 0.00 0.00 32.46 32.72 1wb1 n ARG 360 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.63 179.00 1wb1 h LEU 361 N 2.65 0.00 -1.98 6.15 -0.00 -1.94 -2.46 115.31 117.73 1wb1 h LEU 361 Ca -0.14 0.00 0.05 0.00 -0.00 0.00 0.00 57.88 57.79 1wb1 h LEU 361 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 1wb1 h LEU 361 CO 0.26 0.06 0.38 -2.24 -0.00 0.00 0.00 178.44 176.91 1wb1 h ASP 362 N 0.00 0.00 -3.60 0.17 2.03 -1.99 -3.41 116.42 109.62 1wb1 h ASP 362 Ca -0.00 0.00 -0.45 0.00 -0.73 0.00 0.00 57.03 55.85 1wb1 h ASP 362 Cb 0.29 0.00 0.13 0.00 -0.83 0.00 0.00 39.33 38.92 1wb1 h ASP 362 CO 0.01 0.00 0.33 -0.76 -1.03 0.00 0.00 179.24 177.79 1wb1 s LEU 363 N -6.47 2.77 0.83 0.15 1.43 -0.93 -5.03 118.68 111.43 1wb1 s LEU 363 Ca -0.04 0.17 -0.11 0.00 -1.03 0.00 0.00 54.13 53.12 1wb1 s LEU 363 Cb 0.11 -2.36 0.09 0.00 0.03 0.00 0.00 46.19 44.07 1wb1 s LEU 363 CO 0.39 -2.38 1.13 -2.16 0.23 0.00 0.00 176.35 173.56 1wb1 s PRO 364 N -5.64 1.69 0.28 1.29 0.04 -1.26 -4.87 135.00 126.53 1wb1 s PRO 364 Ca 0.70 1.43 0.25 0.00 0.04 0.00 0.00 61.00 63.42 1wb1 s PRO 364 Cb -0.05 -1.81 0.92 0.00 0.04 0.00 0.00 34.50 33.59 1wb1 s PRO 364 CO 0.50 -2.11 1.76 -1.00 0.04 0.00 0.00 177.00 176.19 1wb1 h PRO 365 N -1.33 0.00 -0.53 0.56 0.13 -1.96 -3.31 132.00 125.56 1wb1 h PRO 365 Ca -0.44 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.73 1wb1 h PRO 365 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 1wb1 h PRO 365 CO 0.47 0.00 0.28 1.15 -0.23 0.00 0.00 178.00 179.67 1wb1 h THR 366 N 0.00 0.97 -2.28 1.56 2.02 -1.97 -3.43 112.91 109.79 1wb1 h THR 366 Ca 0.00 -0.19 -0.48 0.00 0.77 0.00 0.00 66.41 66.51 1wb1 h THR 366 Cb 0.55 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1wb1 h THR 366 CO 0.00 0.10 -0.44 -0.89 0.37 0.00 0.00 175.52 174.66 1wb1 s THR 367 N -6.13 5.25 0.29 3.16 2.01 -1.25 -4.69 115.64 114.28 1wb1 s THR 367 Ca -0.13 -0.93 -0.27 0.00 0.31 0.00 0.00 61.69 60.67 1wb1 s THR 367 Cb 0.14 -3.82 -0.15 0.00 0.01 0.00 0.00 72.50 68.68 1wb1 s THR 367 CO 0.74 -0.27 0.74 0.18 -0.69 0.00 0.00 174.62 175.32 1wb1 n LEU 368 N -1.20 0.38 -3.14 4.42 4.77 -1.26 -4.92 117.00 116.05 1wb1 n LEU 368 Ca -0.09 1.10 -0.19 0.00 -0.03 0.00 0.00 56.01 56.81 1wb1 n LEU 368 Cb 0.56 -1.14 -0.03 0.00 -2.33 0.00 0.00 43.42 40.48 1wb1 n LEU 368 CO 0.46 -2.26 -0.19 0.54 -1.33 0.00 0.00 177.39 174.61 1wb1 n ARG 369 N 0.79 0.89 -3.73 3.23 1.74 -1.26 -5.02 116.66 113.29 1wb1 n ARG 369 Ca 0.13 -3.15 -0.13 0.00 -0.77 0.00 0.00 57.85 53.92 1wb1 n ARG 369 Cb 0.31 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.16 1wb1 n ARG 369 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1wb1 s ILE 370 N -1.71 0.01 0.00 0.55 1.01 -1.26 -3.99 121.20 115.81 1wb1 s ILE 370 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.97 1wb1 s ILE 370 Cb 0.28 -0.58 0.00 0.00 0.01 0.00 0.00 42.46 42.18 1wb1 s ILE 370 CO -0.09 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.43 1wb1 n GLY 372 N 2.68 0.00 2.48 6.18 0.00 -1.20 -4.59 105.19 110.73 1wb1 n GLY 372 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1wb1 n GLY 372 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1wb1 n HIS 373 N 0.00 1.49 -0.25 1.61 -0.00 -1.22 -2.13 115.22 114.73 1wb1 n HIS 373 Ca 0.00 -3.85 -0.30 0.00 0.46 0.00 0.00 57.72 54.03 1wb1 n HIS 373 Cb 0.00 -0.33 0.29 0.00 -0.12 0.00 0.00 29.99 29.83 1wb1 n HIS 373 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1wb1 n GLY 374 N 1.72 -3.82 2.65 1.57 0.00 0.45 -3.11 105.19 104.66 1wb1 n GLY 374 Ca 0.25 -1.66 -0.02 0.00 0.00 0.00 0.00 46.02 44.59 1wb1 n GLY 374 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wb1 n LEU 375 N -5.64 -1.08 0.00 0.99 7.94 -1.25 -2.62 117.00 115.34 1wb1 n LEU 375 Ca 0.13 -1.64 0.00 0.00 -1.11 0.00 0.00 56.01 53.39 1wb1 n LEU 375 Cb 0.59 0.99 0.00 0.00 0.53 0.00 0.00 43.42 45.53 1wb1 n LEU 375 CO 0.40 1.50 0.00 -0.38 -1.11 0.00 0.00 177.39 177.80 1wb1 n ILE 376 N 0.42 0.00 -0.06 1.96 5.41 -0.99 -4.00 119.36 122.10 1wb1 n ILE 376 Ca -0.09 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.57 1wb1 n ILE 376 Cb 0.76 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.65 1wb1 n ILE 376 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1wb1 n GLU 377 N 0.00 0.39 -3.86 0.38 -0.58 -1.16 -1.62 120.64 114.20 1wb1 n GLU 377 Ca 0.00 0.16 -0.09 0.00 -0.42 0.00 0.00 57.16 56.81 1wb1 n GLU 377 Cb 0.00 -1.19 -0.04 0.00 -0.57 0.00 0.00 31.44 29.64 1wb1 n GLU 377 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1wb1 s GLU 378 N -2.61 1.46 -0.38 3.49 2.02 -0.89 -4.72 118.70 117.06 1wb1 s GLU 378 Ca -0.22 -1.04 -0.05 0.00 0.02 0.00 0.00 54.97 53.67 1wb1 s GLU 378 Cb 0.04 0.50 0.08 0.00 0.10 0.00 0.00 34.13 34.85 1wb1 s GLU 378 CO 0.32 -0.61 0.16 -0.06 0.02 0.00 0.00 175.26 175.09 1wb1 s PHE 379 N -3.94 3.39 -0.23 1.61 0.40 -1.26 -2.47 117.98 115.49 1wb1 s PHE 379 Ca 0.15 -1.86 -0.11 0.00 -0.60 0.00 0.00 56.93 54.51 1wb1 s PHE 379 Cb -0.01 -2.76 0.08 0.00 0.51 0.00 0.00 43.02 40.84 1wb1 s PHE 379 CO 0.02 -0.86 0.52 0.15 0.70 0.00 0.00 175.22 175.76 1wb1 s LYS 380 N 1.30 0.49 0.71 0.44 1.02 -1.21 -4.99 119.74 117.49 1wb1 s LYS 380 Ca 0.02 1.07 -0.14 0.00 0.02 0.00 0.00 55.97 56.94 1wb1 s LYS 380 Cb -0.22 0.24 0.03 0.00 -0.52 0.00 0.00 37.83 37.37 1wb1 s LYS 380 CO -0.00 -0.19 1.15 -1.25 -0.92 0.00 0.00 175.35 174.14 1wb1 s PRO 381 N 1.99 2.38 0.13 -1.68 0.04 -1.26 -4.41 135.00 132.18 1wb1 s PRO 381 Ca -0.07 1.52 -0.14 0.00 0.04 0.00 0.00 61.00 62.35 1wb1 s PRO 381 Cb -0.09 -1.89 0.08 0.00 0.04 0.00 0.00 34.50 32.64 1wb1 s PRO 381 CO -0.16 -1.60 0.95 1.51 0.04 0.00 0.00 177.00 177.74 1wb1 n ILE 382 N -2.75 -0.36 0.29 0.56 3.06 -1.26 0.26 119.36 119.16 1wb1 n ILE 382 Ca 0.11 1.45 0.17 0.00 -2.50 0.00 0.00 62.75 61.99 1wb1 n ILE 382 Cb 0.51 -1.87 0.70 0.00 0.54 0.00 0.00 39.64 39.52 1wb1 n ILE 382 CO 0.00 0.00 0.00 0.07 -2.50 0.00 0.00 176.55 174.12 1wb1 h LYS 383 N 0.00 0.00 0.00 9.51 2.10 -2.03 -3.14 116.57 123.01 1wb1 h LYS 383 Ca 0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.82 1wb1 h LYS 383 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 1wb1 h LYS 383 CO -0.60 0.00 0.19 -0.44 -2.00 0.00 0.00 179.45 176.60 1wb1 h ASP 384 N 0.00 0.00 -3.75 7.07 5.19 -0.52 -3.41 116.42 121.00 1wb1 h ASP 384 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 1wb1 h ASP 384 Cb 0.49 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 39.81 1wb1 h ASP 384 CO 0.00 0.00 -0.79 -1.48 -3.12 0.00 0.00 179.24 173.85 1wb1 s LEU 385 N -4.63 2.40 -1.31 1.55 2.34 -1.19 -5.02 118.68 112.82 1wb1 s LEU 385 Ca -0.02 -0.81 -0.14 0.00 0.06 0.00 0.00 54.13 53.22 1wb1 s LEU 385 Cb 0.06 -0.82 0.11 0.00 -0.56 0.00 0.00 46.19 44.99 1wb1 s LEU 385 CO 0.19 -0.02 1.82 -0.46 -1.06 0.00 0.00 176.35 176.82 1wb1 n ASN 386 N 0.51 4.78 -4.42 1.48 0.23 -1.26 -4.90 115.26 111.68 1wb1 n ASN 386 Ca -0.15 -2.96 -0.31 0.00 -0.53 0.00 0.00 54.58 50.63 1wb1 n ASN 386 Cb 0.56 -1.62 -0.06 0.00 -2.08 0.00 0.00 39.78 36.59 1wb1 n ASN 386 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1wb1 n ILE 387 N 4.87 1.96 -3.94 1.53 -6.64 -1.26 -3.60 119.36 112.29 1wb1 n ILE 387 Ca 0.45 -1.99 -0.35 0.00 -1.77 0.00 0.00 62.75 59.08 1wb1 n ILE 387 Cb 0.41 -2.20 -0.11 0.00 -1.44 0.00 0.00 39.64 36.30 1wb1 n ILE 387 CO 0.00 0.00 0.00 -0.54 -1.77 0.00 0.00 176.55 174.24 1wb1 s LYS 388 N 6.15 3.79 0.82 6.28 1.02 0.21 0.23 119.74 138.23 1wb1 s LYS 388 Ca 0.66 -0.43 -0.13 0.00 0.02 0.00 0.00 55.97 56.10 1wb1 s LYS 388 Cb 0.02 -3.24 0.09 0.00 -0.52 0.00 0.00 37.83 34.18 1wb1 s LYS 388 CO 0.13 0.04 1.18 0.21 -0.92 0.00 0.00 175.35 176.00 1wb1 s LYS 389 N 0.98 1.62 -0.98 1.68 2.47 0.11 -4.01 119.74 121.61 1wb1 s LYS 389 Ca 0.04 1.66 -0.02 0.00 -1.56 0.00 0.00 55.97 56.09 1wb1 s LYS 389 Cb -0.14 -1.78 0.30 0.00 -1.46 0.00 0.00 37.83 34.75 1wb1 s LYS 389 CO 0.03 -2.20 1.40 0.39 0.16 0.00 0.00 175.35 175.12 1wb1 n GLU 390 N -3.44 4.27 -2.58 4.03 -0.58 -1.26 -2.72 120.64 118.36 1wb1 n GLU 390 Ca 0.13 -4.61 -0.43 0.00 -0.42 0.00 0.00 57.16 51.83 1wb1 n GLU 390 Cb 0.51 -2.45 -0.02 0.00 -0.57 0.00 0.00 31.44 28.91 1wb1 n GLU 390 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wb1 s VAL 391 N -3.06 4.45 -0.17 2.62 1.01 -1.11 -4.94 120.40 119.20 1wb1 s VAL 391 Ca 0.34 1.70 0.01 0.00 0.00 0.00 0.00 61.98 64.03 1wb1 s VAL 391 Cb 0.10 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 32.20 1wb1 s VAL 391 CO 0.04 -0.37 -0.20 -0.76 0.00 0.00 0.00 175.10 173.82 1wb1 s LEU 392 N 3.66 2.19 -0.13 3.92 1.02 -1.26 0.14 118.68 128.21 1wb1 s LEU 392 Ca 0.48 -0.61 -0.07 0.00 0.02 0.00 0.00 54.13 53.95 1wb1 s LEU 392 Cb -0.15 -1.49 -0.04 0.00 0.02 0.00 0.00 46.19 44.53 1wb1 s LEU 392 CO 0.15 0.03 0.12 -0.60 0.02 0.00 0.00 176.35 176.07 1wb1 s ARG 393 N 1.10 3.54 0.10 1.70 6.06 0.52 -4.98 118.95 126.98 1wb1 s ARG 393 Ca 0.00 -0.18 0.08 0.00 -2.50 0.00 0.00 55.73 53.12 1wb1 s ARG 393 Cb -0.14 -3.19 -0.03 0.00 0.06 0.00 0.00 34.95 31.65 1wb1 s ARG 393 CO -0.08 0.67 -0.20 -2.00 -2.50 0.00 0.00 175.30 171.20 1wb1 s GLU 394 N -0.73 1.07 -0.02 5.12 2.56 -1.26 -2.04 118.70 123.40 1wb1 s GLU 394 Ca 0.13 -1.12 -0.29 0.00 0.00 0.00 0.00 54.97 53.69 1wb1 s GLU 394 Cb -0.12 -1.28 0.10 0.00 2.00 0.00 0.00 34.13 34.84 1wb1 s GLU 394 CO 0.03 0.30 0.89 0.20 -0.56 0.00 0.00 175.26 176.11 1wb1 s GLY 395 N -1.87 -0.45 0.49 -1.50 0.00 -1.24 -4.37 107.32 98.39 1wb1 s GLY 395 Ca 0.05 1.11 0.02 0.00 0.00 0.00 0.00 44.72 45.90 1wb1 s GLY 395 CO 0.04 0.41 0.70 0.54 0.00 0.00 0.00 173.10 174.79 1wb1 s LYS 396 N -2.89 2.77 -0.36 2.90 1.02 -1.24 -1.02 119.74 120.93 1wb1 s LYS 396 Ca 0.04 -0.75 -0.06 0.00 0.02 0.00 0.00 55.97 55.22 1wb1 s LYS 396 Cb -0.01 -2.56 0.06 0.00 -0.52 0.00 0.00 37.83 34.80 1wb1 s LYS 396 CO -0.08 -0.48 0.13 0.08 -0.92 0.00 0.00 175.35 174.08 1wb1 s VAL 397 N -2.62 3.70 -0.02 3.17 1.01 -1.19 0.07 120.40 124.52 1wb1 s VAL 397 Ca 0.53 -1.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.03 1wb1 s VAL 397 Cb -0.10 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1wb1 s VAL 397 CO 0.37 -0.29 0.45 -0.54 0.00 0.00 0.00 175.10 175.09 1wb1 s LYS 398 N 1.36 4.08 -0.11 2.72 1.02 -0.78 -3.70 119.74 124.33 1wb1 s LYS 398 Ca -0.00 0.46 0.00 0.00 0.02 0.00 0.00 55.97 56.45 1wb1 s LYS 398 Cb -0.21 -3.28 0.02 0.00 -0.52 0.00 0.00 37.83 33.84 1wb1 s LYS 398 CO 0.01 0.53 -0.11 0.42 -0.92 0.00 0.00 175.35 175.29 1wb1 s ILE 399 N -0.60 1.22 -0.56 2.17 1.01 -1.26 -0.95 121.20 122.23 1wb1 s ILE 399 Ca 0.25 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 1wb1 s ILE 399 Cb -0.17 -1.17 0.15 0.00 0.01 0.00 0.00 42.46 41.28 1wb1 s ILE 399 CO 0.13 0.39 0.38 -0.62 0.00 0.00 0.00 174.94 175.22 1wb1 s ASP 400 N 1.38 5.34 -0.01 3.58 -1.08 -1.25 -4.91 116.67 119.71 1wb1 s ASP 400 Ca -0.00 -2.53 -0.01 0.00 -0.52 0.00 0.00 52.55 49.48 1wb1 s ASP 400 Cb -0.13 -1.87 0.00 0.00 -1.46 0.00 0.00 42.92 39.45 1wb1 s ASP 400 CO -0.06 -0.45 0.02 2.29 0.52 0.00 0.00 175.17 177.49 1wb1 n LYS 401 N 3.94 -0.05 -1.04 4.34 2.85 -1.26 -3.29 118.16 123.64 1wb1 n LYS 401 Ca 0.04 0.04 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 1wb1 n LYS 401 Cb 0.39 -0.06 0.00 0.00 -0.65 0.00 0.00 35.03 34.72 1wb1 n LYS 401 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1wb1 n GLY 402 N 0.02 0.46 0.00 2.58 0.00 -1.26 -5.10 105.19 101.89 1wb1 n GLY 402 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1wb1 n GLY 402 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wb1 n ARG 403 N -0.86 0.00 -3.75 1.61 0.63 -1.21 -5.17 116.66 107.91 1wb1 n ARG 403 Ca 0.00 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.79 1wb1 n ARG 403 Cb 0.35 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 33.11 1wb1 n ARG 403 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1wb1 s THR 404 N -2.00 -0.05 0.02 5.15 -4.23 -1.26 -3.79 115.64 109.48 1wb1 s THR 404 Ca 0.00 0.19 0.02 0.00 -1.18 0.00 0.00 61.69 60.72 1wb1 s THR 404 Cb 0.00 -0.19 -0.02 0.00 1.34 0.00 0.00 72.50 73.63 1wb1 s THR 404 CO 0.00 0.08 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.39 1wb1 s VAL 405 N 1.14 0.56 -0.50 2.29 1.01 -0.12 -4.57 120.40 120.21 1wb1 s VAL 405 Ca -0.09 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.09 1wb1 s VAL 405 Cb -0.12 -0.55 0.13 0.00 0.00 0.00 0.00 36.38 35.83 1wb1 s VAL 405 CO -0.05 -0.12 0.38 -0.63 0.00 0.00 0.00 175.10 174.68 1wb1 s ILE 406 N -0.77 4.36 0.97 2.22 -1.09 0.24 -1.86 121.20 125.26 1wb1 s ILE 406 Ca -0.03 -1.81 -0.16 0.00 -2.23 0.00 0.00 60.65 56.41 1wb1 s ILE 406 Cb -0.06 -3.85 0.20 0.00 -1.58 0.00 0.00 42.46 37.17 1wb1 s ILE 406 CO 0.00 -0.80 1.32 -0.62 -1.23 0.00 0.00 174.94 173.61 1wb1 s ASP 407 N 2.71 3.02 0.00 3.58 3.68 0.11 -2.44 116.67 127.34 1wb1 s ASP 407 Ca 0.06 0.27 0.00 0.00 2.13 0.00 0.00 52.55 55.01 1wb1 s ASP 407 Cb -0.26 -0.31 0.00 0.00 -1.45 0.00 0.00 42.92 40.90 1wb1 s ASP 407 CO -0.01 -2.79 0.00 0.61 0.13 0.00 0.00 175.17 173.11 1wb1 n GLY 408 N -3.69 -0.12 0.07 2.66 0.00 -1.26 -3.62 105.19 99.24 1wb1 n GLY 408 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1wb1 n GLY 408 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wb1 n LEU 409 N -1.16 0.38 -4.13 0.99 7.94 -1.26 -4.17 117.00 115.59 1wb1 n LEU 409 Ca 0.00 0.17 -0.10 0.00 -1.11 0.00 0.00 56.01 54.97 1wb1 n LEU 409 Cb 0.12 0.17 -0.10 0.00 0.53 0.00 0.00 43.42 44.14 1wb1 n LEU 409 CO 0.00 0.20 -0.26 0.00 -1.11 0.00 0.00 177.39 176.22 1wb1 s ALA 410 N -2.97 0.79 -0.32 1.96 0.00 -1.26 -4.95 121.76 115.01 1wb1 s ALA 410 Ca -0.06 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.50 1wb1 s ALA 410 Cb 0.09 0.91 0.02 0.00 0.00 0.00 0.00 23.12 24.14 1wb1 s ALA 410 CO 0.84 -0.51 0.54 0.00 0.00 0.00 0.00 175.76 176.63 1wb1 n GLN 411 N -0.12 -0.03 -3.73 0.00 0.00 -1.26 -4.64 117.38 107.60 1wb1 n GLN 411 Ca -0.05 -0.60 -0.10 0.00 0.00 0.00 0.00 57.00 56.25 1wb1 n GLN 411 Cb 0.64 -1.01 -0.05 0.00 0.00 0.00 0.00 30.24 29.82 1wb1 n GLN 411 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1wb1 s SER 412 N -0.31 -0.18 0.28 2.61 1.04 -1.26 -4.42 113.70 111.46 1wb1 s SER 412 Ca 0.03 -0.47 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 1wb1 s SER 412 Cb 0.02 0.50 0.39 0.00 0.10 0.00 0.00 66.02 67.03 1wb1 s SER 412 CO 0.04 -0.92 1.90 0.50 0.98 0.00 0.00 173.24 175.74 1wb1 h LYS 413 N 2.35 1.03 0.44 4.02 3.64 -1.88 0.55 116.57 126.72 1wb1 h LYS 413 Ca -0.32 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 58.92 1wb1 h LYS 413 Cb 1.25 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1wb1 h LYS 413 CO 0.44 0.77 -0.21 0.28 -2.27 0.00 0.00 179.45 178.46 1wb1 h VAL 414 N 1.03 0.49 0.00 2.00 2.07 -1.99 -1.96 116.25 117.90 1wb1 h VAL 414 Ca 0.26 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1wb1 h VAL 414 Cb 0.05 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1wb1 h VAL 414 CO -0.04 0.07 -0.11 0.00 0.02 0.00 0.00 177.57 177.51 1wb1 h ALA 415 N -0.47 1.17 0.63 1.67 0.00 -1.95 -3.05 119.26 117.27 1wb1 h ALA 415 Ca -0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1wb1 h ALA 415 Cb 0.56 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1wb1 h ALA 415 CO 0.10 0.13 -0.30 0.00 0.00 0.00 0.00 179.25 179.18 1wb1 h ALA 416 N 1.89 -0.85 -1.22 0.00 0.00 -0.71 -3.13 119.26 115.25 1wb1 h ALA 416 Ca -0.00 -0.21 0.35 0.00 0.00 0.00 0.00 54.91 55.05 1wb1 h ALA 416 Cb 0.38 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 18.42 1wb1 h ALA 416 CO 0.01 -0.86 0.82 0.93 0.00 0.00 0.00 179.25 180.16 1wb1 h GLU 417 N -1.10 0.17 0.34 0.00 5.08 -1.24 -1.49 114.58 116.34 1wb1 h GLU 417 Ca -0.09 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1wb1 h GLU 417 Cb 0.70 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1wb1 h GLU 417 CO 0.14 0.11 -0.16 0.87 -1.00 0.00 0.00 179.01 178.97 1wb1 h LYS 418 N 0.18 -0.44 -4.76 2.33 1.57 -1.59 -3.33 116.57 110.53 1wb1 h LYS 418 Ca 0.67 0.03 -0.59 0.00 -1.87 0.00 0.00 60.65 58.89 1wb1 h LYS 418 Cb 2.15 0.10 0.08 0.00 0.08 0.00 0.00 32.23 34.65 1wb1 h LYS 418 CO -0.23 -0.28 1.79 1.28 -0.57 0.00 0.00 179.45 181.44 1wb1 n LEU 419 N -5.28 2.74 -4.02 2.94 4.32 -0.56 -4.84 117.00 112.31 1wb1 n LEU 419 Ca -0.10 -2.36 -0.27 0.00 -0.02 0.00 0.00 56.01 53.26 1wb1 n LEU 419 Cb 0.21 -0.94 -0.17 0.00 -1.62 0.00 0.00 43.42 40.90 1wb1 n LEU 419 CO 0.35 -1.20 -0.47 -0.63 -1.22 0.00 0.00 177.39 174.22 1wb1 s ILE 420 N 6.60 1.28 0.00 -0.08 1.01 -1.25 -4.77 121.20 123.98 1wb1 s ILE 420 Ca 0.63 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.77 1wb1 s ILE 420 Cb 0.13 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.41 1wb1 s ILE 420 CO 0.21 0.40 0.00 0.61 0.00 0.00 0.00 174.94 176.16 1wb1 n GLY 421 N 4.20 1.34 3.96 6.18 0.00 0.30 -5.00 105.19 116.16 1wb1 n GLY 421 Ca -0.19 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 1wb1 n GLY 421 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wb1 s GLU 422 N -1.42 3.46 0.31 1.61 8.01 -1.26 -4.85 118.70 124.55 1wb1 s GLU 422 Ca 0.00 -0.57 0.03 0.00 0.01 0.00 0.00 54.97 54.44 1wb1 s GLU 422 Cb 0.00 -2.80 0.79 0.00 -4.31 0.00 0.00 34.13 27.80 1wb1 s GLU 422 CO 0.00 0.33 1.52 -0.85 0.01 0.00 0.00 175.26 176.27 1wb1 n GLU 423 N -1.49 -0.08 -2.70 1.61 0.00 -1.26 -3.40 120.64 113.33 1wb1 n GLU 423 Ca -0.07 1.44 -0.21 0.00 0.00 0.00 0.00 57.16 58.32 1wb1 n GLU 423 Cb 0.56 -2.32 0.02 0.00 0.00 0.00 0.00 31.44 29.70 1wb1 n GLU 423 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1wb1 n ILE 424 N -5.43 -2.18 -4.35 3.84 2.08 -1.22 -2.03 119.36 110.08 1wb1 n ILE 424 Ca 0.24 0.03 -0.35 0.00 0.56 0.00 0.00 62.75 63.23 1wb1 n ILE 424 Cb 0.79 -1.98 -0.09 0.00 -0.75 0.00 0.00 39.64 37.61 1wb1 n ILE 424 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1wb1 s SER 425 N -1.31 5.28 0.15 4.38 1.04 -1.09 -0.65 113.70 121.50 1wb1 s SER 425 Ca 0.17 0.15 -0.07 0.00 0.48 0.00 0.00 55.95 56.68 1wb1 s SER 425 Cb -0.02 -1.49 -0.06 0.00 0.10 0.00 0.00 66.02 64.55 1wb1 s SER 425 CO 0.52 0.37 0.43 -0.63 0.98 0.00 0.00 173.24 174.91 1wb1 s ILE 426 N -0.91 5.09 0.18 -1.02 1.01 -0.74 -1.17 121.20 123.64 1wb1 s ILE 426 Ca 0.14 0.24 -0.13 0.00 0.00 0.00 0.00 60.65 60.90 1wb1 s ILE 426 Cb -0.11 -3.63 0.09 0.00 0.01 0.00 0.00 42.46 38.82 1wb1 s ILE 426 CO 0.03 0.06 1.76 -0.08 0.00 0.00 0.00 174.94 176.72 1wb1 h GLU 427 N 2.94 0.40 0.00 2.79 4.57 -1.90 -1.31 114.58 122.06 1wb1 h GLU 427 Ca -0.47 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1wb1 h GLU 427 Cb 1.17 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1wb1 h GLU 427 CO 0.70 0.26 0.00 0.41 -1.18 0.00 0.00 179.01 179.21 1wb1 n GLY 428 N -1.26 -0.52 0.29 1.92 0.00 -1.26 -3.66 105.19 100.70 1wb1 n GLY 428 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 1wb1 n GLY 428 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wb1 n LYS 429 N 0.00 1.26 -0.32 1.61 3.00 -1.26 -4.80 118.16 117.64 1wb1 n LYS 429 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 1wb1 n LYS 429 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 35.03 33.82 1wb1 n LYS 429 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1wb1 n ASP 430 N -0.17 0.00 -2.09 3.14 -0.08 -0.50 -4.83 116.55 112.02 1wb1 n ASP 430 Ca 0.03 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.03 1wb1 n ASP 430 Cb 0.15 -1.54 -0.04 0.00 2.34 0.00 0.00 41.12 42.03 1wb1 n ASP 430 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1wb1 n ILE 431 N -2.00 0.00 -1.44 5.18 -5.35 -1.26 -3.81 119.36 110.69 1wb1 n ILE 431 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 1wb1 n ILE 431 Cb 0.00 -0.01 0.09 0.00 -1.74 0.00 0.00 39.64 37.98 1wb1 n ILE 431 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1wb1 s VAL 432 N 0.07 3.33 0.04 7.28 1.01 -1.26 -1.80 120.40 129.06 1wb1 s VAL 432 Ca 0.43 0.43 -0.25 0.00 0.00 0.00 0.00 61.98 62.59 1wb1 s VAL 432 Cb -0.59 -3.08 0.06 0.00 0.00 0.00 0.00 36.38 32.77 1wb1 s VAL 432 CO 0.27 -0.56 0.58 -0.83 0.00 0.00 0.00 175.10 174.55 1wb1 s GLY 433 N -3.69 -0.50 -0.40 4.51 0.00 0.18 -1.77 107.32 105.65 1wb1 s GLY 433 Ca 0.60 0.79 0.02 0.00 0.00 0.00 0.00 44.72 46.14 1wb1 s GLY 433 CO 0.55 0.47 0.16 0.54 0.00 0.00 0.00 173.10 174.83 1wb1 s LYS 434 N -2.26 1.29 -0.10 2.90 1.02 0.21 -3.61 119.74 119.19 1wb1 s LYS 434 Ca -0.06 -1.83 -0.32 0.00 0.02 0.00 0.00 55.97 53.78 1wb1 s LYS 434 Cb -0.01 -2.60 -0.09 0.00 -0.52 0.00 0.00 37.83 34.61 1wb1 s LYS 434 CO 0.00 -1.06 2.02 1.51 -0.92 0.00 0.00 175.35 176.90 1wb1 n ILE 435 N 3.97 0.56 -4.10 2.17 3.06 -1.22 -2.89 119.36 120.92 1wb1 n ILE 435 Ca 0.04 -0.21 -0.08 0.00 -2.50 0.00 0.00 62.75 60.01 1wb1 n ILE 435 Cb 0.38 -2.16 -0.10 0.00 0.54 0.00 0.00 39.64 38.30 1wb1 n ILE 435 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 1wb1 s LYS 436 N 4.90 0.63 1.26 9.51 1.02 -1.03 0.11 119.74 136.14 1wb1 s LYS 436 Ca 0.95 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 55.72 1wb1 s LYS 436 Cb -0.54 0.14 0.00 0.00 -0.52 0.00 0.00 37.83 36.90 1wb1 s LYS 436 CO 0.45 -0.09 0.00 0.41 -0.92 0.00 0.00 175.35 175.20 1wb1 n GLY 437 N 0.15 -1.91 3.65 -3.33 0.00 -1.26 -3.07 105.19 99.42 1wb1 n GLY 437 Ca -0.14 -1.38 -0.01 0.00 0.00 0.00 0.00 46.02 44.49 1wb1 n GLY 437 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1wb1 s THR 438 N 0.00 0.00 -0.52 2.61 -1.32 -1.26 -4.32 115.64 110.83 1wb1 s THR 438 Ca 0.00 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.36 1wb1 s THR 438 Cb 0.00 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 70.12 1wb1 s THR 438 CO 0.00 0.00 0.43 -0.36 -2.21 0.00 0.00 174.62 172.48 1wb1 s PHE 439 N 0.25 3.37 0.97 9.09 0.40 0.69 -4.90 117.98 127.85 1wb1 s PHE 439 Ca 0.04 -1.65 -0.18 0.00 -0.60 0.00 0.00 56.93 54.54 1wb1 s PHE 439 Cb -0.04 -3.64 -0.15 0.00 0.51 0.00 0.00 43.02 39.70 1wb1 s PHE 439 CO -0.15 -1.00 -0.90 0.41 0.70 0.00 0.00 175.22 174.28 1wb1 n GLY 440 N 4.99 -4.30 3.76 4.36 0.00 -1.26 -3.66 105.19 109.07 1wb1 n GLY 440 Ca -0.09 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1wb1 n GLY 440 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wb1 n THR 441 N -2.58 0.00 -2.06 2.61 -1.04 -1.26 -4.69 114.28 105.27 1wb1 n THR 441 Ca -0.02 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.97 1wb1 n THR 441 Cb 0.57 -0.15 -0.02 0.00 -1.82 0.00 0.00 70.33 68.91 1wb1 n THR 441 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1wb1 n LYS 442 N -2.00 0.00 -0.68 -2.82 5.02 -1.24 -4.81 118.16 111.63 1wb1 n LYS 442 Ca 0.00 -0.74 0.00 0.00 -2.02 0.00 0.00 58.31 55.55 1wb1 n LYS 442 Cb 0.00 0.13 0.00 0.00 -0.02 0.00 0.00 35.03 35.14 1wb1 n LYS 442 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wb1 n GLY 443 N 0.06 0.00 3.55 0.72 0.00 -1.21 -4.52 105.19 103.80 1wb1 n GLY 443 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1wb1 n GLY 443 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wb1 n LEU 444 N 0.00 2.17 -4.72 0.99 4.77 -1.24 -4.18 117.00 114.79 1wb1 n LEU 444 Ca 0.00 -0.62 -0.40 0.00 -0.03 0.00 0.00 56.01 54.96 1wb1 n LEU 444 Cb 0.30 -1.57 -0.05 0.00 -2.33 0.00 0.00 43.42 39.78 1wb1 n LEU 444 CO 0.00 -1.69 0.39 -0.76 -1.33 0.00 0.00 177.39 174.00 1wb1 s LEU 445 N 12.46 4.31 0.38 2.23 1.43 -1.02 -0.22 118.68 138.24 1wb1 s LEU 445 Ca 0.99 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.27 1wb1 s LEU 445 Cb -0.21 -3.07 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 1wb1 s LEU 445 CO 0.25 -0.11 0.58 0.28 0.23 0.00 0.00 176.35 177.58 1wb1 s THR 446 N 0.80 4.69 0.00 5.49 -1.32 -1.25 0.80 115.64 124.85 1wb1 s THR 446 Ca 0.37 -0.51 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 1wb1 s THR 446 Cb -0.18 -3.71 0.00 0.00 -1.51 0.00 0.00 72.50 67.10 1wb1 s THR 446 CO 0.18 -0.46 0.00 0.00 -2.21 0.00 0.00 174.62 172.12 1wb1 n ALA 447 N -1.87 0.00 -3.46 11.08 0.00 -1.17 -2.48 120.51 122.61 1wb1 n ALA 447 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.41 1wb1 n ALA 447 Cb 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 1wb1 n ALA 447 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wb1 s GLU 448 N 1.11 0.53 0.56 0.00 2.02 -1.14 -4.63 118.70 117.14 1wb1 s GLU 448 Ca 0.00 1.18 0.08 0.00 0.02 0.00 0.00 54.97 56.25 1wb1 s GLU 448 Cb 0.00 0.60 0.07 0.00 0.10 0.00 0.00 34.13 34.89 1wb1 s GLU 448 CO 0.00 -0.38 0.65 -0.06 0.02 0.00 0.00 175.26 175.49 1wb1 s PHE 449 N 2.82 1.49 -0.34 1.61 0.08 -1.26 -0.62 117.98 121.76 1wb1 s PHE 449 Ca 0.05 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.33 1wb1 s PHE 449 Cb -0.13 -2.10 0.08 0.00 -0.57 0.00 0.00 43.02 40.30 1wb1 s PHE 449 CO -0.19 -0.91 0.08 -1.54 -0.10 0.00 0.00 175.22 172.56 1wb1 s SER 450 N -4.52 4.97 0.00 1.36 1.04 -0.73 -4.96 113.70 110.86 1wb1 s SER 450 Ca 0.52 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 55.23 1wb1 s SER 450 Cb -0.04 -1.73 0.00 0.00 0.10 0.00 0.00 66.02 64.35 1wb1 s SER 450 CO 0.32 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1wb1 n GLY 451 N 4.53 2.09 2.57 7.32 0.00 -1.26 -4.55 105.19 115.90 1wb1 n GLY 451 Ca -0.06 -2.01 -0.21 0.00 0.00 0.00 0.00 46.02 43.74 1wb1 n GLY 451 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wb1 n ASN 452 N 0.00 -1.32 -3.63 1.61 3.02 -1.26 -5.10 115.26 108.58 1wb1 n ASN 452 Ca 0.00 -1.07 -0.13 0.00 -0.03 0.00 0.00 54.58 53.35 1wb1 n ASN 452 Cb 0.00 -0.72 -0.07 0.00 -0.61 0.00 0.00 39.78 38.38 1wb1 n ASN 452 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wb1 s VAL 453 N -2.58 0.00 0.62 2.41 1.01 -1.26 -5.08 120.40 115.52 1wb1 s VAL 453 Ca 0.52 0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.54 1wb1 s VAL 453 Cb -0.04 -1.00 0.09 0.00 0.00 0.00 0.00 36.38 35.43 1wb1 s VAL 453 CO 0.39 0.00 0.86 -1.61 0.00 0.00 0.00 175.10 174.73 1wb1 s GLU 454 N 0.29 2.10 0.00 2.72 0.41 -1.26 -4.95 118.70 118.02 1wb1 s GLU 454 Ca 0.00 -1.35 0.02 0.00 -0.41 0.00 0.00 54.97 53.24 1wb1 s GLU 454 Cb -0.05 -2.52 0.14 0.00 -1.78 0.00 0.00 34.13 29.93 1wb1 s GLU 454 CO 0.00 -1.04 0.58 0.09 -0.49 0.00 0.00 175.26 174.40 1wb1 n ASN 455 N -2.46 0.00 -0.01 -0.19 3.02 -1.25 -3.64 115.26 110.73 1wb1 n ASN 455 Ca 0.14 -0.80 -0.03 0.00 -0.03 0.00 0.00 54.58 53.86 1wb1 n ASN 455 Cb 0.61 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.77 1wb1 n ASN 455 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1wb1 n ARG 456 N -0.59 0.08 0.00 3.52 5.12 -1.24 -4.35 116.66 119.20 1wb1 n ARG 456 Ca 0.02 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1wb1 n ARG 456 Cb 0.01 -0.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.68 1wb1 n ARG 456 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1wb1 n ASP 457 N -3.25 0.00 -4.71 0.55 9.92 -1.24 -3.76 116.55 114.06 1wb1 n ASP 457 Ca -0.06 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.78 1wb1 n ASP 457 Cb 0.46 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.91 1wb1 n ASP 457 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1wb1 s LYS 458 N 0.00 4.54 -0.37 -1.24 -0.14 -1.26 -3.17 119.74 118.10 1wb1 s LYS 458 Ca 0.00 1.42 -0.25 0.00 -1.36 0.00 0.00 55.97 55.78 1wb1 s LYS 458 Cb 0.00 -3.47 0.01 0.00 -1.68 0.00 0.00 37.83 32.69 1wb1 s LYS 458 CO 0.00 -0.09 0.91 0.08 -0.76 0.00 0.00 175.35 175.48 1wb1 s VAL 459 N 1.16 4.61 -0.52 3.17 1.01 -0.19 -3.14 120.40 126.50 1wb1 s VAL 459 Ca 0.52 1.16 -0.21 0.00 0.00 0.00 0.00 61.98 63.45 1wb1 s VAL 459 Cb -0.21 -4.31 0.05 0.00 0.00 0.00 0.00 36.38 31.91 1wb1 s VAL 459 CO 0.27 -0.52 0.72 -0.63 0.00 0.00 0.00 175.10 174.93 1wb1 s ILE 460 N 3.42 4.74 -0.38 2.22 1.01 -0.32 -3.64 121.20 128.25 1wb1 s ILE 460 Ca 0.37 -0.28 -0.07 0.00 0.00 0.00 0.00 60.65 60.67 1wb1 s ILE 460 Cb -0.12 -4.37 0.07 0.00 0.01 0.00 0.00 42.46 38.05 1wb1 s ILE 460 CO 0.18 -0.90 0.18 -0.22 0.00 0.00 0.00 174.94 174.19 1wb1 s LEU 461 N 3.00 4.81 -0.51 2.97 2.96 -0.86 -2.68 118.68 128.37 1wb1 s LEU 461 Ca 0.19 -1.46 -0.17 0.00 -0.22 0.00 0.00 54.13 52.48 1wb1 s LEU 461 Cb -0.17 -1.90 0.08 0.00 0.50 0.00 0.00 46.19 44.70 1wb1 s LEU 461 CO 0.14 -0.45 0.50 0.20 -1.32 0.00 0.00 176.35 175.41 1wb1 s ASN 462 N 1.78 6.18 0.44 3.68 0.02 -1.26 -0.36 114.94 125.42 1wb1 s ASN 462 Ca 0.02 -1.35 0.08 0.00 -1.02 0.00 0.00 52.86 50.59 1wb1 s ASN 462 Cb -0.22 -2.22 0.02 0.00 0.02 0.00 0.00 41.25 38.85 1wb1 s ASN 462 CO 0.01 -0.79 0.58 -0.13 0.02 0.00 0.00 177.10 176.79 1wb1 s ARG 463 N 1.95 2.71 -0.34 -0.60 1.81 0.36 -4.95 118.95 119.90 1wb1 s ARG 463 Ca 0.07 -1.34 0.00 0.00 -1.72 0.00 0.00 55.73 52.74 1wb1 s ARG 463 Cb -0.24 -2.69 0.14 0.00 -0.45 0.00 0.00 34.95 31.70 1wb1 s ARG 463 CO 0.07 -0.36 0.26 -1.17 -0.68 0.00 0.00 175.30 173.42 1wb1 s LEU 464 N -4.37 0.43 0.84 2.53 2.96 -1.26 -2.77 118.68 117.04 1wb1 s LEU 464 Ca 0.55 -1.65 -0.11 0.00 -0.22 0.00 0.00 54.13 52.69 1wb1 s LEU 464 Cb -0.08 0.01 0.14 0.00 0.50 0.00 0.00 46.19 46.75 1wb1 s LEU 464 CO 0.33 -0.33 1.19 -0.13 -1.32 0.00 0.00 176.35 176.09 1wb1 s ARG 465 N 1.54 1.39 0.11 1.98 0.52 -1.10 -4.81 118.95 118.57 1wb1 s ARG 465 Ca 0.15 -0.35 0.09 0.00 -0.52 0.00 0.00 55.73 55.10 1wb1 s ARG 465 Cb -0.18 -2.00 -0.04 0.00 0.52 0.00 0.00 34.95 33.25 1wb1 s ARG 465 CO -0.12 -1.87 -0.20 0.50 0.02 0.00 0.00 175.30 173.63 1wb1 s ARG 466 N -5.60 1.73 0.01 3.54 3.52 -1.26 0.04 118.95 120.94 1wb1 s ARG 466 Ca 0.67 -1.19 -0.00 0.00 -0.13 0.00 0.00 55.73 55.08 1wb1 s ARG 466 Cb -0.07 -2.07 0.00 0.00 -1.56 0.00 0.00 34.95 31.25 1wb1 s ARG 466 CO 0.49 0.48 0.01 1.87 -0.81 0.00 0.00 175.30 177.34 1wb1 n TRP 467 N 0.95 -4.55 -0.27 5.12 -0.00 0.14 -4.81 117.44 114.01 1wb1 n TRP 467 Ca -0.16 2.70 0.00 0.00 -0.00 0.00 0.00 57.50 60.04 1wb1 n TRP 467 Cb 0.53 -3.67 0.00 0.00 -0.00 0.00 0.00 31.31 28.16 1wb1 n TRP 467 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10