#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3w h PRO 2 N 0.00 0.55 -4.23 0.03 0.11 -2.07 -3.37 132.00 123.02 2b3w h PRO 2 Ca 0.00 -0.19 -0.74 0.00 0.11 0.00 0.00 66.00 65.18 2b3w h PRO 2 Cb 0.00 -0.04 -0.27 0.00 0.11 0.00 0.00 31.00 30.80 2b3w h PRO 2 CO 0.00 0.71 -0.33 0.08 -0.21 0.00 0.00 178.00 178.25 2b3w s VAL 3 N -4.92 4.69 -0.64 3.15 1.01 -1.26 -5.04 120.40 117.38 2b3w s VAL 3 Ca -0.13 -1.57 -0.23 0.00 0.00 0.00 0.00 61.98 60.04 2b3w s VAL 3 Cb 0.08 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.52 2b3w s VAL 3 CO 0.77 -0.77 0.97 -0.60 0.00 0.00 0.00 175.10 175.48 2b3w s ARG 4 N 1.48 3.15 -0.13 2.72 3.52 -1.26 -5.00 118.95 123.43 2b3w s ARG 4 Ca 0.04 -0.71 -0.28 0.00 -0.13 0.00 0.00 55.73 54.66 2b3w s ARG 4 Cb -0.27 -4.19 -0.01 0.00 -1.56 0.00 0.00 34.95 28.91 2b3w s ARG 4 CO 0.02 -1.78 0.93 0.00 -0.81 0.00 0.00 175.30 173.67 2b3w s ALA 5 N 4.13 3.45 -0.02 6.12 0.00 -1.26 -5.03 121.76 129.15 2b3w s ALA 5 Ca 0.24 0.24 -0.15 0.00 0.00 0.00 0.00 51.96 52.29 2b3w s ALA 5 Cb -0.16 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2b3w s ALA 5 CO 0.12 -0.61 0.32 -1.14 0.00 0.00 0.00 175.76 174.45 2b3w s GLN 6 N 2.04 0.68 -0.23 0.00 0.74 -1.26 -5.14 119.66 116.49 2b3w s GLN 6 Ca 0.44 -0.17 -0.20 0.00 0.05 0.00 0.00 55.36 55.48 2b3w s GLN 6 Cb -0.18 0.30 -0.02 0.00 1.10 0.00 0.00 33.01 34.22 2b3w s GLN 6 CO 0.16 -0.19 0.62 1.03 -0.55 0.00 0.00 175.29 176.36 2b3w s ARG 7 N -1.31 4.15 -0.36 1.67 0.52 -1.26 -4.95 118.95 117.41 2b3w s ARG 7 Ca -0.13 0.56 -0.14 0.00 -0.52 0.00 0.00 55.73 55.49 2b3w s ARG 7 Cb -0.05 -3.62 -0.01 0.00 0.52 0.00 0.00 34.95 31.79 2b3w s ARG 7 CO 0.04 -0.33 0.31 -1.50 0.02 0.00 0.00 175.30 173.84 2b3w s ILE 8 N 2.24 5.22 0.28 1.52 2.07 -1.26 -5.07 121.20 126.21 2b3w s ILE 8 Ca 0.27 -0.18 0.03 0.00 -1.41 0.00 0.00 60.65 59.36 2b3w s ILE 8 Cb -0.16 -3.81 -0.06 0.00 0.13 0.00 0.00 42.46 38.57 2b3w s ILE 8 CO 0.09 -0.11 0.04 0.00 -1.91 0.00 0.00 174.94 173.05 2b3w s GLN 9 N 1.86 1.51 -1.06 3.50 1.03 -1.26 -4.70 119.66 120.54 2b3w s GLN 9 Ca 0.09 -1.81 -0.06 0.00 0.04 0.00 0.00 55.36 53.61 2b3w s GLN 9 Cb -0.17 -0.69 -0.07 0.00 0.03 0.00 0.00 33.01 32.12 2b3w s GLN 9 CO 0.11 -0.17 0.92 0.72 -2.54 0.00 0.00 175.29 174.32 2b3w n HIS 10 N -0.56 -2.44 1.10 9.60 8.25 -1.26 -4.88 115.22 125.04 2b3w n HIS 10 Ca -0.03 0.84 0.02 0.00 -0.26 0.00 0.00 57.72 58.29 2b3w n HIS 10 Cb 0.66 -4.13 0.06 0.00 1.12 0.00 0.00 29.99 27.70 2b3w n HIS 10 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2b3w n VAL 11 N -3.30 0.34 -3.36 1.59 0.24 -1.26 -4.85 118.33 107.72 2b3w n VAL 11 Ca -0.08 -0.21 -0.19 0.00 -2.04 0.00 0.00 64.34 61.82 2b3w n VAL 11 Cb 0.62 -0.20 0.06 0.00 -1.47 0.00 0.00 33.84 32.85 2b3w n VAL 11 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 2b3w n MET 12 N -0.00 -6.33 0.00 7.34 2.81 -1.26 -3.20 117.12 116.48 2b3w n MET 12 Ca 0.05 0.67 0.00 0.00 -1.81 0.00 0.00 57.70 56.60 2b3w n MET 12 Cb 0.27 -5.22 0.00 0.00 -0.71 0.00 0.00 33.22 27.56 2b3w n MET 12 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2b3w n GLN 13 N -4.07 0.00 -3.44 0.03 3.00 -1.26 -4.25 117.38 107.38 2b3w n GLN 13 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.69 2b3w n GLN 13 Cb 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 30.24 30.68 2b3w n GLN 13 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2b3w s ASP 14 N 0.00 2.58 -0.07 1.08 2.15 -1.25 -4.52 116.67 116.63 2b3w s ASP 14 Ca 0.00 -2.36 -0.04 0.00 0.43 0.00 0.00 52.55 50.57 2b3w s ASP 14 Cb 0.00 -0.38 -0.04 0.00 -0.30 0.00 0.00 42.92 42.20 2b3w s ASP 14 CO 0.00 -0.28 0.12 0.28 -0.17 0.00 0.00 175.17 175.12 2b3w s THR 15 N 0.86 5.20 -0.49 1.71 -1.32 -1.19 -4.92 115.64 115.49 2b3w s THR 15 Ca 0.21 -0.02 -0.18 0.00 -1.21 0.00 0.00 61.69 60.49 2b3w s THR 15 Cb -0.17 -3.31 0.06 0.00 -1.51 0.00 0.00 72.50 67.57 2b3w s THR 15 CO -0.04 0.52 0.54 -0.63 -2.21 0.00 0.00 174.62 172.80 2b3w s ILE 16 N -1.09 5.00 -0.35 5.08 1.09 -1.26 -0.17 121.20 129.49 2b3w s ILE 16 Ca 0.18 -0.66 -0.21 0.00 -1.10 0.00 0.00 60.65 58.86 2b3w s ILE 16 Cb -0.12 -4.23 0.00 0.00 -1.06 0.00 0.00 42.46 37.05 2b3w s ILE 16 CO 0.08 -0.72 0.67 -0.63 -0.10 0.00 0.00 174.94 174.25 2b3w s ILE 17 N 2.30 4.86 -0.45 2.92 1.01 0.10 -4.95 121.20 126.99 2b3w s ILE 17 Ca 0.11 0.73 -0.19 0.00 0.00 0.00 0.00 60.65 61.30 2b3w s ILE 17 Cb -0.21 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.20 2b3w s ILE 17 CO 0.10 -0.30 0.58 0.20 0.00 0.00 0.00 174.94 175.52 2b3w s ASN 18 N 1.76 6.26 -0.27 3.58 0.02 -1.25 -1.77 114.94 123.27 2b3w s ASN 18 Ca 0.26 -0.61 -0.02 0.00 -1.02 0.00 0.00 52.86 51.47 2b3w s ASN 18 Cb -0.14 -2.28 0.03 0.00 0.02 0.00 0.00 41.25 38.87 2b3w s ASN 18 CO 0.14 -0.76 -0.03 0.72 0.02 0.00 0.00 177.10 177.20 2b3w s PHE 19 N 2.57 3.13 -0.29 2.20 -0.71 -1.03 -4.95 117.98 118.89 2b3w s PHE 19 Ca 0.17 -1.57 0.01 0.00 -1.04 0.00 0.00 56.93 54.50 2b3w s PHE 19 Cb -0.16 -2.09 0.15 0.00 -1.21 0.00 0.00 43.02 39.70 2b3w s PHE 19 CO 0.15 -0.73 0.36 -0.47 -1.34 0.00 0.00 175.22 173.20 2b3w s TYR 20 N 1.33 -0.79 0.00 3.49 5.04 -1.26 -3.94 117.35 121.21 2b3w s TYR 20 Ca -0.01 0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.75 2b3w s TYR 20 Cb -0.17 -0.27 0.00 0.00 0.35 0.00 0.00 41.96 41.86 2b3w s TYR 20 CO -0.03 -0.96 0.00 0.45 -1.34 0.00 0.00 175.55 173.68 2b3w n SER 21 N 5.34 0.00 -0.42 4.32 2.88 -1.26 -5.02 113.62 119.46 2b3w n SER 21 Ca -0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 2b3w n SER 21 Cb 0.48 0.00 0.49 0.00 -0.75 0.00 0.00 64.21 64.44 2b3w n SER 21 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2b3w n THR 22 N 0.00 0.10 -0.99 2.46 -1.04 -1.26 -3.75 114.28 109.80 2b3w n THR 22 Ca 0.00 -0.25 0.08 0.00 -2.04 0.00 0.00 64.05 61.85 2b3w n THR 22 Cb 0.00 0.27 0.27 0.00 -1.82 0.00 0.00 70.33 69.05 2b3w n THR 22 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2b3w n SER 23 N 0.04 4.05 -4.33 8.00 7.64 -1.26 -4.91 113.62 122.85 2b3w n SER 23 Ca 0.18 -3.02 -0.20 0.00 1.01 0.00 0.00 58.87 56.84 2b3w n SER 23 Cb 0.29 -0.56 -0.11 0.00 -1.01 0.00 0.00 64.21 62.83 2b3w n SER 23 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2b3w s ASP 24 N -1.84 2.55 0.39 6.43 2.15 -1.25 -5.03 116.67 120.08 2b3w s ASP 24 Ca 0.43 -0.94 0.08 0.00 0.43 0.00 0.00 52.55 52.56 2b3w s ASP 24 Cb 0.35 -0.14 0.78 0.00 -0.30 0.00 0.00 42.92 43.62 2b3w s ASP 24 CO 0.09 -0.12 1.95 0.44 -0.17 0.00 0.00 175.17 177.37 2b3w h ASP 25 N 2.92 0.34 0.08 -0.34 5.19 -1.94 -0.57 116.42 122.12 2b3w h ASP 25 Ca -0.40 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2b3w h ASP 25 Cb 1.21 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.63 2b3w h ASP 25 CO 0.57 0.40 -0.06 0.00 -3.12 0.00 0.00 179.24 177.02 2b3w n TYR 26 N -4.34 0.00 1.40 4.55 9.36 -1.26 -3.92 117.16 122.95 2b3w n TYR 26 Ca 0.01 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.34 2b3w n TYR 26 Cb 0.20 -0.05 0.67 0.00 -0.63 0.00 0.00 39.34 39.53 2b3w n TYR 26 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2b3w n GLY 27 N 1.19 -0.73 0.44 2.98 0.00 -0.22 -3.80 105.19 105.06 2b3w n GLY 27 Ca 0.18 -0.14 0.26 0.00 0.00 0.00 0.00 46.02 46.32 2b3w n GLY 27 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2b3w h ASP 28 N 0.00 0.06 0.05 1.61 3.58 -1.74 0.95 116.42 120.93 2b3w h ASP 28 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2b3w h ASP 28 Cb 0.01 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2b3w h ASP 28 CO 0.00 0.02 0.00 0.49 -2.88 0.00 0.00 179.24 176.87 2b3w n PHE 29 N -4.32 0.00 -2.51 0.28 3.72 -1.25 -4.73 117.46 108.65 2b3w n PHE 29 Ca 0.17 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.17 2b3w n PHE 29 Cb 0.87 -0.04 -0.04 0.00 -0.94 0.00 0.00 39.48 39.33 2b3w n PHE 29 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2b3w s SER 30 N -2.08 7.32 0.00 4.37 0.15 0.33 -4.92 113.70 118.86 2b3w s SER 30 Ca 0.29 2.22 0.27 0.00 0.70 0.00 0.00 55.95 59.44 2b3w s SER 30 Cb 0.14 -2.62 1.50 0.00 -1.71 0.00 0.00 66.02 63.32 2b3w s SER 30 CO 0.25 -0.11 1.96 -0.46 1.20 0.00 0.00 173.24 176.08 2b3w n ASN 31 N 1.29 0.00 -0.99 5.45 0.23 -1.26 -2.22 115.26 117.76 2b3w n ASN 31 Ca -0.01 -0.44 0.08 0.00 -0.53 0.00 0.00 54.58 53.68 2b3w n ASN 31 Cb 0.45 -0.16 0.24 0.00 -2.08 0.00 0.00 39.78 38.23 2b3w n ASN 31 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 2b3w n PHE 32 N -1.16 0.81 -2.02 -2.53 7.35 -1.26 -3.79 117.46 114.86 2b3w n PHE 32 Ca 0.16 -0.56 -0.41 0.00 -0.76 0.00 0.00 57.45 55.88 2b3w n PHE 32 Cb 0.16 -0.09 -0.02 0.00 0.35 0.00 0.00 39.48 39.88 2b3w n PHE 32 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2b3w s ALA 33 N -1.36 3.58 -1.26 3.13 0.00 -0.94 -4.87 121.76 120.03 2b3w s ALA 33 Ca 0.36 1.34 -0.09 0.00 0.00 0.00 0.00 51.96 53.57 2b3w s ALA 33 Cb 0.21 -3.54 -0.12 0.00 0.00 0.00 0.00 23.12 19.68 2b3w s ALA 33 CO 0.20 -0.75 2.97 0.00 0.00 0.00 0.00 175.76 178.19 2b3w n ALA 34 N 1.64 7.03 -3.50 0.00 0.00 -1.26 -4.41 120.51 120.01 2b3w n ALA 34 Ca 0.04 -3.05 -0.35 0.00 0.00 0.00 0.00 53.44 50.08 2b3w n ALA 34 Cb 0.41 -3.15 -0.14 0.00 0.00 0.00 0.00 19.45 16.57 2b3w n ALA 34 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2b3w s TRP 35 N 2.10 2.99 0.23 0.00 0.52 -1.26 -5.02 118.94 118.50 2b3w s TRP 35 Ca 0.66 -1.02 -0.30 0.00 0.02 0.00 0.00 56.10 55.45 2b3w s TRP 35 Cb 0.19 -2.11 -0.10 0.00 -1.15 0.00 0.00 33.47 30.30 2b3w s TRP 35 CO -0.05 -0.58 1.40 -1.25 0.02 0.00 0.00 176.95 176.50 2b3w s PRO 36 N 1.46 4.31 0.20 4.98 0.04 -1.15 -3.94 135.00 140.90 2b3w s PRO 36 Ca 0.05 2.22 0.10 0.00 0.04 0.00 0.00 61.00 63.41 2b3w s PRO 36 Cb -0.15 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2b3w s PRO 36 CO -0.03 -0.37 -0.21 0.96 0.04 0.00 0.00 177.00 177.39 2b3w s ILE 37 N 0.10 2.18 -0.31 0.56 -4.36 0.45 -4.94 121.20 114.89 2b3w s ILE 37 Ca 0.59 -2.07 0.01 0.00 -0.26 0.00 0.00 60.65 58.91 2b3w s ILE 37 Cb -0.40 -2.07 0.07 0.00 1.25 0.00 0.00 42.46 41.31 2b3w s ILE 37 CO 0.41 -0.25 -0.01 -0.75 0.24 0.00 0.00 174.94 174.58 2b3w s LYS 38 N -2.91 2.15 -0.08 0.37 2.36 -1.26 -0.33 119.74 120.04 2b3w s LYS 38 Ca 0.21 -1.47 0.02 0.00 -2.55 0.00 0.00 55.97 52.18 2b3w s LYS 38 Cb -0.06 -3.13 0.01 0.00 -1.05 0.00 0.00 37.83 33.60 2b3w s LYS 38 CO 0.10 -0.71 -0.13 0.08 1.55 0.00 0.00 175.35 176.23 2b3w s VAL 39 N 1.12 1.29 0.00 4.02 1.01 -0.44 -4.78 120.40 122.62 2b3w s VAL 39 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.41 2b3w s VAL 39 Cb -0.20 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.00 2b3w s VAL 39 CO -0.04 0.39 0.00 -0.67 0.00 0.00 0.00 175.10 174.78 2b3w n ASP 40 N 4.00 0.00 0.00 3.32 2.03 -1.26 -0.24 116.55 124.40 2b3w n ASP 40 Ca -0.21 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.10 2b3w n ASP 40 Cb 0.52 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.75 2b3w n ASP 40 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2b3w n GLY 41 N -1.68 0.49 3.55 0.27 0.00 -1.26 -5.12 105.19 101.43 2b3w n GLY 41 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2b3w n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b3w s LYS 42 N 0.00 3.23 -0.32 1.61 1.02 0.67 -5.08 119.74 120.86 2b3w s LYS 42 Ca 0.00 -0.52 -0.26 0.00 0.02 0.00 0.00 55.97 55.21 2b3w s LYS 42 Cb 0.00 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 34.55 2b3w s LYS 42 CO 0.00 0.46 0.90 0.99 -0.92 0.00 0.00 175.35 176.78 2b3w s THR 43 N -0.24 4.67 -0.16 2.17 2.01 -1.26 -1.33 115.64 121.50 2b3w s THR 43 Ca 0.04 1.36 -0.06 0.00 0.31 0.00 0.00 61.69 63.34 2b3w s THR 43 Cb -0.13 -4.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.09 2b3w s THR 43 CO 0.02 -0.36 0.02 0.26 -0.69 0.00 0.00 174.62 173.87 2b3w s TRP 44 N 3.25 3.16 0.45 4.92 0.52 0.56 -5.00 118.94 126.79 2b3w s TRP 44 Ca 0.37 -0.06 0.25 0.00 0.02 0.00 0.00 56.10 56.67 2b3w s TRP 44 Cb -0.13 -2.01 1.41 0.00 -1.15 0.00 0.00 33.47 31.59 2b3w s TRP 44 CO 0.14 0.11 2.09 -1.00 0.02 0.00 0.00 176.95 178.31 2b3w h PRO 45 N 6.57 0.00 -3.02 4.98 0.13 -1.88 0.13 132.00 138.90 2b3w h PRO 45 Ca -0.36 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.80 2b3w h PRO 45 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2b3w h PRO 45 CO 0.66 0.11 0.24 0.99 -0.23 0.00 0.00 178.00 179.77 2b3w s THR 46 N -4.39 0.00 -0.09 1.56 2.01 -1.26 -2.93 115.64 110.55 2b3w s THR 46 Ca -0.03 -1.01 -0.26 0.00 0.31 0.00 0.00 61.69 60.69 2b3w s THR 46 Cb 0.14 -2.37 -0.26 0.00 0.01 0.00 0.00 72.50 70.02 2b3w s THR 46 CO 0.61 0.00 0.91 0.28 -0.69 0.00 0.00 174.62 175.73 2b3w h SER 47 N 2.01 0.15 -0.00 3.53 0.02 -1.77 -3.25 113.55 114.23 2b3w h SER 47 Ca -0.25 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 59.82 2b3w h SER 47 Cb 1.25 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 2b3w h SER 47 CO 0.31 1.01 0.00 1.05 -1.14 0.00 0.00 176.83 178.07 2b3w h GLU 48 N -0.70 0.00 -0.67 3.45 9.09 -1.92 -1.12 114.58 122.72 2b3w h GLU 48 Ca -0.03 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.39 2b3w h GLU 48 Cb 1.07 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.13 2b3w h GLU 48 CO 0.04 0.00 0.44 0.45 0.05 0.00 0.00 179.01 179.99 2b3w h HIS 49 N 0.00 0.83 -0.29 2.06 3.86 -1.93 0.38 115.15 120.06 2b3w h HIS 49 Ca 0.00 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2b3w h HIS 49 Cb 0.01 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.19 2b3w h HIS 49 CO 0.00 0.52 -0.06 -0.92 0.86 0.00 0.00 177.93 178.33 2b3w h TYR 50 N 0.90 0.62 -0.33 2.45 3.20 -1.32 -1.58 116.97 120.92 2b3w h TYR 50 Ca 0.25 -0.13 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2b3w h TYR 50 Cb -0.09 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2b3w h TYR 50 CO -0.03 0.74 0.20 0.35 -1.64 0.00 0.00 178.16 177.78 2b3w h PHE 51 N 0.32 0.43 -0.17 -3.82 3.57 -1.20 -1.55 116.94 114.53 2b3w h PHE 51 Ca 0.08 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 2b3w h PHE 51 Cb 0.53 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2b3w h PHE 51 CO 0.05 0.31 -0.16 0.37 -2.23 0.00 0.00 178.31 176.65 2b3w h GLN 52 N 0.42 0.27 -0.05 1.11 5.75 -0.20 -1.33 115.11 121.09 2b3w h GLN 52 Ca 0.12 -0.07 -0.09 0.00 -0.15 0.00 0.00 58.65 58.45 2b3w h GLN 52 Cb 0.01 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2b3w h GLN 52 CO -0.02 0.44 -0.32 0.00 -2.65 0.00 0.00 178.83 176.28 2b3w h ALA 53 N 1.58 0.11 0.00 3.38 0.00 -0.93 -3.18 119.26 120.22 2b3w h ALA 53 Ca 0.05 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2b3w h ALA 53 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2b3w h ALA 53 CO 0.03 0.17 0.00 1.04 0.00 0.00 0.00 179.25 180.49 2b3w n GLN 54 N -4.43 0.04 0.23 0.00 1.13 -0.62 -2.67 117.38 111.07 2b3w n GLN 54 Ca -0.09 0.05 0.07 0.00 -1.94 0.00 0.00 57.00 55.09 2b3w n GLN 54 Cb 0.51 -1.50 0.55 0.00 0.11 0.00 0.00 30.24 29.91 2b3w n GLN 54 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2b3w h LYS 55 N 0.00 0.00 -6.12 -1.09 3.64 -1.22 -3.44 116.57 108.34 2b3w h LYS 55 Ca 0.00 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.86 2b3w h LYS 55 Cb 0.43 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 2b3w h LYS 55 CO 0.00 0.16 -0.46 -0.06 -2.27 0.00 0.00 179.45 176.81 2b3w s PHE 56 N -4.61 2.75 -0.19 1.91 0.08 -1.09 -4.56 117.98 112.27 2b3w s PHE 56 Ca -0.04 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.63 2b3w s PHE 56 Cb 0.15 -1.87 -0.21 0.00 -0.57 0.00 0.00 43.02 40.52 2b3w s PHE 56 CO 0.68 0.15 0.06 1.28 -0.10 0.00 0.00 175.22 177.29 2b3w n LEU 57 N -1.33 2.14 -4.70 -0.37 4.32 -1.26 -4.92 117.00 110.88 2b3w n LEU 57 Ca -0.01 0.03 -0.42 0.00 -0.02 0.00 0.00 56.01 55.59 2b3w n LEU 57 Cb 0.61 -0.60 -0.03 0.00 -1.62 0.00 0.00 43.42 41.78 2b3w n LEU 57 CO 0.43 0.78 1.34 -0.62 -1.22 0.00 0.00 177.39 178.10 2b3w s ASP 58 N -6.42 6.54 0.25 -1.43 2.15 -1.26 -4.90 116.67 111.60 2b3w s ASP 58 Ca -0.24 2.60 0.05 0.00 0.43 0.00 0.00 52.55 55.40 2b3w s ASP 58 Cb 0.08 -2.57 0.29 0.00 -0.30 0.00 0.00 42.92 40.41 2b3w s ASP 58 CO 0.71 -0.90 1.58 -0.33 -0.17 0.00 0.00 175.17 176.06 2b3w h GLU 59 N 7.91 0.21 -0.67 4.34 5.08 -1.96 -2.29 114.58 127.20 2b3w h GLU 59 Ca -0.43 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 57.73 2b3w h GLU 59 Cb 1.21 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 2b3w h GLU 59 CO 0.93 0.73 0.18 -0.22 -1.00 0.00 0.00 179.01 179.63 2b3w h LYS 60 N 0.16 1.06 -0.14 2.33 3.64 -1.98 -2.18 116.57 119.46 2b3w h LYS 60 Ca -0.00 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.06 2b3w h LYS 60 Cb 1.07 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 2b3w h LYS 60 CO 0.09 0.93 -0.26 -0.92 -2.27 0.00 0.00 179.45 177.03 2b3w h TYR 61 N 0.99 0.27 -0.37 1.91 3.20 -1.89 0.53 116.97 121.61 2b3w h TYR 61 Ca 0.21 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 2b3w h TYR 61 Cb 0.34 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 2b3w h TYR 61 CO 0.03 0.49 0.13 0.00 -1.64 0.00 0.00 178.16 177.16 2b3w h ARG 62 N 0.22 0.57 0.00 1.82 3.08 -1.02 -2.15 114.38 116.91 2b3w h ARG 62 Ca 0.04 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2b3w h ARG 62 Cb 0.58 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2b3w h ARG 62 CO 0.04 0.57 0.00 1.49 -1.07 0.00 0.00 179.97 181.00 2b3w h GLU 63 N 0.46 0.00 -0.24 0.04 4.81 -0.88 -2.49 114.58 116.27 2b3w h GLU 63 Ca 0.12 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.31 2b3w h GLU 63 Cb 0.22 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2b3w h GLU 63 CO -0.01 0.00 -0.03 1.49 -0.73 0.00 0.00 179.01 179.74 2b3w h GLU 64 N 0.00 0.45 -0.05 1.92 4.57 0.67 0.17 114.58 122.31 2b3w h GLU 64 Ca 0.00 -0.16 -0.12 0.00 -1.18 0.00 0.00 59.36 57.90 2b3w h GLU 64 Cb 0.72 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 2b3w h GLU 64 CO 0.00 0.65 -0.53 0.82 -1.18 0.00 0.00 179.01 178.77 2b3w h ILE 65 N 0.20 1.37 0.00 2.32 5.03 -1.36 -2.06 117.51 123.02 2b3w h ILE 65 Ca 0.07 -1.83 0.00 0.00 -0.12 0.00 0.00 64.86 62.98 2b3w h ILE 65 Cb 0.47 1.93 0.00 0.00 -3.03 0.00 0.00 36.82 36.19 2b3w h ILE 65 CO 0.02 0.53 0.00 -1.14 -0.68 0.00 0.00 178.15 176.88 2b3w n ARG 66 N -3.92 0.07 0.00 2.37 0.63 -0.94 -2.48 116.66 112.39 2b3w n ARG 66 Ca -0.02 0.25 0.13 0.00 -0.92 0.00 0.00 57.85 57.29 2b3w n ARG 66 Cb 0.56 -1.62 0.49 0.00 0.45 0.00 0.00 32.46 32.34 2b3w n ARG 66 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 2b3w n ARG 67 N -1.74 0.28 -4.96 -0.14 3.00 0.57 -4.81 116.66 108.85 2b3w n ARG 67 Ca 0.04 -0.10 -0.32 0.00 -0.00 0.00 0.00 57.85 57.46 2b3w n ARG 67 Cb 0.24 -1.50 -0.14 0.00 0.00 0.00 0.00 32.46 31.06 2b3w n ARG 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2b3w s VAL 68 N -2.80 2.85 -0.06 5.15 0.11 -1.04 -5.00 120.40 119.61 2b3w s VAL 68 Ca 0.19 -0.79 0.08 0.00 -2.93 0.00 0.00 61.98 58.52 2b3w s VAL 68 Cb 0.19 -2.11 -0.24 0.00 -1.53 0.00 0.00 36.38 32.69 2b3w s VAL 68 CO 0.56 0.58 0.58 -0.24 -3.33 0.00 0.00 175.10 173.26 2b3w n SER 69 N 2.52 1.16 -4.67 3.54 2.88 -1.26 -4.84 113.62 112.96 2b3w n SER 69 Ca -0.17 0.36 -0.42 0.00 -1.33 0.00 0.00 58.87 57.31 2b3w n SER 69 Cb 0.52 -0.24 -0.03 0.00 -0.75 0.00 0.00 64.21 63.71 2b3w n SER 69 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2b3w s SER 70 N -6.31 6.74 0.34 -3.46 0.15 -1.26 -4.83 113.70 105.07 2b3w s SER 70 Ca -0.09 2.15 0.07 0.00 0.70 0.00 0.00 55.95 58.78 2b3w s SER 70 Cb 0.08 -2.54 0.61 0.00 -1.71 0.00 0.00 66.02 62.45 2b3w s SER 70 CO 0.81 -0.86 1.82 -0.65 1.20 0.00 0.00 173.24 175.56 2b3w h PRO 71 N 8.90 0.31 -0.44 5.44 0.11 -1.99 -2.71 132.00 141.62 2b3w h PRO 71 Ca -0.37 -0.10 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2b3w h PRO 71 Cb 1.17 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2b3w h PRO 71 CO 0.94 0.51 -0.15 1.98 -0.21 0.00 0.00 178.00 181.08 2b3w h MET 72 N 0.28 0.88 -0.38 1.05 4.05 -1.99 -1.52 114.93 117.30 2b3w h MET 72 Ca 0.05 -0.36 -0.09 0.00 -0.28 0.00 0.00 59.70 59.03 2b3w h MET 72 Cb 0.54 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.28 2b3w h MET 72 CO 0.04 1.00 -0.13 0.28 0.23 0.00 0.00 176.91 178.33 2b3w h VAL 73 N 0.71 1.25 -0.56 -5.77 2.07 -1.95 -0.72 116.25 111.28 2b3w h VAL 73 Ca 0.11 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2b3w h VAL 73 Cb 0.70 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2b3w h VAL 73 CO 0.05 0.38 0.36 0.00 0.02 0.00 0.00 177.57 178.38 2b3w h ALA 74 N 1.25 0.72 -0.75 1.67 0.00 -1.17 -1.48 119.26 119.49 2b3w h ALA 74 Ca 0.11 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2b3w h ALA 74 Cb 0.57 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2b3w h ALA 74 CO 0.04 0.17 0.27 0.00 0.00 0.00 0.00 179.25 179.73 2b3w h ALA 75 N 1.19 1.07 0.15 0.00 0.00 -0.87 0.02 119.26 120.82 2b3w h ALA 75 Ca 0.20 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2b3w h ALA 75 Cb -0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2b3w h ALA 75 CO -0.04 0.65 -0.22 -0.09 0.00 0.00 0.00 179.25 179.54 2b3w h ARG 76 N 1.09 -0.42 -0.02 0.00 2.43 -0.55 0.12 114.38 117.05 2b3w h ARG 76 Ca 0.25 0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.33 2b3w h ARG 76 Cb 0.25 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2b3w h ARG 76 CO -0.02 -0.28 -0.52 0.52 -1.51 0.00 0.00 179.97 178.16 2b3w h MET 77 N -0.43 0.05 -0.00 0.20 2.86 -1.16 -2.71 114.93 113.73 2b3w h MET 77 Ca 0.02 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2b3w h MET 77 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 2b3w h MET 77 CO -0.10 0.56 -0.07 0.41 1.06 0.00 0.00 176.91 178.77 2b3w n GLY 78 N 0.00 -1.27 0.40 8.32 0.00 -0.02 -2.95 105.19 109.67 2b3w n GLY 78 Ca -0.02 -0.18 0.14 0.00 0.00 0.00 0.00 46.02 45.97 2b3w n GLY 78 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2b3w n ARG 79 N -1.30 1.46 -2.17 1.61 0.63 0.00 -4.85 116.66 112.04 2b3w n ARG 79 Ca 0.11 -0.81 -0.43 0.00 -0.92 0.00 0.00 57.85 55.81 2b3w n ARG 79 Cb 0.29 -1.48 -0.02 0.00 0.45 0.00 0.00 32.46 31.69 2b3w n ARG 79 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2b3w s ASP 80 N -2.09 6.27 -0.02 6.15 2.15 -1.15 -4.84 116.67 123.14 2b3w s ASP 80 Ca 0.36 1.30 0.18 0.00 0.43 0.00 0.00 52.55 54.82 2b3w s ASP 80 Cb 0.21 -2.53 0.54 0.00 -0.30 0.00 0.00 42.92 40.84 2b3w s ASP 80 CO 0.37 -1.40 1.45 -1.14 -0.17 0.00 0.00 175.17 174.28 2b3w n ARG 81 N 7.94 2.54 0.20 4.34 0.63 -1.26 -3.85 116.66 127.19 2b3w n ARG 81 Ca 0.19 -2.21 0.07 0.00 -0.92 0.00 0.00 57.85 54.99 2b3w n ARG 81 Cb 0.46 -1.52 0.32 0.00 0.45 0.00 0.00 32.46 32.17 2b3w n ARG 81 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 2b3w h SER 82 N 3.51 0.00 -3.99 6.15 0.02 -1.99 -3.45 113.55 113.80 2b3w h SER 82 Ca 0.00 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.47 2b3w h SER 82 Cb 0.88 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.44 2b3w h SER 82 CO 0.03 0.31 0.40 -0.54 -1.14 0.00 0.00 176.83 175.89 2b3w s LYS 83 N -3.45 4.12 0.02 3.45 -0.14 -1.25 -4.98 119.74 117.50 2b3w s LYS 83 Ca 0.02 1.44 -0.30 0.00 -1.36 0.00 0.00 55.97 55.77 2b3w s LYS 83 Cb 0.09 -2.44 -0.08 0.00 -1.68 0.00 0.00 37.83 33.73 2b3w s LYS 83 CO 0.67 -0.17 1.85 -1.25 -0.76 0.00 0.00 175.35 175.69 2b3w s PRO 84 N -2.67 4.16 0.32 -1.68 0.04 -1.26 -4.98 135.00 128.92 2b3w s PRO 84 Ca 0.60 2.47 -0.13 0.00 0.04 0.00 0.00 61.00 63.98 2b3w s PRO 84 Cb -0.20 -4.05 -0.08 0.00 0.04 0.00 0.00 34.50 30.21 2b3w s PRO 84 CO 0.25 -0.90 0.71 -0.51 0.04 0.00 0.00 177.00 176.58 2b3w s LEU 85 N 4.14 4.04 0.13 -3.56 1.43 -1.26 -4.69 118.68 118.90 2b3w s LEU 85 Ca 0.83 1.19 -0.31 0.00 -1.03 0.00 0.00 54.13 54.81 2b3w s LEU 85 Cb -0.40 -4.00 -0.08 0.00 0.03 0.00 0.00 46.19 41.74 2b3w s LEU 85 CO 0.37 -0.22 1.39 -0.13 0.23 0.00 0.00 176.35 177.99 2b3w s ARG 86 N -3.13 4.32 0.21 1.70 0.52 -1.26 -4.92 118.95 116.40 2b3w s ARG 86 Ca 0.52 2.09 -0.09 0.00 -0.52 0.00 0.00 55.73 57.74 2b3w s ARG 86 Cb -0.10 -3.23 0.22 0.00 0.52 0.00 0.00 34.95 32.36 2b3w s ARG 86 CO 0.21 -0.42 1.84 -0.22 0.02 0.00 0.00 175.30 176.73 2b3w h LYS 87 N 6.59 0.83 -0.87 3.54 3.64 -2.00 -2.00 116.57 126.30 2b3w h LYS 87 Ca -0.43 -0.05 -0.51 0.00 -1.27 0.00 0.00 60.65 58.40 2b3w h LYS 87 Cb 1.21 -0.19 -0.28 0.00 -0.41 0.00 0.00 32.23 32.57 2b3w h LYS 87 CO 0.85 0.55 0.51 0.09 -2.27 0.00 0.00 179.45 179.18 2b3w n ASN 88 N -4.67 4.65 -0.37 4.20 4.13 -1.26 -4.60 115.26 117.34 2b3w n ASN 88 Ca 0.09 -3.70 -0.02 0.00 1.68 0.00 0.00 54.58 52.62 2b3w n ASN 88 Cb 0.12 -0.82 0.11 0.00 -1.54 0.00 0.00 39.78 37.65 2b3w n ASN 88 CO 0.00 0.00 0.00 -0.25 0.28 0.00 0.00 177.26 177.29 2b3w h TRP 89 N 1.33 1.25 0.00 3.10 -0.00 -1.74 -0.99 115.95 118.90 2b3w h TRP 89 Ca 0.55 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 59.43 2b3w h TRP 89 Cb 2.04 -0.42 -0.00 0.00 -0.00 0.00 0.00 29.16 30.77 2b3w h TRP 89 CO 1.42 0.79 -0.14 1.05 -0.00 0.00 0.00 178.44 181.57 2b3w h GLU 90 N 1.35 0.00 0.00 2.65 4.11 -1.83 0.72 114.58 121.59 2b3w h GLU 90 Ca 0.36 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.79 2b3w h GLU 90 Cb -0.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 2b3w h GLU 90 CO -0.08 0.14 -0.45 0.77 0.07 0.00 0.00 179.01 179.46 2b3w h SER 91 N 0.00 0.00 -0.15 3.06 0.02 -1.55 -3.27 113.55 111.66 2b3w h SER 91 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b3w h SER 91 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2b3w h SER 91 CO 0.02 0.01 0.00 1.33 -1.14 0.00 0.00 176.83 177.05 2b3w n VAL 92 N -2.92 0.70 0.16 2.27 0.24 -0.85 -4.66 118.33 113.27 2b3w n VAL 92 Ca 0.02 -0.85 -0.14 0.00 -2.04 0.00 0.00 64.34 61.33 2b3w n VAL 92 Cb 0.55 0.69 -0.07 0.00 -1.47 0.00 0.00 33.84 33.54 2b3w n VAL 92 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2b3w h LYS 93 N 1.28 -0.37 0.00 7.34 3.64 -0.92 0.73 116.57 128.27 2b3w h LYS 93 Ca 0.00 0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 2b3w h LYS 93 Cb 0.53 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2b3w h LYS 93 CO 0.00 -0.25 -0.49 1.05 -2.27 0.00 0.00 179.45 177.49 2b3w h GLU 94 N -0.39 0.00 0.51 1.90 -0.00 -1.84 -2.68 114.58 112.08 2b3w h GLU 94 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.32 2b3w h GLU 94 Cb 0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.08 2b3w h GLU 94 CO 0.00 0.49 -0.31 0.37 -0.00 0.00 0.00 179.01 179.56 2b3w h GLN 95 N 0.00 -0.75 -0.57 1.06 4.15 -1.71 0.18 115.11 117.48 2b3w h GLN 95 Ca -0.00 0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 2b3w h GLN 95 Cb 1.26 0.17 -0.03 0.00 0.21 0.00 0.00 27.48 29.09 2b3w h GLN 95 CO 0.06 -0.50 0.34 0.28 -1.93 0.00 0.00 178.83 177.09 2b3w h VAL 96 N -0.78 1.17 -0.42 2.39 2.07 -0.88 -1.96 116.25 117.85 2b3w h VAL 96 Ca -0.06 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 2b3w h VAL 96 Cb 0.63 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2b3w h VAL 96 CO 0.07 0.18 0.08 -0.03 0.02 0.00 0.00 177.57 177.88 2b3w h MET 97 N 0.77 0.69 0.00 1.57 1.85 -1.39 -1.59 114.93 116.83 2b3w h MET 97 Ca 0.21 -0.18 -0.07 0.00 -0.61 0.00 0.00 59.70 59.05 2b3w h MET 97 Cb -0.01 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 31.92 2b3w h MET 97 CO -0.04 0.72 -0.31 0.07 -0.40 0.00 0.00 176.91 176.95 2b3w h ARG 98 N 0.55 0.00 -0.22 0.39 0.11 -0.48 0.16 114.38 114.89 2b3w h ARG 98 Ca 0.13 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.08 2b3w h ARG 98 Cb 0.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.44 2b3w h ARG 98 CO 0.01 0.31 -0.38 -0.22 0.10 0.00 0.00 179.97 179.78 2b3w h LYS 99 N 0.00 0.65 -0.54 0.08 3.64 -1.03 -0.95 116.57 118.42 2b3w h LYS 99 Ca -0.00 -0.40 -0.10 0.00 -1.27 0.00 0.00 60.65 58.87 2b3w h LYS 99 Cb 0.57 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 2b3w h LYS 99 CO 0.04 1.02 -0.07 0.00 -2.27 0.00 0.00 179.45 178.17 2b3w h ALA 100 N 0.62 0.73 -0.78 5.00 0.00 -0.88 -2.37 119.26 121.58 2b3w h ALA 100 Ca 0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2b3w h ALA 100 Cb 0.98 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2b3w h ALA 100 CO 0.09 0.62 0.47 -0.07 0.00 0.00 0.00 179.25 180.35 2b3w h LEU 101 N 0.87 0.94 -0.13 0.00 3.38 -0.62 -1.35 115.31 118.40 2b3w h LEU 101 Ca 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2b3w h LEU 101 Cb 0.63 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2b3w h LEU 101 CO 0.04 0.73 0.08 -0.09 0.09 0.00 0.00 178.44 179.29 2b3w h ARG 102 N 1.08 0.17 -0.81 1.13 2.43 -1.03 -2.43 114.38 114.92 2b3w h ARG 102 Ca 0.28 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.54 2b3w h ARG 102 Cb -0.04 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.42 2b3w h ARG 102 CO -0.05 0.17 0.53 0.00 -1.51 0.00 0.00 179.97 179.10 2b3w h ALA 103 N 1.00 1.77 0.02 2.80 0.00 -1.02 0.49 119.26 124.31 2b3w h ALA 103 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2b3w h ALA 103 Cb 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2b3w h ALA 103 CO -0.01 0.06 -0.04 -0.22 0.00 0.00 0.00 179.25 179.04 2b3w h LYS 104 N 0.73 -0.08 0.00 0.00 3.64 -0.79 -1.12 116.57 118.96 2b3w h LYS 104 Ca 0.38 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.62 2b3w h LYS 104 Cb 0.48 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 2b3w h LYS 104 CO -0.15 -0.05 -0.77 0.74 -2.27 0.00 0.00 179.45 176.95 2b3w h PHE 105 N -0.08 0.00 -0.03 1.91 0.04 -0.99 -3.15 116.94 114.64 2b3w h PHE 105 Ca 0.01 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.57 2b3w h PHE 105 Cb 0.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 2b3w h PHE 105 CO -0.10 0.62 -0.86 0.93 -0.60 0.00 0.00 178.31 178.29 2b3w h GLU 106 N 0.00 0.43 0.00 1.51 4.39 0.03 -3.16 114.58 117.78 2b3w h GLU 106 Ca -0.04 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.24 2b3w h GLU 106 Cb 1.50 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.26 2b3w h GLU 106 CO 0.08 1.07 -0.24 1.04 -1.16 0.00 0.00 179.01 179.80 2b3w n GLN 107 N -3.79 0.08 -3.79 2.33 1.13 -0.43 -4.54 117.38 108.37 2b3w n GLN 107 Ca -0.06 0.05 -0.30 0.00 -1.94 0.00 0.00 57.00 54.75 2b3w n GLN 107 Cb 0.79 -1.57 -0.15 0.00 0.11 0.00 0.00 30.24 29.42 2b3w n GLN 107 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2b3w s HIS 108 N -3.04 2.17 0.52 1.08 3.76 -1.19 -4.97 115.29 113.63 2b3w s HIS 108 Ca 0.11 -2.06 0.17 0.00 -0.15 0.00 0.00 55.06 53.13 2b3w s HIS 108 Cb 0.17 -1.99 1.29 0.00 1.11 0.00 0.00 32.58 33.16 2b3w s HIS 108 CO 0.62 -0.89 2.14 0.00 -0.85 0.00 0.00 174.74 175.77 2b3w h ALA 109 N 7.88 2.02 -0.22 -1.40 0.00 -1.80 -0.36 119.26 125.38 2b3w h ALA 109 Ca -0.11 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2b3w h ALA 109 Cb 1.01 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 2b3w h ALA 109 CO 0.48 -0.04 -0.16 0.93 0.00 0.00 0.00 179.25 180.46 2b3w h GLU 110 N 0.00 -0.16 -0.01 0.00 3.07 -1.93 -1.45 114.58 114.11 2b3w h GLU 110 Ca 0.02 0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 58.69 2b3w h GLU 110 Cb 0.06 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 2b3w h GLU 110 CO -0.00 -0.10 -0.85 -0.07 -1.40 0.00 0.00 179.01 176.58 2b3w h LEU 111 N -0.16 0.34 -0.85 1.33 3.38 -1.53 -2.67 115.31 115.15 2b3w h LEU 111 Ca 0.13 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.88 2b3w h LEU 111 Cb 0.35 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 2b3w h LEU 111 CO -0.31 1.05 0.54 -0.09 0.09 0.00 0.00 178.44 179.71 2b3w h ARG 112 N 0.16 0.98 -0.27 1.13 2.43 -0.79 0.54 114.38 118.56 2b3w h ARG 112 Ca -0.05 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 58.95 2b3w h ARG 112 Cb 1.47 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2b3w h ARG 112 CO 0.14 0.65 -0.26 0.00 -1.51 0.00 0.00 179.97 178.99 2b3w h ALA 113 N 1.38 0.40 -0.64 2.80 0.00 -1.21 -2.42 119.26 119.56 2b3w h ALA 113 Ca 0.35 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2b3w h ALA 113 Cb 0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2b3w h ALA 113 CO -0.14 0.39 0.36 1.25 0.00 0.00 0.00 179.25 181.10 2b3w h LEU 114 N 0.38 0.54 -0.34 0.00 5.85 -1.04 -1.03 115.31 119.67 2b3w h LEU 114 Ca 0.04 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2b3w h LEU 114 Cb 0.82 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 2b3w h LEU 114 CO 0.07 0.35 0.15 0.25 -0.34 0.00 0.00 178.44 178.92 2b3w h LEU 115 N 0.67 0.46 -1.20 2.25 5.85 -0.87 -2.75 115.31 119.72 2b3w h LEU 115 Ca 0.28 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2b3w h LEU 115 Cb 0.15 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2b3w h LEU 115 CO -0.17 0.48 0.00 -0.07 -0.34 0.00 0.00 178.44 178.34 2b3w h LEU 116 N 0.41 0.00 -0.86 2.25 3.38 -0.94 -2.59 115.31 116.96 2b3w h LEU 116 Ca 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2b3w h LEU 116 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2b3w h LEU 116 CO -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 178.44 178.39 2b3w h ALA 117 N 2.09 0.97 0.00 1.53 0.00 -0.89 -3.16 119.26 119.81 2b3w h ALA 117 Ca 0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2b3w h ALA 117 Cb 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2b3w h ALA 117 CO 0.00 0.16 -0.57 1.79 0.00 0.00 0.00 179.25 180.63 2b3w h THR 118 N 0.00 1.14 -2.17 0.00 1.35 -1.50 -3.43 112.91 108.30 2b3w h THR 118 Ca -0.00 -2.17 -0.63 0.00 -0.55 0.00 0.00 66.41 63.06 2b3w h THR 118 Cb 0.80 2.27 0.10 0.00 -1.73 0.00 0.00 68.15 69.58 2b3w h THR 118 CO 0.02 0.56 0.15 0.00 -0.25 0.00 0.00 175.52 175.99 2b3w n ALA 119 N -2.31 -0.60 -1.29 6.62 0.00 -1.20 -0.33 120.51 121.41 2b3w n ALA 119 Ca 0.00 0.42 -0.27 0.00 0.00 0.00 0.00 53.44 53.59 2b3w n ALA 119 Cb 0.67 -2.00 0.14 0.00 0.00 0.00 0.00 19.45 18.26 2b3w n ALA 119 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2b3w n PRO 120 N 1.16 2.41 -0.90 0.00 -0.04 -1.26 -4.94 135.00 131.42 2b3w n PRO 120 Ca 0.12 -3.13 -0.31 0.00 -0.04 0.00 0.00 63.50 60.14 2b3w n PRO 120 Cb 0.29 -2.21 0.14 0.00 -0.04 0.00 0.00 33.50 31.68 2b3w n PRO 120 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b3w s ALA 121 N -3.49 1.72 -0.27 0.55 0.00 0.55 -4.82 121.76 116.00 2b3w s ALA 121 Ca 0.59 0.55 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 2b3w s ALA 121 Cb 0.49 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 20.18 2b3w s ALA 121 CO 0.06 -2.44 0.60 0.15 0.00 0.00 0.00 175.76 174.13 2b3w s LYS 122 N -4.64 4.02 -0.38 0.00 1.02 0.75 -4.94 119.74 115.57 2b3w s LYS 122 Ca 0.66 0.41 -0.24 0.00 0.02 0.00 0.00 55.97 56.82 2b3w s LYS 122 Cb -0.22 -3.68 0.01 0.00 -0.52 0.00 0.00 37.83 33.43 2b3w s LYS 122 CO 0.56 -0.46 0.84 -0.51 -0.92 0.00 0.00 175.35 174.86 2b3w s LEU 123 N 2.50 4.09 -0.07 3.17 1.43 -1.26 -0.72 118.68 127.82 2b3w s LEU 123 Ca 0.25 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 2b3w s LEU 123 Cb -0.15 -3.10 0.02 0.00 0.03 0.00 0.00 46.19 42.99 2b3w s LEU 123 CO 0.10 -0.82 -0.07 -0.69 0.23 0.00 0.00 176.35 175.10 2b3w s VAL 124 N 3.29 0.79 0.21 -1.59 1.01 -0.73 -4.16 120.40 119.22 2b3w s VAL 124 Ca 0.34 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 61.84 2b3w s VAL 124 Cb -0.12 -0.79 -0.08 0.00 0.00 0.00 0.00 36.38 35.38 2b3w s VAL 124 CO 0.19 0.29 0.81 -0.70 0.00 0.00 0.00 175.10 175.70 2b3w s GLU 125 N 1.11 4.53 -0.69 2.72 -6.30 -1.26 -2.47 118.70 116.34 2b3w s GLU 125 Ca -0.07 1.16 0.05 0.00 -2.50 0.00 0.00 54.97 53.61 2b3w s GLU 125 Cb -0.14 -3.10 0.19 0.00 0.00 0.00 0.00 34.13 31.08 2b3w s GLU 125 CO -0.01 0.48 0.56 1.58 0.02 0.00 0.00 175.26 177.89 2b3w n HIS 126 N 1.22 3.37 -2.66 5.30 -0.00 -1.25 -1.64 115.22 119.55 2b3w n HIS 126 Ca -0.03 -4.28 -0.41 0.00 -0.00 0.00 0.00 57.72 53.00 2b3w n HIS 126 Cb 0.49 -0.61 -0.05 0.00 -0.00 0.00 0.00 29.99 29.82 2b3w n HIS 126 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 2b3w s THR 127 N -1.74 4.08 0.00 3.57 2.01 -1.25 -4.85 115.64 117.46 2b3w s THR 127 Ca 0.29 1.91 0.00 0.00 0.31 0.00 0.00 61.69 64.20 2b3w s THR 127 Cb 0.01 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.30 2b3w s THR 127 CO -0.13 0.38 0.42 -0.62 -0.69 0.00 0.00 174.62 173.98 2b3w n GLU 128 N 2.03 0.09 0.00 4.92 4.71 -1.26 -0.70 120.64 130.43 2b3w n GLU 128 Ca 0.00 -0.42 0.12 0.00 -0.01 0.00 0.00 57.16 56.85 2b3w n GLU 128 Cb 0.47 -0.92 0.20 0.00 -1.01 0.00 0.00 31.44 30.18 2b3w n GLU 128 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 2b3w n ASN 129 N -0.13 1.39 -0.50 1.62 0.23 -1.26 -4.64 115.26 111.97 2b3w n ASN 129 Ca 0.00 -1.11 0.00 0.00 -0.53 0.00 0.00 54.58 52.94 2b3w n ASN 129 Cb 0.01 0.32 0.00 0.00 -2.08 0.00 0.00 39.78 38.03 2b3w n ASN 129 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2b3w n ASP 130 N -0.49 0.00 -3.56 0.53 -0.08 -1.26 -5.10 116.55 106.59 2b3w n ASP 130 Ca 0.10 -0.50 -0.28 0.00 -1.51 0.00 0.00 54.79 52.60 2b3w n ASP 130 Cb 0.39 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.74 2b3w n ASP 130 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2b3w s ALA 131 N -1.00 1.69 -0.23 -1.67 0.00 -1.25 -3.50 121.76 115.80 2b3w s ALA 131 Ca 0.00 -2.43 -0.09 0.00 0.00 0.00 0.00 51.96 49.44 2b3w s ALA 131 Cb 0.00 -1.74 0.10 0.00 0.00 0.00 0.00 23.12 21.48 2b3w s ALA 131 CO 0.00 -2.06 0.51 -0.47 0.00 0.00 0.00 175.76 173.75 2b3w s TYR 132 N 0.34 -0.96 -1.76 0.00 5.04 -1.25 -4.60 117.35 114.16 2b3w s TYR 132 Ca 0.23 1.79 0.00 0.00 -2.44 0.00 0.00 57.07 56.65 2b3w s TYR 132 Cb -0.14 0.48 0.00 0.00 0.35 0.00 0.00 41.96 42.65 2b3w s TYR 132 CO -0.07 -0.52 0.00 0.91 -1.34 0.00 0.00 175.55 174.53 2b3w n TRP 133 N 5.16 -0.05 0.00 4.97 5.03 -1.21 -4.69 117.44 126.64 2b3w n TRP 133 Ca -0.13 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.40 2b3w n TRP 133 Cb 0.51 -2.93 0.00 0.00 -1.03 0.00 0.00 31.31 27.86 2b3w n TRP 133 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2b3w n GLY 134 N -0.92 -0.29 3.80 6.99 0.00 0.45 -4.37 105.19 110.84 2b3w n GLY 134 Ca -0.17 0.59 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 2b3w n GLY 134 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b3w s ASP 135 N 2.00 4.51 -0.13 1.61 2.15 -0.65 0.42 116.67 126.58 2b3w s ASP 135 Ca 0.00 -1.15 0.17 0.00 0.43 0.00 0.00 52.55 52.00 2b3w s ASP 135 Cb 0.00 -0.15 0.29 0.00 -0.30 0.00 0.00 42.92 42.77 2b3w s ASP 135 CO 0.00 -0.74 1.15 0.61 -0.17 0.00 0.00 175.17 176.03 2b3w n GLY 136 N -1.41 4.71 0.67 2.66 0.00 -1.14 -3.74 105.19 106.94 2b3w n GLY 136 Ca -0.03 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2b3w n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3w n GLY 137 N -1.34 0.77 0.00 -0.02 0.00 0.12 -4.74 105.19 99.99 2b3w n GLY 137 Ca 0.16 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2b3w n GLY 137 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2b3w n HIS 138 N -0.98 0.00 0.00 1.61 -0.00 -1.26 -5.02 115.22 109.57 2b3w n HIS 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2b3w n HIS 138 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.25 2b3w n HIS 138 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2b3w n GLY 139 N -0.49 0.61 0.00 -1.39 0.00 -1.26 -5.11 105.19 97.54 2b3w n GLY 139 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2b3w n GLY 139 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2b3w n LYS 140 N 0.00 0.00 0.03 1.61 4.81 -1.26 -5.01 118.16 118.34 2b3w n LYS 140 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2b3w n LYS 140 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2b3w n LYS 140 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2b3w n GLY 141 N 0.00 -0.02 2.73 3.14 0.00 -1.13 -4.09 105.19 105.81 2b3w n GLY 141 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2b3w n GLY 141 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b3w n LYS 142 N -2.99 0.39 0.00 1.61 5.02 0.17 -4.72 118.16 117.64 2b3w n LYS 142 Ca 0.00 -1.54 0.04 0.00 -2.02 0.00 0.00 58.31 54.79 2b3w n LYS 142 Cb 0.00 -0.88 0.26 0.00 -0.02 0.00 0.00 35.03 34.40 2b3w n LYS 142 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2b3w n ASN 143 N 2.68 0.00 -0.34 4.39 4.05 -1.19 -0.42 115.26 124.44 2b3w n ASN 143 Ca 0.15 -0.83 0.18 0.00 0.45 0.00 0.00 54.58 54.52 2b3w n ASN 143 Cb 0.60 0.00 0.41 0.00 1.23 0.00 0.00 39.78 42.02 2b3w n ASN 143 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 177.26 174.12 2b3w h ARG 144 N 0.00 0.55 0.76 1.20 9.65 -1.88 0.27 114.38 124.92 2b3w h ARG 144 Ca 0.00 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 2b3w h ARG 144 Cb 0.00 -0.12 0.01 0.00 -1.39 0.00 0.00 29.97 28.46 2b3w h ARG 144 CO 0.00 0.37 -0.36 1.25 2.80 0.00 0.00 179.97 184.02 2b3w h LEU 145 N 0.57 -0.86 -1.76 3.80 5.85 -1.76 0.16 115.31 121.31 2b3w h LEU 145 Ca 0.60 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.31 2b3w h LEU 145 Cb 1.21 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.46 2b3w h LEU 145 CO -0.38 -0.54 -0.12 1.23 -0.34 0.00 0.00 178.44 178.29 2b3w h GLY 146 N -1.14 0.00 1.07 3.75 0.00 -1.55 -1.58 103.07 103.61 2b3w h GLY 146 Ca -0.10 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.12 2b3w h GLY 146 CO 0.17 0.00 -0.10 -1.82 0.00 0.00 0.00 176.54 174.79 2b3w h TYR 147 N 0.00 1.09 -0.80 5.60 3.20 -0.23 -1.26 116.97 124.58 2b3w h TYR 147 Ca -0.00 -0.23 -0.01 0.00 3.14 0.00 0.00 58.73 61.63 2b3w h TYR 147 Cb 0.22 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 2b3w h TYR 147 CO 0.00 1.03 0.47 -0.07 -1.64 0.00 0.00 178.16 177.95 2b3w h LEU 148 N 0.84 0.97 -1.24 2.82 3.38 0.24 0.27 115.31 122.58 2b3w h LEU 148 Ca 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2b3w h LEU 148 Cb 0.66 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2b3w h LEU 148 CO 0.05 0.76 0.35 -0.07 0.09 0.00 0.00 178.44 179.62 2b3w h LEU 149 N 1.10 0.77 -0.08 1.67 3.38 -1.02 0.21 115.31 121.35 2b3w h LEU 149 Ca 0.29 -0.05 -0.24 0.00 0.09 0.00 0.00 57.88 57.96 2b3w h LEU 149 Cb -0.02 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2b3w h LEU 149 CO -0.05 0.62 -1.05 0.24 0.09 0.00 0.00 178.44 178.29 2b3w h MET 150 N 0.88 0.31 -0.19 1.13 2.86 -0.48 0.95 114.93 120.38 2b3w h MET 150 Ca 0.23 -0.40 0.01 0.00 -2.06 0.00 0.00 59.70 57.47 2b3w h MET 150 Cb 0.02 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2b3w h MET 150 CO -0.04 1.12 0.11 0.93 1.06 0.00 0.00 176.91 180.09 2b3w h GLU 151 N 0.14 0.23 -0.55 1.72 4.39 -0.05 -1.85 114.58 118.61 2b3w h GLU 151 Ca -0.09 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.53 2b3w h GLU 151 Cb 1.72 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 30.29 2b3w h GLU 151 CO 0.17 0.15 0.08 1.25 -1.16 0.00 0.00 179.01 179.50 2b3w h LEU 152 N 0.23 0.83 -0.82 1.33 5.85 -0.54 -2.09 115.31 120.11 2b3w h LEU 152 Ca 0.07 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2b3w h LEU 152 Cb -0.01 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 2b3w h LEU 152 CO -0.03 0.85 0.48 -0.09 -0.34 0.00 0.00 178.44 179.31 2b3w h ARG 153 N 0.83 1.12 -0.22 1.25 2.43 -0.52 0.20 114.38 119.47 2b3w h ARG 153 Ca 0.17 -0.11 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 2b3w h ARG 153 Cb 0.38 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2b3w h ARG 153 CO 0.01 0.79 -0.27 0.93 -1.51 0.00 0.00 179.97 179.93 2b3w h GLU 154 N 1.12 0.41 0.24 0.20 4.39 -1.07 -1.86 114.58 118.01 2b3w h GLU 154 Ca 0.29 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2b3w h GLU 154 Cb -0.03 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2b3w h GLU 154 CO -0.05 0.65 -0.11 0.37 -1.16 0.00 0.00 179.01 178.70 2b3w h GLN 155 N 0.37 -0.31 0.00 2.33 5.75 -0.58 -3.15 115.11 119.52 2b3w h GLN 155 Ca 0.05 0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 2b3w h GLN 155 Cb 0.66 0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.28 2b3w h GLN 155 CO 0.05 -0.02 -0.14 -0.07 -2.65 0.00 0.00 178.83 175.99 2b3w h LEU 156 N -0.59 0.00 -0.09 -2.39 3.38 -0.61 -2.94 115.31 112.08 2b3w h LEU 156 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2b3w h LEU 156 Cb 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2b3w h LEU 156 CO 0.05 0.14 0.02 0.00 0.09 0.00 0.00 178.44 178.75 2b3w h ALA 157 N 1.86 0.11 -0.51 1.53 0.00 -1.30 -2.07 119.26 118.88 2b3w h ALA 157 Ca -0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 2b3w h ALA 157 Cb 0.51 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2b3w h ALA 157 CO 0.02 -0.26 0.02 0.82 0.00 0.00 0.00 179.25 179.85 2b3w h ILE 158 N -0.06 1.24 0.00 0.00 5.03 -1.50 -1.75 117.51 120.47 2b3w h ILE 158 Ca 0.03 -0.99 -0.02 0.00 -0.12 0.00 0.00 64.86 63.75 2b3w h ILE 158 Cb 0.24 0.83 -0.00 0.00 -3.03 0.00 0.00 36.82 34.85 2b3w h ILE 158 CO -0.00 0.36 -0.12 -0.33 -0.68 0.00 0.00 178.15 177.38 2b3w h GLU 159 N 0.79 0.00 0.00 2.37 5.08 -1.46 -0.45 114.58 120.91 2b3w h GLU 159 Ca 0.16 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.46 2b3w h GLU 159 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2b3w h GLU 159 CO 0.02 0.12 -0.27 -0.22 -1.00 0.00 0.00 179.01 177.65 2b3w h LYS 160 N 0.00 0.00 0.10 2.33 3.64 -0.58 -2.15 116.57 119.91 2b3w h LYS 160 Ca -0.00 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.11 2b3w h LYS 160 Cb 0.38 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2b3w h LYS 160 CO 0.02 0.27 -1.17 -0.07 -2.27 0.00 0.00 179.45 176.23 2b3w h LEU 161 N 0.00 0.50 -0.76 5.20 4.07 -1.05 -3.23 115.31 120.05 2b3w h LEU 161 Ca -0.00 -0.49 0.00 0.00 0.08 0.00 0.00 57.88 57.47 2b3w h LEU 161 Cb 0.62 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.20 2b3w h LEU 161 CO 0.04 1.35 0.00 -0.62 -1.08 0.00 0.00 178.44 178.12 2b3w n GLU 162 N -3.62 1.46 0.19 1.13 1.02 -0.94 -4.01 120.64 115.88 2b3w n GLU 162 Ca -0.09 -0.61 0.14 0.00 -0.02 0.00 0.00 57.16 56.58 2b3w n GLU 162 Cb 0.97 -1.21 0.68 0.00 -0.02 0.00 0.00 31.44 31.86 2b3w n GLU 162 CO 0.00 0.00 0.00 1.12 1.18 0.00 0.00 177.13 179.43 2b3w h HIS 163 N 0.96 0.00 -2.12 -0.32 2.07 -1.42 -3.36 115.15 110.95 2b3w h HIS 163 Ca 0.00 0.00 -0.58 0.00 -2.85 0.00 0.00 60.37 56.94 2b3w h HIS 163 Cb 0.32 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.30 2b3w h HIS 163 CO 0.13 0.00 1.42 -1.58 -3.07 0.00 0.00 177.93 174.83 2b3w s HIS 164 N -3.61 1.24 -2.04 6.12 5.65 -1.26 -1.42 115.29 119.97 2b3w s HIS 164 Ca -0.01 0.35 0.00 0.00 0.25 0.00 0.00 55.06 55.65 2b3w s HIS 164 Cb 0.08 -4.00 0.00 0.00 -1.18 0.00 0.00 32.58 27.48 2b3w s HIS 164 CO 0.30 -4.28 0.00 1.58 -0.65 0.00 0.00 174.74 171.69 2b3w n HIS 165 N 10.75 -0.42 0.16 3.88 -0.00 -1.26 -4.84 115.22 123.50 2b3w n HIS 165 Ca 0.27 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 58.03 2b3w n HIS 165 Cb 0.44 -3.70 0.18 0.00 -0.00 0.00 0.00 29.99 26.91 2b3w n HIS 165 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2b3w h HIS 166 N 0.00 0.00 -2.07 1.57 2.76 -1.39 -3.38 115.15 112.64 2b3w h HIS 166 Ca -0.46 0.00 -0.38 0.00 -2.20 0.00 0.00 60.37 57.34 2b3w h HIS 166 Cb 1.37 0.00 -0.32 0.00 1.55 0.00 0.00 27.41 30.00 2b3w h HIS 166 CO 0.58 0.45 -0.69 -1.58 -1.30 0.00 0.00 177.93 175.39 2b3w s HIS 167 N -3.26 -0.25 0.00 5.26 2.46 -1.26 -5.09 115.29 113.14 2b3w s HIS 167 Ca 0.02 -0.70 0.00 0.00 0.47 0.00 0.00 55.06 54.85 2b3w s HIS 167 Cb 0.09 -0.47 0.00 0.00 -0.13 0.00 0.00 32.58 32.07 2b3w s HIS 167 CO 0.72 -0.94 0.00 1.58 -2.47 0.00 0.00 174.74 173.62