#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3w s PRO 2 N 0.00 3.21 0.00 0.03 0.02 -1.26 -4.66 135.00 132.34 2b3w s PRO 2 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 61.00 61.00 2b3w s PRO 2 Cb 0.00 -4.16 0.00 0.00 0.02 0.00 0.00 34.50 30.36 2b3w s PRO 2 CO 0.00 -2.10 0.00 1.55 -0.33 0.00 0.00 177.00 176.12 2b3w n VAL 3 N 6.54 0.00 0.00 3.83 3.14 -1.26 -5.06 118.33 125.53 2b3w n VAL 3 Ca 0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.44 2b3w n VAL 3 Cb 0.49 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.90 2b3w n VAL 3 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2b3w n ARG 4 N -1.70 0.00 -2.64 1.45 1.74 -1.26 -4.84 116.66 109.41 2b3w n ARG 4 Ca 0.00 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2b3w n ARG 4 Cb 0.26 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.70 2b3w n ARG 4 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2b3w n ALA 5 N 1.17 -3.49 -1.93 7.54 0.00 -1.26 -4.86 120.51 117.67 2b3w n ALA 5 Ca 0.00 0.62 -0.42 0.00 0.00 0.00 0.00 53.44 53.63 2b3w n ALA 5 Cb 0.00 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.19 2b3w n ALA 5 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2b3w s GLN 6 N -1.48 3.23 -0.40 0.00 -1.52 -1.26 -4.95 119.66 113.27 2b3w s GLN 6 Ca -0.02 1.46 -0.26 0.00 -1.95 0.00 0.00 55.36 54.59 2b3w s GLN 6 Cb 0.00 -4.24 0.02 0.00 -0.22 0.00 0.00 33.01 28.57 2b3w s GLN 6 CO 0.75 -1.99 0.95 -0.98 -0.25 0.00 0.00 175.29 173.77 2b3w s ARG 7 N 5.91 3.76 0.30 2.91 1.70 -1.26 -4.91 118.95 127.37 2b3w s ARG 7 Ca 0.82 0.50 0.15 0.00 -0.47 0.00 0.00 55.73 56.73 2b3w s ARG 7 Cb -0.23 -3.84 0.31 0.00 -0.57 0.00 0.00 34.95 30.62 2b3w s ARG 7 CO 0.33 -1.05 1.56 0.97 -1.08 0.00 0.00 175.30 176.02 2b3w h ILE 8 N 5.92 1.01 -4.95 4.99 2.10 -1.97 -3.49 117.51 121.13 2b3w h ILE 8 Ca -0.23 -2.07 0.00 0.00 1.08 0.00 0.00 64.86 63.64 2b3w h ILE 8 Cb 1.08 2.25 0.00 0.00 -1.09 0.00 0.00 36.82 39.06 2b3w h ILE 8 CO 1.01 0.51 -0.46 1.67 -1.08 0.00 0.00 178.15 179.79 2b3w n GLN 9 N -3.40 -2.12 -0.93 2.19 7.27 -1.26 -4.89 117.38 114.23 2b3w n GLN 9 Ca 0.01 1.94 0.13 0.00 0.07 0.00 0.00 57.00 59.15 2b3w n GLN 9 Cb 0.66 -5.07 -0.03 0.00 2.41 0.00 0.00 30.24 28.21 2b3w n GLN 9 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2b3w n HIS 10 N -0.26 -3.05 -4.25 3.69 8.25 -1.26 -5.01 115.22 113.33 2b3w n HIS 10 Ca 0.10 1.16 -0.12 0.00 -0.26 0.00 0.00 57.72 58.60 2b3w n HIS 10 Cb 0.36 -2.14 -0.03 0.00 1.12 0.00 0.00 29.99 29.30 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 -3.11 0.00 0.00 1.59 0.24 -1.26 -4.99 118.33 110.80 2b3w n VAL 11 Ca 0.01 -1.10 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 2b3w n VAL 11 Cb 0.43 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 33.17 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 -0.45 0.00 -3.31 7.34 0.00 -1.26 -5.04 117.12 114.40 2b3w n MET 12 Ca -0.04 0.09 0.03 0.00 0.00 0.00 0.00 57.70 57.78 2b3w n MET 12 Cb 0.29 -0.44 -0.04 0.00 0.00 0.00 0.00 33.22 33.02 2b3w n MET 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 2b3w s GLN 13 N -0.57 0.11 -1.51 0.03 0.74 -1.26 -4.95 119.66 112.24 2b3w s GLN 13 Ca 0.00 0.25 -0.13 0.00 0.05 0.00 0.00 55.36 55.53 2b3w s GLN 13 Cb 0.00 0.13 0.07 0.00 1.10 0.00 0.00 33.01 34.32 2b3w s GLN 13 CO 0.00 -0.03 1.02 -3.47 -0.55 0.00 0.00 175.29 172.25 2b3w n ASP 14 N 4.40 -5.11 -4.76 6.67 2.03 -1.26 -4.93 116.55 113.60 2b3w n ASP 14 Ca -0.09 -0.74 -0.40 0.00 0.52 0.00 0.00 54.79 54.09 2b3w n ASP 14 Cb 0.55 -4.06 -0.05 0.00 -0.72 0.00 0.00 41.12 36.84 2b3w n ASP 14 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2b3w s THR 15 N -3.30 3.71 -0.19 5.18 2.01 -1.26 -4.85 115.64 116.94 2b3w s THR 15 Ca 0.66 1.67 -0.01 0.00 0.31 0.00 0.00 61.69 64.32 2b3w s THR 15 Cb -0.32 -4.05 0.00 0.00 0.01 0.00 0.00 72.50 68.14 2b3w s THR 15 CO 0.81 0.36 -0.12 -0.63 -0.69 0.00 0.00 174.62 174.35 2b3w s ILE 16 N -1.23 2.78 -0.37 1.82 1.01 -1.26 0.28 121.20 124.23 2b3w s ILE 16 Ca 0.45 -0.71 -0.11 0.00 0.00 0.00 0.00 60.65 60.28 2b3w s ILE 16 Cb -0.29 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 39.99 2b3w s ILE 16 CO 0.37 0.49 0.21 -0.63 0.00 0.00 0.00 174.94 175.37 2b3w s ILE 17 N 1.23 4.66 -0.63 2.92 1.01 0.44 -4.94 121.20 125.89 2b3w s ILE 17 Ca 0.03 -0.77 -0.23 0.00 0.00 0.00 0.00 60.65 59.68 2b3w s ILE 17 Cb -0.14 -3.57 0.06 0.00 0.01 0.00 0.00 42.46 38.82 2b3w s ILE 17 CO -0.06 -0.20 0.95 0.20 0.00 0.00 0.00 174.94 175.84 2b3w s ASN 18 N 1.58 6.21 -0.21 3.58 0.02 -1.24 -0.92 114.94 123.96 2b3w s ASN 18 Ca 0.03 -0.86 -0.09 0.00 -1.02 0.00 0.00 52.86 50.92 2b3w s ASN 18 Cb -0.19 -2.42 -0.05 0.00 0.02 0.00 0.00 41.25 38.62 2b3w s ASN 18 CO 0.07 -1.38 0.12 0.72 0.02 0.00 0.00 177.10 176.64 2b3w s PHE 19 N 4.01 3.33 0.34 2.20 -0.12 -0.83 -4.80 117.98 122.12 2b3w s PHE 19 Ca 0.24 0.21 -0.04 0.00 -0.05 0.00 0.00 56.93 57.29 2b3w s PHE 19 Cb -0.16 -2.16 0.02 0.00 -0.63 0.00 0.00 43.02 40.08 2b3w s PHE 19 CO 0.12 0.18 0.51 0.98 -0.05 0.00 0.00 175.22 176.97 2b3w n TYR 20 N 3.74 -1.56 -2.06 3.49 9.36 -1.26 -3.11 117.16 125.76 2b3w n TYR 20 Ca -0.16 -2.16 -0.02 0.00 3.32 0.00 0.00 57.90 58.88 2b3w n TYR 20 Cb 0.52 0.59 0.00 0.00 -0.63 0.00 0.00 39.34 39.82 2b3w n TYR 20 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 2b3w n SER 21 N -1.62 -4.62 0.00 2.98 7.64 -1.26 -3.54 113.62 113.20 2b3w n SER 21 Ca -0.01 0.43 0.12 0.00 1.01 0.00 0.00 58.87 60.42 2b3w n SER 21 Cb 0.56 -2.91 0.53 0.00 -1.01 0.00 0.00 64.21 61.38 2b3w n SER 21 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2b3w n THR 22 N -0.07 0.30 0.63 0.44 -2.24 -1.26 -2.60 114.28 109.48 2b3w n THR 22 Ca 0.03 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 2b3w n THR 22 Cb 0.10 -0.65 0.18 0.00 -2.10 0.00 0.00 70.33 67.87 2b3w n THR 22 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2b3w n SER 23 N -1.49 3.20 0.00 3.42 7.64 -1.26 -4.69 113.62 120.45 2b3w n SER 23 Ca 0.06 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.96 2b3w n SER 23 Cb 0.28 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 2b3w n SER 23 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2b3w n ASP 24 N 1.38 0.00 0.00 6.43 2.03 -1.07 -5.08 116.55 120.24 2b3w n ASP 24 Ca 0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.48 2b3w n ASP 24 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 2b3w n ASP 24 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2b3w n ASP 25 N -0.60 0.00 -0.10 1.67 5.75 -1.26 -4.95 116.55 117.05 2b3w n ASP 25 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 54.79 54.92 2b3w n ASP 25 Cb 0.00 0.14 0.62 0.00 -1.03 0.00 0.00 41.12 40.85 2b3w n ASP 25 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b3w n TYR 26 N -1.76 0.00 1.88 2.11 9.36 -1.26 -3.02 117.16 124.47 2b3w n TYR 26 Ca 0.00 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.37 2b3w n TYR 26 Cb 0.00 -0.19 0.90 0.00 -0.63 0.00 0.00 39.34 39.42 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 1.28 -0.97 0.42 2.98 0.00 -1.20 -4.06 105.19 103.64 2b3w n GLY 27 Ca 0.14 -0.19 0.23 0.00 0.00 0.00 0.00 46.02 46.20 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 0.28 0.00 1.61 3.58 -1.79 -1.22 116.42 118.88 2b3w h ASP 28 Ca 0.00 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2b3w h ASP 28 Cb 0.01 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2b3w h ASP 28 CO 0.00 0.10 0.14 -0.26 -2.88 0.00 0.00 179.24 176.34 2b3w h PHE 29 N 0.27 0.00 -4.01 0.28 -1.00 -1.89 -3.42 116.94 107.17 2b3w h PHE 29 Ca 0.47 0.00 -0.48 0.00 2.81 0.00 0.00 57.97 60.78 2b3w h PHE 29 Cb 1.39 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.97 2b3w h PHE 29 CO -0.00 0.00 0.40 0.45 -1.61 0.00 0.00 178.31 177.55 2b3w s SER 30 N -4.64 6.62 0.00 2.17 0.15 -0.46 -4.93 113.70 112.61 2b3w s SER 30 Ca -0.04 1.98 0.19 0.00 0.70 0.00 0.00 55.95 58.78 2b3w s SER 30 Cb 0.10 -2.57 0.82 0.00 -1.71 0.00 0.00 66.02 62.66 2b3w s SER 30 CO 0.32 -0.59 1.62 -0.46 1.20 0.00 0.00 173.24 175.32 2b3w n ASN 31 N -0.43 0.00 -0.67 5.45 0.23 -1.26 -2.21 115.26 116.38 2b3w n ASN 31 Ca 0.07 0.50 0.07 0.00 -0.53 0.00 0.00 54.58 54.69 2b3w n ASN 31 Cb 0.51 -0.50 0.23 0.00 -2.08 0.00 0.00 39.78 37.93 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 -1.50 0.42 -2.18 -2.53 7.35 -1.26 -2.81 117.46 114.95 2b3w n PHE 32 Ca 0.05 -0.21 -0.41 0.00 -0.76 0.00 0.00 57.45 56.12 2b3w n PHE 32 Cb 0.23 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.03 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 -1.58 3.49 -1.17 3.13 0.00 -0.94 -4.90 121.76 119.79 2b3w s ALA 33 Ca 0.27 1.19 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 2b3w s ALA 33 Cb 0.14 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 2b3w s ALA 33 CO 0.20 -0.55 2.98 0.00 0.00 0.00 0.00 175.76 178.38 2b3w n ALA 34 N 1.11 7.13 -3.97 0.00 0.00 -1.26 -4.47 120.51 119.05 2b3w n ALA 34 Ca 0.01 -3.27 -0.33 0.00 0.00 0.00 0.00 53.44 49.85 2b3w n ALA 34 Cb 0.42 -2.97 -0.15 0.00 0.00 0.00 0.00 19.45 16.75 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 1.04 3.00 0.32 0.00 0.52 -1.24 -5.00 118.94 117.58 2b3w s TRP 35 Ca 0.66 -1.78 -0.29 0.00 0.02 0.00 0.00 56.10 54.70 2b3w s TRP 35 Cb 0.22 -1.97 -0.11 0.00 -1.15 0.00 0.00 33.47 30.46 2b3w s TRP 35 CO -0.07 -0.80 1.56 -1.25 0.02 0.00 0.00 176.95 176.42 2b3w s PRO 36 N 1.26 4.12 0.45 4.98 0.04 -1.06 -4.25 135.00 140.54 2b3w s PRO 36 Ca -0.00 2.58 0.03 0.00 0.04 0.00 0.00 61.00 63.65 2b3w s PRO 36 Cb -0.16 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 2b3w s PRO 36 CO -0.08 -0.60 0.05 0.96 0.04 0.00 0.00 177.00 177.36 2b3w s ILE 37 N -0.34 1.10 -0.31 0.56 -4.36 0.11 -4.94 121.20 113.02 2b3w s ILE 37 Ca 0.60 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.98 2b3w s ILE 37 Cb -0.47 -2.38 0.10 0.00 1.25 0.00 0.00 42.46 40.95 2b3w s ILE 37 CO 0.53 0.00 0.09 -0.75 0.24 0.00 0.00 174.94 175.05 2b3w s LYS 38 N -3.81 0.75 -0.10 0.37 2.47 -1.26 -0.43 119.74 117.73 2b3w s LYS 38 Ca 0.18 -1.09 0.03 0.00 -1.56 0.00 0.00 55.97 53.53 2b3w s LYS 38 Cb 0.04 -2.05 -0.00 0.00 -1.46 0.00 0.00 37.83 34.35 2b3w s LYS 38 CO 0.10 -0.97 -0.22 0.08 0.16 0.00 0.00 175.35 174.49 2b3w s VAL 39 N 1.59 2.23 0.00 4.02 1.01 0.63 -4.60 120.40 125.27 2b3w s VAL 39 Ca 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2b3w s VAL 39 Cb -0.17 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.34 2b3w s VAL 39 CO -0.24 0.55 0.00 0.47 0.00 0.00 0.00 175.10 175.89 2b3w n ASP 40 N 3.51 -5.31 0.00 3.32 8.00 -1.26 -0.93 116.55 123.88 2b3w n ASP 40 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 2b3w n ASP 40 Cb 0.53 -3.03 0.00 0.00 -0.02 0.00 0.00 41.12 38.59 2b3w n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b3w n GLY 41 N 0.32 0.82 3.35 0.44 0.00 -1.26 -5.10 105.19 103.77 2b3w n GLY 41 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.75 1.66 0.05 1.61 1.02 -0.11 -5.11 119.74 118.10 2b3w s LYS 42 Ca 0.00 -1.18 -0.30 0.00 0.02 0.00 0.00 55.97 54.51 2b3w s LYS 42 Cb 0.00 -1.93 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 2b3w s LYS 42 CO 0.00 0.49 1.00 0.99 -0.92 0.00 0.00 175.35 176.91 2b3w s THR 43 N -0.89 4.62 -0.04 2.17 2.01 -1.26 -0.27 115.64 121.99 2b3w s THR 43 Ca 0.12 1.98 0.06 0.00 0.31 0.00 0.00 61.69 64.16 2b3w s THR 43 Cb -0.10 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.13 2b3w s THR 43 CO 0.03 0.21 -0.22 0.26 -0.69 0.00 0.00 174.62 174.21 2b3w s TRP 44 N 0.65 2.10 0.35 4.92 0.52 0.43 -4.95 118.94 122.96 2b3w s TRP 44 Ca 0.51 -0.53 0.05 0.00 0.02 0.00 0.00 56.10 56.16 2b3w s TRP 44 Cb -0.23 -1.37 0.72 0.00 -1.15 0.00 0.00 33.47 31.44 2b3w s TRP 44 CO 0.29 -0.13 1.95 -1.35 0.02 0.00 0.00 176.95 177.73 2b3w h PRO 45 N 5.90 0.76 -4.02 4.98 0.11 -1.89 0.32 132.00 138.16 2b3w h PRO 45 Ca -0.36 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.52 2b3w h PRO 45 Cb 1.16 -0.17 -0.09 0.00 0.11 0.00 0.00 31.00 32.00 2b3w h PRO 45 CO 0.47 0.50 -0.23 0.95 -0.21 0.00 0.00 178.00 179.49 2b3w s THR 46 N -5.70 0.00 0.21 -1.15 -4.23 -1.26 -2.55 115.64 100.97 2b3w s THR 46 Ca -0.10 -1.59 0.13 0.00 -1.18 0.00 0.00 61.69 58.95 2b3w s THR 46 Cb 0.19 -2.47 0.03 0.00 1.34 0.00 0.00 72.50 71.60 2b3w s THR 46 CO 0.78 0.00 1.64 0.28 -0.54 0.00 0.00 174.62 176.77 2b3w h SER 47 N 2.24 0.00 -0.12 3.99 0.02 -1.78 -3.16 113.55 114.73 2b3w h SER 47 Ca -0.29 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.54 2b3w h SER 47 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 2b3w h SER 47 CO 0.40 0.54 -0.31 -0.08 -1.14 0.00 0.00 176.83 176.23 2b3w h GLU 48 N 0.00 0.61 -0.55 3.45 4.22 -1.87 -2.56 114.58 117.89 2b3w h GLU 48 Ca -0.01 -0.27 -0.03 0.00 0.08 0.00 0.00 59.36 59.13 2b3w h GLU 48 Cb 1.06 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.27 2b3w h GLU 48 CO 0.07 0.85 0.22 0.45 -2.18 0.00 0.00 179.01 178.42 2b3w h HIS 49 N 0.52 0.79 -0.17 0.92 3.86 -1.88 0.11 115.15 119.30 2b3w h HIS 49 Ca 0.06 -0.04 -0.19 0.00 -1.16 0.00 0.00 60.37 59.04 2b3w h HIS 49 Cb 0.80 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.03 2b3w h HIS 49 CO 0.03 0.61 -0.67 -0.92 0.86 0.00 0.00 177.93 177.84 2b3w h TYR 50 N 0.78 0.86 -0.20 2.45 3.20 -1.62 -1.72 116.97 120.73 2b3w h TYR 50 Ca 0.19 -0.35 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 2b3w h TYR 50 Cb 0.15 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 2b3w h TYR 50 CO 0.01 1.14 0.10 0.35 -1.64 0.00 0.00 178.16 178.12 2b3w h PHE 51 N 0.47 0.29 -0.36 -3.82 3.57 -0.93 -0.49 116.94 115.68 2b3w h PHE 51 Ca -0.02 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2b3w h PHE 51 Cb 1.27 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 2b3w h PHE 51 CO 0.06 0.30 0.08 1.96 -2.23 0.00 0.00 178.31 178.49 2b3w h GLN 52 N 0.20 0.59 -0.64 1.11 1.08 -0.84 -2.21 115.11 114.40 2b3w h GLN 52 Ca 0.07 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2b3w h GLN 52 Cb 0.12 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 2b3w h GLN 52 CO -0.01 0.63 0.40 0.00 -0.95 0.00 0.00 178.83 178.91 2b3w h ALA 53 N 0.93 1.50 0.00 3.87 0.00 -1.17 -1.32 119.26 123.07 2b3w h ALA 53 Ca 0.11 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2b3w h ALA 53 Cb 0.32 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2b3w h ALA 53 CO 0.00 0.45 -0.53 0.37 0.00 0.00 0.00 179.25 179.54 2b3w h GLN 54 N 0.88 0.00 -0.43 0.00 5.75 -0.85 -2.93 115.11 117.53 2b3w h GLN 54 Ca 0.23 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.68 2b3w h GLN 54 Cb -0.06 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 2b3w h GLN 54 CO -0.05 0.53 0.06 -0.22 -2.65 0.00 0.00 178.83 176.50 2b3w h LYS 55 N 0.00 0.71 -6.48 1.69 3.64 -0.63 -3.41 116.57 112.08 2b3w h LYS 55 Ca -0.01 -0.20 -0.57 0.00 -1.27 0.00 0.00 60.65 58.61 2b3w h LYS 55 Cb 0.97 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.66 2b3w h LYS 55 CO 0.07 0.75 1.11 -0.06 -2.27 0.00 0.00 179.45 179.06 2b3w s PHE 56 N -5.16 2.28 -0.15 1.91 0.08 -0.88 -4.48 117.98 111.58 2b3w s PHE 56 Ca -0.13 0.66 0.00 0.00 0.12 0.00 0.00 56.93 57.58 2b3w s PHE 56 Cb 0.10 -4.28 0.15 0.00 -0.57 0.00 0.00 43.02 38.42 2b3w s PHE 56 CO 0.79 -2.17 1.60 1.28 -0.10 0.00 0.00 175.22 176.61 2b3w n LEU 57 N 9.14 4.91 -4.14 -0.37 4.32 -0.81 -4.73 117.00 125.31 2b3w n LEU 57 Ca 0.18 -2.45 -0.34 0.00 -0.02 0.00 0.00 56.01 53.38 2b3w n LEU 57 Cb 0.48 -0.82 -0.14 0.00 -1.62 0.00 0.00 43.42 41.32 2b3w n LEU 57 CO 0.70 0.87 -0.40 -0.62 -1.22 0.00 0.00 177.39 176.72 2b3w s ASP 58 N 0.66 4.62 0.10 -1.43 -1.08 -1.26 -4.91 116.67 113.38 2b3w s ASP 58 Ca 0.16 -1.24 -0.30 0.00 -0.52 0.00 0.00 52.55 50.66 2b3w s ASP 58 Cb 0.13 -1.65 -0.11 0.00 -1.46 0.00 0.00 42.92 39.84 2b3w s ASP 58 CO 0.01 -0.21 1.61 -0.08 0.52 0.00 0.00 175.17 177.03 2b3w h GLU 59 N 7.93 -0.61 0.00 4.34 4.81 -1.99 0.30 114.58 129.35 2b3w h GLU 59 Ca -0.23 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 58.96 2b3w h GLU 59 Cb 1.06 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 2b3w h GLU 59 CO 0.52 -0.41 -0.40 0.87 -0.73 0.00 0.00 179.01 178.86 2b3w h LYS 60 N -0.63 0.00 -0.07 1.92 6.56 -1.98 -2.08 116.57 120.28 2b3w h LYS 60 Ca 0.00 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 59.37 2b3w h LYS 60 Cb 0.62 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.28 2b3w h LYS 60 CO -0.13 0.40 -0.86 -0.92 -2.06 0.00 0.00 179.45 175.87 2b3w h TYR 61 N 0.00 0.85 -0.83 -1.35 5.03 -1.85 -1.00 116.97 117.82 2b3w h TYR 61 Ca -0.00 -0.41 -0.02 0.00 2.58 0.00 0.00 58.73 60.87 2b3w h TYR 61 Cb 0.93 -0.12 -0.04 0.00 1.55 0.00 0.00 36.73 39.05 2b3w h TYR 61 CO 0.00 1.23 0.44 -0.09 -1.32 0.00 0.00 178.16 178.42 2b3w h ARG 62 N 0.38 1.16 -0.83 1.82 2.43 -0.17 0.18 114.38 119.35 2b3w h ARG 62 Ca -0.07 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 58.92 2b3w h ARG 62 Cb 1.48 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.77 2b3w h ARG 62 CO 0.16 0.86 0.40 1.49 -1.51 0.00 0.00 179.97 181.37 2b3w h GLU 63 N 1.16 1.20 -0.59 0.20 4.81 -1.31 -2.48 114.58 117.57 2b3w h GLU 63 Ca 0.29 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2b3w h GLU 63 Cb 0.05 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2b3w h GLU 63 CO -0.04 0.92 0.13 1.49 -0.73 0.00 0.00 179.01 180.77 2b3w h GLU 64 N 1.19 0.92 -0.35 1.92 4.81 -0.17 -1.03 114.58 121.87 2b3w h GLU 64 Ca 0.29 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 2b3w h GLU 64 Cb 0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2b3w h GLU 64 CO -0.04 0.83 -0.09 0.82 -0.73 0.00 0.00 179.01 179.81 2b3w h ILE 65 N 0.88 1.23 0.00 2.32 1.08 -0.26 -0.96 117.51 121.80 2b3w h ILE 65 Ca 0.19 -1.01 -0.04 0.00 -0.39 0.00 0.00 64.86 63.61 2b3w h ILE 65 Cb 0.34 1.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.15 2b3w h ILE 65 CO 0.00 0.34 -0.21 -0.09 -0.69 0.00 0.00 178.15 177.50 2b3w h ARG 66 N 0.54 0.00 0.00 2.37 1.12 -1.14 -3.19 114.38 114.09 2b3w h ARG 66 Ca 0.10 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.97 2b3w h ARG 66 Cb 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.44 2b3w h ARG 66 CO 0.03 0.21 0.00 -0.09 -3.11 0.00 0.00 179.97 177.00 2b3w h ARG 67 N 0.00 0.00 -5.67 0.20 2.43 0.12 -3.43 114.38 108.03 2b3w h ARG 67 Ca -0.00 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 58.58 2b3w h ARG 67 Cb 1.01 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.48 2b3w h ARG 67 CO 0.03 0.00 -0.22 0.14 -1.51 0.00 0.00 179.97 178.41 2b3w s VAL 68 N -3.22 5.22 -0.36 0.20 -7.23 -0.73 -4.95 120.40 109.34 2b3w s VAL 68 Ca 0.07 0.78 0.23 0.00 -1.81 0.00 0.00 61.98 61.25 2b3w s VAL 68 Cb 0.07 -3.73 0.07 0.00 0.56 0.00 0.00 36.38 33.34 2b3w s VAL 68 CO 0.64 0.38 1.20 0.77 -0.31 0.00 0.00 175.10 177.78 2b3w h SER 69 N 6.49 0.00 -3.25 4.85 4.64 -1.87 -3.46 113.55 120.95 2b3w h SER 69 Ca -0.42 -0.04 -0.56 0.00 -0.47 0.00 0.00 61.79 60.29 2b3w h SER 69 Cb 1.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 2b3w h SER 69 CO 0.74 0.02 0.56 -0.55 -0.87 0.00 0.00 176.83 176.73 2b3w s SER 70 N -5.25 7.17 0.16 4.97 0.15 -1.26 -4.94 113.70 114.70 2b3w s SER 70 Ca 0.02 1.44 -0.10 0.00 0.70 0.00 0.00 55.95 58.02 2b3w s SER 70 Cb 0.10 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.89 2b3w s SER 70 CO 0.75 -0.46 1.56 -0.65 1.20 0.00 0.00 173.24 175.64 2b3w h PRO 71 N 7.18 0.99 -0.35 5.44 0.11 -1.97 -3.01 132.00 140.39 2b3w h PRO 71 Ca -0.29 -0.42 -0.07 0.00 0.11 0.00 0.00 66.00 65.32 2b3w h PRO 71 Cb 1.13 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2b3w h PRO 71 CO 0.87 1.10 -0.09 1.98 -0.21 0.00 0.00 178.00 181.64 2b3w h MET 72 N 0.86 0.59 -0.33 1.05 4.05 -1.98 0.32 114.93 119.49 2b3w h MET 72 Ca 0.11 -0.17 -0.07 0.00 -0.28 0.00 0.00 59.70 59.29 2b3w h MET 72 Cb 0.79 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 2b3w h MET 72 CO 0.07 0.68 -0.05 0.28 0.23 0.00 0.00 176.91 178.12 2b3w h VAL 73 N 0.55 1.27 -0.54 -5.77 2.07 -1.97 -1.08 116.25 110.78 2b3w h VAL 73 Ca 0.10 -1.07 -0.12 0.00 0.82 0.00 0.00 66.70 66.43 2b3w h VAL 73 Cb 0.49 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2b3w h VAL 73 CO 0.03 0.35 -0.13 0.00 0.02 0.00 0.00 177.57 177.84 2b3w h ALA 74 N 0.82 0.74 -0.70 1.67 0.00 -1.32 -0.61 119.26 119.87 2b3w h ALA 74 Ca 0.09 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2b3w h ALA 74 Cb 0.53 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2b3w h ALA 74 CO 0.03 0.67 0.35 0.00 0.00 0.00 0.00 179.25 180.31 2b3w h ALA 75 N 0.92 1.31 -0.59 0.00 0.00 -0.91 -0.71 119.26 119.28 2b3w h ALA 75 Ca 0.14 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2b3w h ALA 75 Cb 0.70 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2b3w h ALA 75 CO 0.05 0.55 0.13 -0.09 0.00 0.00 0.00 179.25 179.89 2b3w h ARG 76 N 0.98 0.92 0.72 0.00 2.43 -0.62 0.13 114.38 118.94 2b3w h ARG 76 Ca 0.24 -0.20 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 2b3w h ARG 76 Cb 0.07 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2b3w h ARG 76 CO -0.03 0.83 -0.34 0.52 -1.51 0.00 0.00 179.97 179.43 2b3w h MET 77 N 0.88 -0.93 -0.01 0.20 2.86 -0.36 -3.05 114.93 114.54 2b3w h MET 77 Ca 0.19 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2b3w h MET 77 Cb 0.33 0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.20 2b3w h MET 77 CO 0.00 -0.61 0.00 0.41 1.06 0.00 0.00 176.91 177.77 2b3w n GLY 78 N -1.46 -0.94 0.21 8.32 0.00 -0.34 -2.66 105.19 108.31 2b3w n GLY 78 Ca -0.14 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.85 2b3w n GLY 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2b3w h ARG 79 N 0.12 0.00 -7.66 1.61 9.65 -0.62 -3.46 114.38 114.01 2b3w h ARG 79 Ca 0.00 0.00 -0.46 0.00 -1.10 0.00 0.00 59.98 58.42 2b3w h ARG 79 Cb 0.03 0.00 0.13 0.00 -1.39 0.00 0.00 29.97 28.73 2b3w h ARG 79 CO 0.00 0.00 0.39 0.34 2.80 0.00 0.00 179.97 183.50 2b3w s ASP 80 N -6.05 3.87 0.00 -3.80 -1.08 -1.09 -5.01 116.67 103.51 2b3w s ASP 80 Ca 0.07 0.65 0.00 0.00 -0.52 0.00 0.00 52.55 52.75 2b3w s ASP 80 Cb 0.06 -1.01 0.00 0.00 -1.46 0.00 0.00 42.92 40.51 2b3w s ASP 80 CO 0.67 -2.29 0.23 -1.14 0.52 0.00 0.00 175.17 173.15 2b3w n ARG 81 N -3.55 -0.09 0.00 4.34 0.00 -1.26 -4.75 116.66 111.35 2b3w n ARG 81 Ca 0.10 -0.26 0.13 0.00 -0.00 0.00 0.00 57.85 57.83 2b3w n ARG 81 Cb 0.60 -0.65 0.45 0.00 0.00 0.00 0.00 32.46 32.87 2b3w n ARG 81 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2b3w n SER 82 N -0.02 0.81 -4.88 6.15 3.41 -1.26 -4.89 113.62 112.94 2b3w n SER 82 Ca 0.00 -0.74 -0.31 0.00 -0.26 0.00 0.00 58.87 57.56 2b3w n SER 82 Cb 0.22 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 2b3w n SER 82 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2b3w s LYS 83 N -2.52 3.79 -0.06 4.33 -0.14 -1.26 -5.00 119.74 118.88 2b3w s LYS 83 Ca 0.25 0.29 -0.32 0.00 -1.36 0.00 0.00 55.97 54.83 2b3w s LYS 83 Cb 0.19 -2.59 -0.10 0.00 -1.68 0.00 0.00 37.83 33.65 2b3w s LYS 83 CO 0.51 0.23 1.96 -0.35 -0.76 0.00 0.00 175.35 176.94 2b3w n PRO 84 N -0.47 2.41 -3.64 -1.68 -0.04 -1.26 -4.97 135.00 125.34 2b3w n PRO 84 Ca 0.01 0.87 -0.21 0.00 -0.04 0.00 0.00 63.50 64.12 2b3w n PRO 84 Cb 0.53 -2.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.13 2b3w n PRO 84 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2b3w s LEU 85 N 4.65 3.41 0.53 1.53 1.43 -1.26 -1.93 118.68 127.03 2b3w s LEU 85 Ca 0.92 -0.72 0.09 0.00 -1.03 0.00 0.00 54.13 53.40 2b3w s LEU 85 Cb -0.57 -2.05 0.06 0.00 0.03 0.00 0.00 46.19 43.66 2b3w s LEU 85 CO 0.47 -0.59 0.71 0.00 0.23 0.00 0.00 176.35 177.17 2b3w s ARG 86 N -4.09 2.46 0.00 1.70 1.70 -1.26 -4.90 118.95 114.57 2b3w s ARG 86 Ca 0.46 -1.53 -0.03 0.00 -0.47 0.00 0.00 55.73 54.17 2b3w s ARG 86 Cb -0.03 -2.67 -0.01 0.00 -0.57 0.00 0.00 34.95 31.67 2b3w s ARG 86 CO 0.27 -0.67 1.03 -0.22 -1.08 0.00 0.00 175.30 174.63 2b3w h LYS 87 N 0.33 -0.09 -1.08 3.89 3.64 -2.01 -3.20 116.57 118.05 2b3w h LYS 87 Ca -0.33 0.01 -0.54 0.00 -1.27 0.00 0.00 60.65 58.52 2b3w h LYS 87 Cb 1.29 0.02 -0.26 0.00 -0.41 0.00 0.00 32.23 32.87 2b3w h LYS 87 CO 0.42 -0.06 0.70 0.09 -2.27 0.00 0.00 179.45 178.33 2b3w n ASN 88 N -2.26 6.05 -0.10 4.20 4.13 -1.26 -4.59 115.26 121.43 2b3w n ASN 88 Ca -0.01 -3.53 0.06 0.00 1.68 0.00 0.00 54.58 52.77 2b3w n ASN 88 Cb 0.04 -0.93 0.39 0.00 -1.54 0.00 0.00 39.78 37.74 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 1.51 0.64 0.00 3.10 -0.00 -1.97 0.30 115.95 119.52 2b3w h TRP 89 Ca 0.54 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.45 2b3w h TRP 89 Cb 1.49 -0.21 0.00 0.00 -0.00 0.00 0.00 29.16 30.43 2b3w h TRP 89 CO 1.32 0.37 0.00 0.93 -0.00 0.00 0.00 178.44 181.06 2b3w h GLU 90 N 0.66 0.00 0.00 2.65 4.39 -1.86 -3.13 114.58 117.28 2b3w h GLU 90 Ca 0.24 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.55 2b3w h GLU 90 Cb 0.13 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.71 2b3w h GLU 90 CO -0.07 0.00 -2.44 0.43 -1.16 0.00 0.00 179.01 175.77 2b3w n SER 91 N -2.61 1.50 -0.32 1.42 7.64 -0.19 -4.46 113.62 116.60 2b3w n SER 91 Ca 0.03 -0.09 0.11 0.00 1.01 0.00 0.00 58.87 59.93 2b3w n SER 91 Cb 0.34 -0.08 0.52 0.00 -1.01 0.00 0.00 64.21 63.97 2b3w n SER 91 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2b3w n VAL 92 N -3.14 0.09 -0.17 0.44 0.24 -0.08 -4.05 118.33 111.66 2b3w n VAL 92 Ca -0.42 -0.19 -0.03 0.00 -2.04 0.00 0.00 64.34 61.66 2b3w n VAL 92 Cb 1.03 0.10 0.07 0.00 -1.47 0.00 0.00 33.84 33.57 2b3w n VAL 92 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2b3w h LYS 93 N 1.34 0.35 0.00 7.34 1.57 -1.76 -0.50 116.57 124.91 2b3w h LYS 93 Ca 0.00 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2b3w h LYS 93 Cb 0.29 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2b3w h LYS 93 CO 0.00 0.23 -0.22 1.05 -0.57 0.00 0.00 179.45 179.94 2b3w h GLU 94 N 0.36 0.00 -0.03 3.15 4.11 -1.91 -1.27 114.58 118.99 2b3w h GLU 94 Ca 0.25 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.52 2b3w h GLU 94 Cb 0.27 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.53 2b3w h GLU 94 CO -0.25 0.22 -0.59 0.37 0.07 0.00 0.00 179.01 178.83 2b3w h GLN 95 N 0.00 0.46 -0.25 1.06 4.15 -1.52 -2.21 115.11 116.80 2b3w h GLN 95 Ca -0.00 -0.45 -0.00 0.00 0.77 0.00 0.00 58.65 58.97 2b3w h GLN 95 Cb 0.57 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 2b3w h GLN 95 CO 0.03 1.10 0.15 0.28 -1.93 0.00 0.00 178.83 178.45 2b3w h VAL 96 N -0.01 1.10 -0.19 2.39 2.07 -0.72 -2.52 116.25 118.39 2b3w h VAL 96 Ca -0.06 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 2b3w h VAL 96 Cb 1.28 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2b3w h VAL 96 CO 0.12 0.10 -0.20 0.24 0.02 0.00 0.00 177.57 177.85 2b3w h MET 97 N 0.30 0.32 -0.58 1.57 2.86 -1.33 -2.04 114.93 116.04 2b3w h MET 97 Ca 0.09 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2b3w h MET 97 Cb 0.04 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2b3w h MET 97 CO -0.02 0.52 0.35 -0.09 1.06 0.00 0.00 176.91 178.74 2b3w h ARG 98 N 0.30 0.79 -0.39 1.72 2.43 -0.99 0.36 114.38 118.61 2b3w h ARG 98 Ca 0.05 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.00 2b3w h ARG 98 Cb 0.53 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2b3w h ARG 98 CO 0.04 0.57 -0.34 -0.22 -1.51 0.00 0.00 179.97 178.51 2b3w h LYS 99 N 0.79 0.91 -0.16 0.20 3.64 -1.22 -0.97 116.57 119.76 2b3w h LYS 99 Ca 0.21 -0.46 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 2b3w h LYS 99 Cb -0.02 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2b3w h LYS 99 CO -0.04 1.12 0.03 0.00 -2.27 0.00 0.00 179.45 178.29 2b3w h ALA 100 N 0.78 0.21 -0.41 5.00 0.00 -1.04 -1.97 119.26 121.83 2b3w h ALA 100 Ca 0.07 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2b3w h ALA 100 Cb 0.93 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2b3w h ALA 100 CO 0.09 -0.13 -0.15 -0.07 0.00 0.00 0.00 179.25 178.99 2b3w h LEU 101 N 0.05 0.74 -0.12 0.00 3.38 -0.29 -2.19 115.31 116.88 2b3w h LEU 101 Ca 0.05 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2b3w h LEU 101 Cb 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2b3w h LEU 101 CO 0.00 0.90 0.08 -0.09 0.09 0.00 0.00 178.44 179.42 2b3w h ARG 102 N 0.67 0.16 -0.19 1.13 2.43 -1.08 -2.02 114.38 115.48 2b3w h ARG 102 Ca 0.11 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2b3w h ARG 102 Cb 0.63 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 2b3w h ARG 102 CO 0.04 0.12 0.13 0.00 -1.51 0.00 0.00 179.97 178.75 2b3w h ALA 103 N 1.03 2.11 0.36 2.80 0.00 -1.10 0.12 119.26 124.58 2b3w h ALA 103 Ca 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2b3w h ALA 103 Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2b3w h ALA 103 CO -0.01 -0.15 -0.17 -0.22 0.00 0.00 0.00 179.25 178.70 2b3w h LYS 104 N 0.05 -0.46 0.00 0.00 3.64 -0.75 -1.49 116.57 117.56 2b3w h LYS 104 Ca 0.08 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2b3w h LYS 104 Cb 0.27 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2b3w h LYS 104 CO -0.01 -0.16 0.00 1.19 -2.27 0.00 0.00 179.45 178.21 2b3w n PHE 105 N -5.18 0.16 0.02 1.91 3.72 -0.82 -1.58 117.46 115.70 2b3w n PHE 105 Ca -0.10 0.05 -0.04 0.00 -0.05 0.00 0.00 57.45 57.32 2b3w n PHE 105 Cb 0.27 -0.59 -0.10 0.00 -0.94 0.00 0.00 39.48 38.12 2b3w n PHE 105 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2b3w h GLU 106 N 0.00 0.00 0.01 -1.08 5.08 -0.98 -3.36 114.58 114.26 2b3w h GLU 106 Ca 0.00 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.09 2b3w h GLU 106 Cb 0.40 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 2b3w h GLU 106 CO 0.00 0.46 -1.48 0.37 -1.00 0.00 0.00 179.01 177.36 2b3w h GLN 107 N 0.00 0.03 -4.82 2.33 5.75 -0.55 -3.44 115.11 114.41 2b3w h GLN 107 Ca -0.18 -0.05 -0.68 0.00 -0.15 0.00 0.00 58.65 57.59 2b3w h GLN 107 Cb 1.75 0.02 -0.33 0.00 1.07 0.00 0.00 27.48 30.00 2b3w h GLN 107 CO 0.07 0.73 -0.72 -1.01 -2.65 0.00 0.00 178.83 175.25 2b3w s HIS 108 N -2.63 3.20 0.24 3.99 3.76 -0.62 -4.99 115.29 118.24 2b3w s HIS 108 Ca -0.04 -1.80 -0.06 0.00 -0.15 0.00 0.00 55.06 53.02 2b3w s HIS 108 Cb 0.08 -2.08 0.26 0.00 1.11 0.00 0.00 32.58 31.95 2b3w s HIS 108 CO 0.82 -0.78 1.85 0.00 -0.85 0.00 0.00 174.74 175.78 2b3w h ALA 109 N 7.99 1.18 -0.50 -1.40 0.00 -1.85 -1.63 119.26 123.05 2b3w h ALA 109 Ca -0.25 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.60 2b3w h ALA 109 Cb 1.08 -0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 2b3w h ALA 109 CO 0.54 0.64 0.09 0.93 0.00 0.00 0.00 179.25 181.45 2b3w h GLU 110 N 1.17 0.22 -0.01 0.00 3.07 -1.94 -1.61 114.58 115.47 2b3w h GLU 110 Ca 0.29 -0.01 -0.17 0.00 -0.50 0.00 0.00 59.36 58.97 2b3w h GLU 110 Cb 0.08 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 2b3w h GLU 110 CO -0.04 0.15 -0.77 -0.07 -1.40 0.00 0.00 179.01 176.88 2b3w h LEU 111 N 0.23 0.11 -0.12 1.33 3.38 -1.83 -1.76 115.31 116.66 2b3w h LEU 111 Ca 0.25 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.17 2b3w h LEU 111 Cb 0.34 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2b3w h LEU 111 CO -0.33 0.83 -0.06 -0.09 0.09 0.00 0.00 178.44 178.88 2b3w h ARG 112 N 0.05 -0.05 -0.32 1.13 9.65 -0.62 0.78 114.38 125.00 2b3w h ARG 112 Ca -0.02 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.71 2b3w h ARG 112 Cb 1.35 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.94 2b3w h ARG 112 CO 0.11 -0.03 -0.42 0.00 2.80 0.00 0.00 179.97 182.42 2b3w h ALA 113 N 1.05 0.64 -0.48 2.80 0.00 -1.25 -2.64 119.26 119.39 2b3w h ALA 113 Ca 0.07 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2b3w h ALA 113 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2b3w h ALA 113 CO -0.15 0.67 0.31 1.25 0.00 0.00 0.00 179.25 181.33 2b3w h LEU 114 N 0.66 0.56 -0.49 0.00 5.85 -1.06 -0.34 115.31 120.48 2b3w h LEU 114 Ca 0.05 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2b3w h LEU 114 Cb 0.99 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 2b3w h LEU 114 CO 0.10 0.42 0.25 0.25 -0.34 0.00 0.00 178.44 179.11 2b3w h LEU 115 N 0.64 0.62 -0.65 2.25 5.85 -0.78 -2.47 115.31 120.78 2b3w h LEU 115 Ca 0.17 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2b3w h LEU 115 Cb -0.05 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.82 2b3w h LEU 115 CO -0.04 0.56 0.00 -0.07 -0.34 0.00 0.00 178.44 178.55 2b3w h LEU 116 N 0.64 0.00 -0.41 2.25 3.38 -1.22 -2.88 115.31 117.08 2b3w h LEU 116 Ca 0.17 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2b3w h LEU 116 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2b3w h LEU 116 CO -0.02 0.00 -0.27 0.00 0.09 0.00 0.00 178.44 178.23 2b3w h ALA 117 N 2.13 0.87 0.00 1.53 0.00 -0.59 -3.09 119.26 120.11 2b3w h ALA 117 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2b3w h ALA 117 Cb 0.67 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2b3w h ALA 117 CO 0.00 0.34 -0.28 1.79 0.00 0.00 0.00 179.25 181.10 2b3w h THR 118 N 0.00 0.66 -1.98 0.00 1.35 -1.35 -3.38 112.91 108.21 2b3w h THR 118 Ca -0.00 -1.26 -0.64 0.00 -0.55 0.00 0.00 66.41 63.95 2b3w h THR 118 Cb 1.06 1.83 0.09 0.00 -1.73 0.00 0.00 68.15 69.40 2b3w h THR 118 CO 0.04 0.27 0.15 0.00 -0.25 0.00 0.00 175.52 175.72 2b3w n ALA 119 N -2.25 -0.90 -1.28 6.62 0.00 -1.17 -0.23 120.51 121.30 2b3w n ALA 119 Ca 0.00 0.44 -0.27 0.00 0.00 0.00 0.00 53.44 53.62 2b3w n ALA 119 Cb 0.46 -1.98 0.15 0.00 0.00 0.00 0.00 19.45 18.08 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 1.38 2.39 -1.22 0.00 -0.04 -1.26 -4.54 135.00 131.71 2b3w n PRO 120 Ca 0.14 -3.12 -0.31 0.00 -0.04 0.00 0.00 63.50 60.16 2b3w n PRO 120 Cb 0.26 -2.20 0.10 0.00 -0.04 0.00 0.00 33.50 31.62 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 -3.47 2.12 -0.23 0.55 0.00 0.68 -4.81 121.76 116.60 2b3w s ALA 121 Ca 0.59 0.40 -0.22 0.00 0.00 0.00 0.00 51.96 52.73 2b3w s ALA 121 Cb 0.49 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 2b3w s ALA 121 CO 0.07 -1.91 0.68 0.21 0.00 0.00 0.00 175.76 174.80 2b3w s LYS 122 N -4.70 4.17 -0.36 0.00 2.20 0.14 -4.94 119.74 116.25 2b3w s LYS 122 Ca 0.64 0.68 -0.21 0.00 -0.36 0.00 0.00 55.97 56.71 2b3w s LYS 122 Cb -0.19 -3.62 0.01 0.00 -1.51 0.00 0.00 37.83 32.51 2b3w s LYS 122 CO 0.54 -0.37 0.67 -0.51 -0.36 0.00 0.00 175.35 175.32 2b3w s LEU 123 N 2.36 4.24 -0.17 5.43 1.43 -1.26 -0.42 118.68 130.29 2b3w s LEU 123 Ca 0.29 0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.55 2b3w s LEU 123 Cb -0.16 -2.84 0.04 0.00 0.03 0.00 0.00 46.19 43.27 2b3w s LEU 123 CO 0.09 -0.64 -0.04 -0.69 0.23 0.00 0.00 176.35 175.30 2b3w s VAL 124 N 2.81 1.05 -0.19 -1.59 1.01 -0.09 -4.22 120.40 119.18 2b3w s VAL 124 Ca 0.26 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2b3w s VAL 124 Cb -0.14 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 2b3w s VAL 124 CO 0.16 0.11 1.33 -0.70 0.00 0.00 0.00 175.10 176.00 2b3w s GLU 125 N 1.66 4.12 -1.28 2.72 2.12 -1.26 -1.96 118.70 124.83 2b3w s GLU 125 Ca 0.01 1.62 -0.14 0.00 0.36 0.00 0.00 54.97 56.81 2b3w s GLU 125 Cb -0.15 -3.83 0.12 0.00 0.26 0.00 0.00 34.13 30.53 2b3w s GLU 125 CO -0.08 -0.86 1.68 1.58 -0.54 0.00 0.00 175.26 177.05 2b3w n HIS 126 N 7.02 4.43 -2.46 5.30 -0.00 -1.18 -1.16 115.22 127.17 2b3w n HIS 126 Ca 0.15 -3.07 -0.42 0.00 -0.00 0.00 0.00 57.72 54.37 2b3w n HIS 126 Cb 0.45 -2.34 -0.02 0.00 -0.00 0.00 0.00 29.99 28.08 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 2.41 3.94 -0.67 3.57 2.01 -1.26 -4.85 115.64 120.79 2b3w s THR 127 Ca 0.46 0.88 0.16 0.00 0.31 0.00 0.00 61.69 63.50 2b3w s THR 127 Cb 0.03 -4.48 0.57 0.00 0.01 0.00 0.00 72.50 68.62 2b3w s THR 127 CO 0.02 -1.09 1.48 1.21 -0.69 0.00 0.00 174.62 175.55 2b3w n GLU 128 N 8.34 3.36 0.00 4.92 2.13 -1.26 -0.93 120.64 137.21 2b3w n GLU 128 Ca 0.12 -2.70 0.00 0.00 0.66 0.00 0.00 57.16 55.24 2b3w n GLU 128 Cb 0.49 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.43 2b3w n GLU 128 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2b3w n ASN 129 N 0.36 3.50 -4.02 4.31 6.94 -1.26 -4.87 115.26 120.23 2b3w n ASN 129 Ca 0.21 0.00 -0.20 0.00 -0.02 0.00 0.00 54.58 54.57 2b3w n ASN 129 Cb 0.81 0.52 -0.15 0.00 -2.36 0.00 0.00 39.78 38.60 2b3w n ASN 129 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2b3w s ASP 130 N -1.91 1.26 -0.95 0.53 1.11 -1.26 -5.08 116.67 110.37 2b3w s ASP 130 Ca 0.00 -0.20 -0.12 0.00 0.18 0.00 0.00 52.55 52.42 2b3w s ASP 130 Cb 0.00 -0.29 0.24 0.00 1.07 0.00 0.00 42.92 43.94 2b3w s ASP 130 CO 0.00 0.08 0.92 0.00 1.18 0.00 0.00 175.17 177.35 2b3w s ALA 131 N 0.08 4.36 0.00 5.23 0.00 -1.26 -3.68 121.76 126.49 2b3w s ALA 131 Ca -0.01 -3.55 0.00 0.00 0.00 0.00 0.00 51.96 48.40 2b3w s ALA 131 Cb -0.08 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2b3w s ALA 131 CO 0.00 -2.25 0.00 0.98 0.00 0.00 0.00 175.76 174.49 2b3w n TYR 132 N 3.45 0.00 -0.95 0.00 9.36 -0.99 -4.89 117.16 123.13 2b3w n TYR 132 Ca 0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.40 2b3w n TYR 132 Cb 0.44 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.15 2b3w n TYR 132 CO 0.00 0.00 0.00 0.91 0.22 0.00 0.00 176.86 177.99 2b3w n TRP 133 N -0.10 0.00 0.00 2.98 5.03 -0.58 -4.73 117.44 120.04 2b3w n TRP 133 Ca 0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 2b3w n TRP 133 Cb 0.00 -0.46 0.00 0.00 -1.03 0.00 0.00 31.31 29.82 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 -1.99 0.05 0.13 6.99 0.00 -0.18 -4.07 105.19 106.13 2b3w n GLY 134 Ca 0.00 0.53 -0.28 0.00 0.00 0.00 0.00 46.02 46.27 2b3w n GLY 134 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b3w n ASP 135 N 0.00 1.95 0.00 1.61 -0.08 -0.31 -2.60 116.55 117.13 2b3w n ASP 135 Ca 0.00 0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.61 2b3w n ASP 135 Cb 0.00 -0.82 0.00 0.00 2.34 0.00 0.00 41.12 42.64 2b3w n ASP 135 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2b3w n GLY 136 N 1.33 1.98 0.58 0.27 0.00 -0.10 -1.45 105.19 107.79 2b3w n GLY 136 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.00 0.83 0.53 -0.02 0.00 -0.92 -4.60 105.19 99.01 2b3w n GLY 137 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.29 0.00 0.00 1.61 1.44 -1.20 -5.03 115.22 109.75 2b3w n HIS 138 Ca 0.00 -0.14 0.00 0.00 -2.01 0.00 0.00 57.72 55.57 2b3w n HIS 138 Cb 0.00 0.30 0.00 0.00 0.12 0.00 0.00 29.99 30.41 2b3w n HIS 138 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2b3w n GLY 139 N 0.00 1.25 2.77 -1.39 0.00 -0.76 -4.80 105.19 102.27 2b3w n GLY 139 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2b3w n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b3w n LYS 140 N 0.00 3.69 -0.07 1.61 5.02 -1.08 -4.31 118.16 123.03 2b3w n LYS 140 Ca 0.00 -3.37 0.05 0.00 -2.02 0.00 0.00 58.31 52.96 2b3w n LYS 140 Cb 0.00 -2.91 0.06 0.00 -0.02 0.00 0.00 35.03 32.16 2b3w n LYS 140 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b3w n GLY 141 N 2.79 3.29 2.00 0.72 0.00 -0.53 -4.79 105.19 108.67 2b3w n GLY 141 Ca 0.46 -0.53 -0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.86 -0.93 0.00 1.61 5.02 -1.07 -1.53 118.16 120.40 2b3w n LYS 142 Ca 0.07 1.13 0.03 0.00 -2.02 0.00 0.00 58.31 57.53 2b3w n LYS 142 Cb 0.48 -3.02 0.19 0.00 -0.02 0.00 0.00 35.03 32.65 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 -0.37 0.00 0.30 4.39 4.05 -1.12 -1.01 115.26 121.51 2b3w n ASN 143 Ca 0.04 -0.55 0.19 0.00 0.45 0.00 0.00 54.58 54.71 2b3w n ASN 143 Cb 0.16 0.00 1.02 0.00 1.23 0.00 0.00 39.78 42.19 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 0.00 -0.10 1.20 2.43 -1.88 0.82 114.38 116.85 2b3w h ARG 144 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2b3w h ARG 144 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2b3w h ARG 144 CO 0.00 0.00 0.00 1.25 -1.51 0.00 0.00 179.97 179.71 2b3w h LEU 145 N 0.00 0.16 -1.64 3.80 5.85 -1.71 0.42 115.31 122.20 2b3w h LEU 145 Ca 0.02 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 2b3w h LEU 145 Cb 0.21 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2b3w h LEU 145 CO -0.00 0.43 -0.20 1.23 -0.34 0.00 0.00 178.44 179.56 2b3w h GLY 146 N -0.10 0.00 1.36 3.75 0.00 -1.11 -1.20 103.07 105.76 2b3w h GLY 146 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.23 2b3w h GLY 146 CO 0.00 0.00 -0.33 -1.82 0.00 0.00 0.00 176.54 174.40 2b3w h TYR 147 N 0.00 0.84 -0.29 5.60 3.20 -0.49 0.26 116.97 126.10 2b3w h TYR 147 Ca -0.00 -0.22 0.02 0.00 3.14 0.00 0.00 58.73 61.66 2b3w h TYR 147 Cb 0.38 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 2b3w h TYR 147 CO 0.00 0.95 0.15 -0.07 -1.64 0.00 0.00 178.16 177.55 2b3w h LEU 148 N 0.61 0.23 -1.04 2.82 3.38 0.74 0.31 115.31 122.35 2b3w h LEU 148 Ca 0.07 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2b3w h LEU 148 Cb 0.85 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 2b3w h LEU 148 CO 0.07 0.17 0.39 -0.07 0.09 0.00 0.00 178.44 179.10 2b3w h LEU 149 N 0.31 0.96 -0.24 1.67 3.38 -0.92 0.12 115.31 120.59 2b3w h LEU 149 Ca 0.12 -0.09 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 2b3w h LEU 149 Cb 0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.54 2b3w h LEU 149 CO -0.07 0.79 -0.63 0.24 0.09 0.00 0.00 178.44 178.86 2b3w h MET 150 N 1.07 0.84 -0.48 1.13 2.86 0.03 0.44 114.93 120.83 2b3w h MET 150 Ca 0.27 -0.59 -0.11 0.00 -2.06 0.00 0.00 59.70 57.21 2b3w h MET 150 Cb 0.06 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2b3w h MET 150 CO -0.04 1.22 -0.14 0.93 1.06 0.00 0.00 176.91 179.94 2b3w h GLU 151 N 0.61 0.91 -0.33 1.72 5.08 -0.20 0.34 114.58 122.71 2b3w h GLU 151 Ca -0.01 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2b3w h GLU 151 Cb 1.25 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2b3w h GLU 151 CO 0.14 0.99 0.16 1.25 -1.00 0.00 0.00 179.01 180.54 2b3w h LEU 152 N 0.81 0.43 -0.70 1.33 5.85 -0.65 -0.15 115.31 122.23 2b3w h LEU 152 Ca 0.12 -0.12 0.12 0.00 0.84 0.00 0.00 57.88 58.84 2b3w h LEU 152 Cb 0.67 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.51 2b3w h LEU 152 CO 0.05 0.43 0.26 -0.09 -0.34 0.00 0.00 178.44 178.75 2b3w h ARG 153 N 0.39 0.41 -0.47 1.25 2.43 0.20 0.35 114.38 118.93 2b3w h ARG 153 Ca 0.11 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.14 2b3w h ARG 153 Cb 0.11 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2b3w h ARG 153 CO -0.01 0.27 -0.16 1.49 -1.51 0.00 0.00 179.97 180.04 2b3w h GLU 154 N 0.42 0.92 -0.12 0.20 4.81 -0.50 0.14 114.58 120.45 2b3w h GLU 154 Ca 0.37 -0.35 -0.18 0.00 -0.13 0.00 0.00 59.36 59.07 2b3w h GLU 154 Cb 0.53 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 2b3w h GLU 154 CO -0.37 1.01 -0.67 0.37 -0.73 0.00 0.00 179.01 178.62 2b3w h GLN 155 N 0.81 0.47 0.00 1.92 4.15 -0.17 -2.13 115.11 120.16 2b3w h GLN 155 Ca 0.12 -0.35 -0.05 0.00 0.77 0.00 0.00 58.65 59.13 2b3w h GLN 155 Cb 0.70 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.45 2b3w h GLN 155 CO 0.05 0.97 -0.26 -0.07 -1.93 0.00 0.00 178.83 177.59 2b3w h LEU 156 N 0.34 0.00 -0.94 -2.39 3.38 -0.17 -2.57 115.31 112.95 2b3w h LEU 156 Ca -0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2b3w h LEU 156 Cb 1.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2b3w h LEU 156 CO 0.12 0.26 -0.32 0.00 0.09 0.00 0.00 178.44 178.59 2b3w h ALA 157 N 1.74 0.99 -0.94 1.53 0.00 -0.33 -2.77 119.26 119.48 2b3w h ALA 157 Ca -0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2b3w h ALA 157 Cb 0.94 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2b3w h ALA 157 CO 0.03 0.40 0.57 0.82 0.00 0.00 0.00 179.25 181.08 2b3w h ILE 158 N 0.00 1.25 -0.68 0.00 2.04 -0.96 0.41 117.51 119.57 2b3w h ILE 158 Ca -0.00 -0.54 -0.05 0.00 1.00 0.00 0.00 64.86 65.27 2b3w h ILE 158 Cb 0.87 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2b3w h ILE 158 CO 0.04 0.26 0.24 -0.33 0.00 0.00 0.00 178.15 178.37 2b3w h GLU 159 N 1.29 1.02 -0.68 2.37 5.08 -1.56 0.13 114.58 122.24 2b3w h GLU 159 Ca 0.34 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2b3w h GLU 159 Cb -0.07 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 28.99 2b3w h GLU 159 CO -0.06 0.86 0.22 -0.22 -1.00 0.00 0.00 179.01 178.81 2b3w h LYS 160 N 1.00 1.05 -0.20 2.33 1.63 -1.03 -1.59 116.57 119.75 2b3w h LYS 160 Ca 0.23 -0.22 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 2b3w h LYS 160 Cb 0.24 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.71 2b3w h LYS 160 CO -0.01 0.90 -0.05 -0.07 -3.45 0.00 0.00 179.45 176.77 2b3w h LEU 161 N 0.99 0.39 -0.75 5.20 4.07 0.20 -3.08 115.31 122.33 2b3w h LEU 161 Ca 0.22 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2b3w h LEU 161 Cb 0.28 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.92 2b3w h LEU 161 CO -0.01 0.67 0.00 -0.62 -1.08 0.00 0.00 178.44 177.40 2b3w n GLU 162 N -4.62 1.46 -2.10 1.13 1.02 0.42 -4.88 120.64 113.07 2b3w n GLU 162 Ca -0.05 -0.62 -0.41 0.00 -0.02 0.00 0.00 57.16 56.06 2b3w n GLU 162 Cb 0.28 -1.20 -0.02 0.00 -0.02 0.00 0.00 31.44 30.48 2b3w n GLU 162 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2b3w s HIS 163 N -1.72 3.04 0.00 -0.32 -3.43 -0.61 -4.34 115.29 107.91 2b3w s HIS 163 Ca 0.11 1.37 0.00 0.00 -0.80 0.00 0.00 55.06 55.74 2b3w s HIS 163 Cb 0.06 -3.70 0.00 0.00 -1.43 0.00 0.00 32.58 27.51 2b3w s HIS 163 CO 0.07 -1.96 0.00 1.58 -2.00 0.00 0.00 174.74 172.43 2b3w n HIS 164 N 0.98 0.00 -2.52 0.38 -0.00 -1.20 -4.91 115.22 107.96 2b3w n HIS 164 Ca 0.01 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 2b3w n HIS 164 Cb 0.42 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.43 2b3w n HIS 164 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2b3w n HIS 165 N 0.00 0.15 -3.45 1.57 -0.00 -1.26 -4.66 115.22 107.57 2b3w n HIS 165 Ca 0.00 -0.71 -0.35 0.00 -0.00 0.00 0.00 57.72 56.66 2b3w n HIS 165 Cb 0.00 -0.16 -0.05 0.00 -0.00 0.00 0.00 29.99 29.77 2b3w n HIS 165 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2b3w n HIS 166 N 0.34 3.63 0.00 1.57 -0.00 -1.26 -4.73 115.22 114.77 2b3w n HIS 166 Ca 0.06 -3.81 0.00 0.00 -0.00 0.00 0.00 57.72 53.98 2b3w n HIS 166 Cb 1.10 -1.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.10 2b3w n HIS 166 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2b3w n HIS 167 N 1.68 0.00 -1.17 4.41 8.25 -1.26 -5.00 115.22 122.13 2b3w n HIS 167 Ca 0.25 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 2b3w n HIS 167 Cb 0.37 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.48 2b3w n HIS 167 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59