#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 3.51 0.26 0.03 0.02 -1.26 -4.69 135.00 132.87 2b3w s PRO 2 Ca 0.00 -0.96 0.00 0.00 0.02 0.00 0.00 61.00 60.06 2b3w s PRO 2 Cb 0.00 -5.14 0.00 0.00 0.02 0.00 0.00 34.50 29.38 2b3w s PRO 2 CO 0.00 -2.20 0.00 0.28 -0.33 0.00 0.00 177.00 174.75 2b3w n VAL 3 N 6.80 -3.22 -1.01 3.83 0.31 -1.26 -4.61 118.33 119.17 2b3w n VAL 3 Ca 0.28 1.23 -0.13 0.00 -0.01 0.00 0.00 64.34 65.71 2b3w n VAL 3 Cb 0.51 -1.75 -0.13 0.00 -0.91 0.00 0.00 33.84 31.55 2b3w n VAL 3 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2b3w n ARG 4 N -0.82 1.94 -1.13 5.55 1.74 -1.26 -4.85 116.66 117.83 2b3w n ARG 4 Ca 0.00 -1.09 -0.12 0.00 -0.77 0.00 0.00 57.85 55.88 2b3w n ARG 4 Cb 0.00 -1.91 0.07 0.00 -1.02 0.00 0.00 32.46 29.61 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 2.14 -0.33 -2.51 7.54 0.00 -1.26 -4.44 120.51 121.64 2b3w n ALA 5 Ca 0.39 -0.81 -0.21 0.00 0.00 0.00 0.00 53.44 52.81 2b3w n ALA 5 Cb 0.82 0.04 -0.00 0.00 0.00 0.00 0.00 19.45 20.31 2b3w n ALA 5 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2b3w n GLN 6 N -2.05 -2.26 -0.13 0.00 6.02 -1.26 -4.88 117.38 112.82 2b3w n GLN 6 Ca 0.07 0.99 -0.04 0.00 -0.01 0.00 0.00 57.00 58.01 2b3w n GLN 6 Cb 0.26 -5.70 0.04 0.00 1.02 0.00 0.00 30.24 25.86 2b3w n GLN 6 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2b3w h ARG 7 N -0.25 0.19 -5.11 -1.09 9.65 -1.98 -3.36 114.38 112.43 2b3w h ARG 7 Ca -0.50 -0.01 -0.64 0.00 -1.10 0.00 0.00 59.98 57.72 2b3w h ARG 7 Cb 1.37 -0.04 -0.22 0.00 -1.39 0.00 0.00 29.97 29.69 2b3w h ARG 7 CO 0.58 0.13 -0.64 0.42 2.80 0.00 0.00 179.97 183.26 2b3w s ILE 8 N -6.16 4.15 0.23 1.20 1.01 -1.26 -5.00 121.20 115.37 2b3w s ILE 8 Ca -0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 2b3w s ILE 8 Cb 0.14 -2.89 0.06 0.00 0.01 0.00 0.00 42.46 39.78 2b3w s ILE 8 CO 0.72 0.41 1.67 1.56 0.00 0.00 0.00 174.94 179.30 2b3w h GLN 9 N 7.52 0.77 -2.47 2.79 4.20 -1.94 -3.45 115.11 122.54 2b3w h GLN 9 Ca -0.36 -0.28 -0.08 0.00 0.06 0.00 0.00 58.65 57.99 2b3w h GLN 9 Cb 1.18 -0.05 -0.25 0.00 0.30 0.00 0.00 27.48 28.66 2b3w h GLN 9 CO 0.62 0.88 -0.19 -1.58 -0.67 0.00 0.00 178.83 177.88 2b3w s HIS 10 N -4.72 -0.71 0.73 2.96 5.04 -1.26 -4.98 115.29 112.34 2b3w s HIS 10 Ca -0.09 1.51 -0.08 0.00 -1.54 0.00 0.00 55.06 54.85 2b3w s HIS 10 Cb 0.14 0.35 0.16 0.00 0.04 0.00 0.00 32.58 33.26 2b3w s HIS 10 CO 0.83 -0.38 0.99 1.33 -2.34 0.00 0.00 174.74 175.17 2b3w n VAL 11 N 4.04 0.00 -3.43 0.89 0.24 -1.26 -5.10 118.33 113.71 2b3w n VAL 11 Ca -0.21 -1.01 -0.19 0.00 -2.04 0.00 0.00 64.34 60.90 2b3w n VAL 11 Cb 0.56 -1.35 -0.00 0.00 -1.47 0.00 0.00 33.84 31.58 2b3w n VAL 11 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2b3w s MET 12 N -5.09 3.07 -0.24 7.34 -1.94 -1.26 -4.94 119.30 116.23 2b3w s MET 12 Ca 0.59 -1.05 -0.29 0.00 -1.71 0.00 0.00 55.69 53.23 2b3w s MET 12 Cb -0.02 -2.80 -0.03 0.00 2.01 0.00 0.00 34.83 33.99 2b3w s MET 12 CO 0.41 0.02 1.86 -0.65 -0.01 0.00 0.00 175.02 176.65 2b3w s GLN 13 N -4.19 3.49 -0.30 2.03 1.11 -1.26 -3.45 119.66 117.09 2b3w s GLN 13 Ca 0.46 1.73 -0.08 0.00 0.01 0.00 0.00 55.36 57.48 2b3w s GLN 13 Cb -0.09 -4.19 0.01 0.00 -1.01 0.00 0.00 33.01 27.73 2b3w s GLN 13 CO 0.31 -1.68 0.32 -3.47 0.01 0.00 0.00 175.29 170.78 2b3w n ASP 14 N 9.86 -6.55 -4.24 5.90 2.03 -1.26 -5.04 116.55 117.25 2b3w n ASP 14 Ca 0.23 0.62 -0.34 0.00 0.52 0.00 0.00 54.79 55.82 2b3w n ASP 14 Cb 0.45 -4.33 -0.15 0.00 -0.72 0.00 0.00 41.12 36.37 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 -1.92 2.85 -0.46 5.18 2.01 -1.22 -4.95 115.64 117.12 2b3w s THR 15 Ca 0.13 -0.67 -0.17 0.00 0.31 0.00 0.00 61.69 61.29 2b3w s THR 15 Cb -0.04 -2.26 0.05 0.00 0.01 0.00 0.00 72.50 70.26 2b3w s THR 15 CO 0.59 0.47 0.48 -0.63 -0.69 0.00 0.00 174.62 174.84 2b3w s ILE 16 N 1.35 5.07 -0.51 1.82 1.01 -1.26 0.88 121.20 129.56 2b3w s ILE 16 Ca 0.05 -0.61 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 2b3w s ILE 16 Cb -0.14 -4.14 0.12 0.00 0.01 0.00 0.00 42.46 38.30 2b3w s ILE 16 CO -0.06 -0.59 0.44 -0.63 0.00 0.00 0.00 174.94 174.10 2b3w s ILE 17 N 2.14 4.97 -0.56 2.92 1.01 -0.74 -4.96 121.20 125.98 2b3w s ILE 17 Ca 0.10 -1.48 -0.23 0.00 0.00 0.00 0.00 60.65 59.04 2b3w s ILE 17 Cb -0.20 -4.16 0.05 0.00 0.01 0.00 0.00 42.46 38.16 2b3w s ILE 17 CO 0.11 -0.78 0.91 0.20 0.00 0.00 0.00 174.94 175.38 2b3w s ASN 18 N 3.18 6.31 0.37 3.58 0.01 -1.25 -1.87 114.94 125.26 2b3w s ASN 18 Ca 0.04 -0.49 0.08 0.00 -0.71 0.00 0.00 52.86 51.78 2b3w s ASN 18 Cb -0.28 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 38.92 2b3w s ASN 18 CO 0.03 -1.22 0.20 0.72 -1.51 0.00 0.00 177.10 175.32 2b3w s PHE 19 N 3.84 2.71 -0.17 2.20 -0.71 -0.13 -4.91 117.98 120.82 2b3w s PHE 19 Ca 0.28 -0.43 -0.07 0.00 -1.04 0.00 0.00 56.93 55.67 2b3w s PHE 19 Cb -0.14 -1.80 0.07 0.00 -1.21 0.00 0.00 43.02 39.95 2b3w s PHE 19 CO 0.17 0.22 0.36 -0.47 -1.34 0.00 0.00 175.22 174.17 2b3w s TYR 20 N -2.45 -0.62 0.18 3.49 5.04 -1.26 -1.73 117.35 120.00 2b3w s TYR 20 Ca 0.40 1.26 0.00 0.00 -2.44 0.00 0.00 57.07 56.30 2b3w s TYR 20 Cb -0.02 0.18 0.00 0.00 0.35 0.00 0.00 41.96 42.48 2b3w s TYR 20 CO 0.24 -0.40 0.00 -1.13 -1.34 0.00 0.00 175.55 172.92 2b3w n SER 21 N 5.05 -6.45 0.09 4.32 3.41 -1.26 -4.42 113.62 114.35 2b3w n SER 21 Ca -0.12 0.86 -0.03 0.00 -0.26 0.00 0.00 58.87 59.32 2b3w n SER 21 Cb 0.51 -2.47 -0.06 0.00 -0.26 0.00 0.00 64.21 61.93 2b3w n SER 21 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2b3w h THR 22 N -0.74 1.29 0.00 6.66 1.35 -1.94 -3.39 112.91 116.14 2b3w h THR 22 Ca 0.02 -2.86 0.00 0.00 -0.55 0.00 0.00 66.41 63.02 2b3w h THR 22 Cb 0.73 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.78 2b3w h THR 22 CO 0.01 0.74 0.00 -1.54 -0.25 0.00 0.00 175.52 174.47 2b3w n SER 23 N -3.27 0.00 0.00 5.36 3.41 -1.26 -1.66 113.62 116.20 2b3w n SER 23 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2b3w n SER 23 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 2b3w n SER 23 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2b3w n ASP 24 N 2.41 0.00 0.00 4.04 2.03 -1.26 -5.00 116.55 118.77 2b3w n ASP 24 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2b3w n ASP 24 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2b3w n ASP 24 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2b3w n ASP 25 N 0.00 0.42 -0.00 1.67 9.92 -1.25 -4.75 116.55 122.56 2b3w n ASP 25 Ca 0.00 -1.02 0.10 0.00 -0.53 0.00 0.00 54.79 53.34 2b3w n ASP 25 Cb 0.00 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.35 2b3w n ASP 25 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2b3w n TYR 26 N -0.01 0.00 1.27 1.24 9.36 -1.26 -4.34 117.16 123.43 2b3w n TYR 26 Ca 0.00 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.35 2b3w n TYR 26 Cb 0.16 -0.18 0.35 0.00 -0.63 0.00 0.00 39.34 39.04 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 1.42 0.43 0.00 2.98 0.00 -0.66 -4.39 105.19 104.97 2b3w n GLY 27 Ca 0.01 -0.55 0.02 0.00 0.00 0.00 0.00 46.02 45.50 2b3w n GLY 27 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b3w n ASP 28 N 0.66 0.00 0.17 1.61 8.00 -1.26 -1.36 116.55 124.38 2b3w n ASP 28 Ca 0.17 -0.12 0.05 0.00 0.71 0.00 0.00 54.79 55.60 2b3w n ASP 28 Cb 0.45 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.05 2b3w n ASP 28 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2b3w h PHE 29 N 0.00 0.15 -4.00 1.24 -1.00 -1.89 -3.44 116.94 108.00 2b3w h PHE 29 Ca 0.00 -0.01 -0.55 0.00 2.81 0.00 0.00 57.97 60.22 2b3w h PHE 29 Cb 0.00 -0.05 0.17 0.00 3.61 0.00 0.00 35.95 39.69 2b3w h PHE 29 CO 0.00 0.21 0.29 0.43 -1.61 0.00 0.00 178.31 177.63 2b3w n SER 30 N -4.39 1.09 0.15 2.17 7.64 -0.46 -4.90 113.62 114.92 2b3w n SER 30 Ca -0.01 0.69 0.13 0.00 1.01 0.00 0.00 58.87 60.68 2b3w n SER 30 Cb 0.18 -1.48 0.40 0.00 -1.01 0.00 0.00 64.21 62.30 2b3w n SER 30 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2b3w h ASN 31 N -0.25 0.00 -0.15 6.43 2.35 -1.91 -2.57 115.58 119.48 2b3w h ASN 31 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2b3w h ASN 31 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 2b3w h ASN 31 CO 0.48 0.00 0.00 0.33 -1.65 0.00 0.00 177.43 176.59 2b3w n PHE 32 N -2.53 0.20 -1.73 1.19 7.35 -1.26 -2.87 117.46 117.82 2b3w n PHE 32 Ca 0.04 -0.10 -0.39 0.00 -0.76 0.00 0.00 57.45 56.24 2b3w n PHE 32 Cb 0.40 0.00 0.04 0.00 0.35 0.00 0.00 39.48 40.27 2b3w n PHE 32 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2b3w n ALA 33 N 0.04 1.42 -0.09 3.13 0.00 -0.97 -4.89 120.51 119.15 2b3w n ALA 33 Ca 0.13 0.13 0.02 0.00 0.00 0.00 0.00 53.44 53.72 2b3w n ALA 33 Cb 0.23 -2.32 0.22 0.00 0.00 0.00 0.00 19.45 17.57 2b3w n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b3w n ALA 34 N -1.02 3.40 -2.67 0.00 0.00 -1.26 -4.19 120.51 114.77 2b3w n ALA 34 Ca 0.10 -1.14 -0.40 0.00 0.00 0.00 0.00 53.44 52.01 2b3w n ALA 34 Cb 0.44 -1.09 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 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 -1.98 3.41 0.11 0.00 0.52 -1.25 -4.83 118.94 114.92 2b3w s TRP 35 Ca 0.31 0.91 -0.31 0.00 0.02 0.00 0.00 56.10 57.03 2b3w s TRP 35 Cb 0.24 -2.74 -0.09 0.00 -1.15 0.00 0.00 33.47 29.73 2b3w s TRP 35 CO 0.09 -0.10 1.50 -1.25 0.02 0.00 0.00 176.95 177.21 2b3w s PRO 36 N 1.62 4.26 -0.12 4.98 0.04 -1.15 -4.22 135.00 140.40 2b3w s PRO 36 Ca 0.28 2.22 -0.05 0.00 0.04 0.00 0.00 61.00 63.48 2b3w s PRO 36 Cb -0.16 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.03 2b3w s PRO 36 CO 0.11 -0.57 0.08 0.96 0.04 0.00 0.00 177.00 177.62 2b3w s ILE 37 N 1.54 4.95 -0.52 0.56 -4.36 0.65 -4.88 121.20 119.14 2b3w s ILE 37 Ca 0.68 0.00 -0.16 0.00 -0.26 0.00 0.00 60.65 60.92 2b3w s ILE 37 Cb -0.39 -3.15 0.12 0.00 1.25 0.00 0.00 42.46 40.28 2b3w s ILE 37 CO 0.31 0.58 0.47 -0.75 0.24 0.00 0.00 174.94 175.79 2b3w s LYS 38 N -0.67 2.97 -0.16 0.37 2.47 -1.26 -0.52 119.74 122.94 2b3w s LYS 38 Ca 0.12 -1.63 -0.00 0.00 -1.56 0.00 0.00 55.97 52.90 2b3w s LYS 38 Cb -0.12 -4.25 -0.00 0.00 -1.46 0.00 0.00 37.83 32.00 2b3w s LYS 38 CO 0.02 -1.26 -0.14 0.08 0.16 0.00 0.00 175.35 174.22 2b3w s VAL 39 N 1.60 2.78 0.00 4.02 1.01 -0.25 -4.82 120.40 124.75 2b3w s VAL 39 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2b3w s VAL 39 Cb -0.29 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 33.91 2b3w s VAL 39 CO 0.04 0.51 0.00 -0.67 0.00 0.00 0.00 175.10 174.97 2b3w n ASP 40 N 4.11 0.00 0.00 3.32 2.03 -1.26 -1.06 116.55 123.69 2b3w n ASP 40 Ca -0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.12 2b3w n ASP 40 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 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 0.00 0.00 2.99 0.27 0.00 -1.26 -5.15 105.19 102.04 2b3w n GLY 41 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 0.50 -0.44 1.61 1.02 -0.22 -5.12 119.74 117.09 2b3w s LYS 42 Ca 0.00 -0.33 -0.13 0.00 0.02 0.00 0.00 55.97 55.53 2b3w s LYS 42 Cb 0.00 -0.45 0.06 0.00 -0.52 0.00 0.00 37.83 36.92 2b3w s LYS 42 CO 0.00 0.12 0.33 0.99 -0.92 0.00 0.00 175.35 175.86 2b3w s THR 43 N -0.39 4.93 -0.23 2.17 2.01 -1.26 -1.09 115.64 121.78 2b3w s THR 43 Ca 0.00 -1.06 -0.17 0.00 0.31 0.00 0.00 61.69 60.77 2b3w s THR 43 Cb -0.04 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 2b3w s THR 43 CO -0.00 -0.48 0.46 0.26 -0.69 0.00 0.00 174.62 174.17 2b3w s TRP 44 N 1.59 3.32 0.40 4.92 0.52 0.32 -4.89 118.94 125.12 2b3w s TRP 44 Ca 0.04 0.63 0.20 0.00 0.02 0.00 0.00 56.10 56.98 2b3w s TRP 44 Cb -0.23 -2.63 1.14 0.00 -1.15 0.00 0.00 33.47 30.60 2b3w s TRP 44 CO 0.06 -0.16 1.76 -1.00 0.02 0.00 0.00 176.95 177.63 2b3w h PRO 45 N 7.74 0.35 -3.85 4.98 0.13 -1.88 0.19 132.00 139.65 2b3w h PRO 45 Ca -0.32 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.69 2b3w h PRO 45 Cb 1.15 -0.08 -0.12 0.00 0.13 0.00 0.00 31.00 32.08 2b3w h PRO 45 CO 0.71 0.23 -0.28 0.95 -0.23 0.00 0.00 178.00 179.37 2b3w s THR 46 N -5.46 0.05 0.22 1.56 -4.23 -1.26 -2.93 115.64 103.58 2b3w s THR 46 Ca -0.09 -1.39 -0.07 0.00 -1.18 0.00 0.00 61.69 58.96 2b3w s THR 46 Cb 0.26 -1.92 0.15 0.00 1.34 0.00 0.00 72.50 72.33 2b3w s THR 46 CO 0.80 -0.22 1.77 -1.28 -0.54 0.00 0.00 174.62 175.15 2b3w h SER 47 N 2.48 1.10 -0.83 3.99 0.87 -1.72 -2.49 113.55 116.96 2b3w h SER 47 Ca -0.31 -0.18 0.06 0.00 -1.23 0.00 0.00 61.79 60.13 2b3w h SER 47 Cb 1.24 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 62.86 2b3w h SER 47 CO 0.46 0.98 0.54 -0.33 -0.53 0.00 0.00 176.83 177.95 2b3w h GLU 48 N 1.15 0.90 -0.58 2.24 4.39 -1.86 -2.19 114.58 118.61 2b3w h GLU 48 Ca 0.26 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.90 2b3w h GLU 48 Cb 0.24 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 2b3w h GLU 48 CO -0.02 0.59 0.35 0.45 -1.16 0.00 0.00 179.01 179.22 2b3w h HIS 49 N 0.92 0.77 -0.42 4.33 3.86 -1.79 -0.56 115.15 122.27 2b3w h HIS 49 Ca 0.35 -0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.43 2b3w h HIS 49 Cb 0.20 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 2b3w h HIS 49 CO -0.00 0.53 -0.27 -0.92 0.86 0.00 0.00 177.93 178.13 2b3w h TYR 50 N 0.79 1.02 -0.36 2.45 3.20 -1.46 -1.53 116.97 121.09 2b3w h TYR 50 Ca 0.21 -0.26 -0.02 0.00 3.14 0.00 0.00 58.73 61.80 2b3w h TYR 50 Cb -0.01 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2b3w h TYR 50 CO -0.02 1.04 0.16 0.35 -1.64 0.00 0.00 178.16 178.05 2b3w h PHE 51 N 0.75 0.52 -0.15 -3.82 3.57 -0.94 -1.33 116.94 115.55 2b3w h PHE 51 Ca 0.09 -0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.43 2b3w h PHE 51 Cb 0.82 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 2b3w h PHE 51 CO 0.05 0.46 -0.47 1.96 -2.23 0.00 0.00 178.31 178.08 2b3w h GLN 52 N 0.43 0.37 -0.33 1.11 1.08 -1.06 -1.30 115.11 115.41 2b3w h GLN 52 Ca 0.12 -0.20 -0.05 0.00 -1.45 0.00 0.00 58.65 57.07 2b3w h GLN 52 Cb 0.14 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2b3w h GLN 52 CO -0.01 0.76 -0.01 0.00 -0.95 0.00 0.00 178.83 178.62 2b3w h ALA 53 N 1.21 0.44 0.00 3.87 0.00 -0.99 -2.84 119.26 120.95 2b3w h ALA 53 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2b3w h ALA 53 Cb 0.94 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2b3w h ALA 53 CO 0.08 0.21 -0.10 1.04 0.00 0.00 0.00 179.25 180.48 2b3w n GLN 54 N -4.52 0.11 0.22 0.00 3.00 -0.53 -3.03 117.38 112.63 2b3w n GLN 54 Ca -0.02 0.08 0.06 0.00 -0.01 0.00 0.00 57.00 57.11 2b3w n GLN 54 Cb 0.27 -1.62 0.50 0.00 0.00 0.00 0.00 30.24 29.39 2b3w n GLN 54 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2b3w h LYS 55 N 0.00 0.00 -6.08 -1.09 3.64 -0.98 -3.45 116.57 108.61 2b3w h LYS 55 Ca 0.00 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.84 2b3w h LYS 55 Cb 0.60 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.35 2b3w h LYS 55 CO 0.00 0.25 -0.50 -0.06 -2.27 0.00 0.00 179.45 176.87 2b3w s PHE 56 N -4.29 2.72 0.00 1.91 0.08 -1.17 -4.09 117.98 113.14 2b3w s PHE 56 Ca -0.03 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.60 2b3w s PHE 56 Cb 0.14 -1.78 0.00 0.00 -0.57 0.00 0.00 43.02 40.81 2b3w s PHE 56 CO 0.68 0.24 0.55 1.47 -0.10 0.00 0.00 175.22 178.06 2b3w n LEU 57 N -1.24 1.06 -4.75 -0.37 -0.00 -1.26 -4.97 117.00 105.47 2b3w n LEU 57 Ca -0.02 -1.06 -0.40 0.00 -0.00 0.00 0.00 56.01 54.52 2b3w n LEU 57 Cb 0.62 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.99 2b3w n LEU 57 CO 0.43 0.27 0.75 -1.81 -0.00 0.00 0.00 177.39 177.03 2b3w s ASP 58 N -0.23 7.37 0.04 1.45 1.11 -1.26 -4.97 116.67 120.18 2b3w s ASP 58 Ca 0.00 2.12 -0.29 0.00 0.18 0.00 0.00 52.55 54.56 2b3w s ASP 58 Cb 0.00 -2.61 -0.17 0.00 1.07 0.00 0.00 42.92 41.20 2b3w s ASP 58 CO 0.00 -0.09 1.44 -0.08 1.18 0.00 0.00 175.17 177.62 2b3w h GLU 59 N 4.33 -0.69 -0.29 8.23 4.81 -1.98 -2.59 114.58 126.40 2b3w h GLU 59 Ca -0.45 0.05 0.02 0.00 -0.13 0.00 0.00 59.36 58.84 2b3w h GLU 59 Cb 1.21 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.72 2b3w h GLU 59 CO 0.69 -0.41 0.15 0.87 -0.73 0.00 0.00 179.01 179.58 2b3w h LYS 60 N -0.87 0.31 -0.18 1.92 1.79 -1.99 -0.76 116.57 116.79 2b3w h LYS 60 Ca -0.07 -0.02 -0.19 0.00 -2.18 0.00 0.00 60.65 58.19 2b3w h LYS 60 Cb 0.61 -0.07 0.01 0.00 -1.58 0.00 0.00 32.23 31.19 2b3w h LYS 60 CO 0.12 0.20 -0.62 -0.92 -1.08 0.00 0.00 179.45 177.16 2b3w h TYR 61 N 0.31 0.97 -0.06 -1.35 3.20 -1.99 -2.24 116.97 115.82 2b3w h TYR 61 Ca 0.12 -0.40 -0.07 0.00 3.14 0.00 0.00 58.73 61.52 2b3w h TYR 61 Cb 0.03 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 2b3w h TYR 61 CO -0.09 1.21 -0.29 -0.09 -1.64 0.00 0.00 178.16 177.26 2b3w h ARG 62 N 0.45 0.11 -0.21 1.82 2.43 -1.34 -1.09 114.38 116.55 2b3w h ARG 62 Ca -0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2b3w h ARG 62 Cb 1.24 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 2b3w h ARG 62 CO 0.13 0.39 0.09 1.49 -1.51 0.00 0.00 179.97 180.56 2b3w h GLU 63 N 0.10 0.31 0.24 0.20 4.57 -0.93 -2.17 114.58 116.90 2b3w h GLU 63 Ca 0.01 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2b3w h GLU 63 Cb 0.57 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2b3w h GLU 63 CO 0.04 0.35 -0.12 0.93 -1.18 0.00 0.00 179.01 179.04 2b3w h GLU 64 N 0.19 -0.31 0.00 1.92 4.39 -0.84 -2.81 114.58 117.12 2b3w h GLU 64 Ca 0.07 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.76 2b3w h GLU 64 Cb 0.16 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2b3w h GLU 64 CO -0.01 -0.15 -0.13 0.82 -1.16 0.00 0.00 179.01 178.39 2b3w h ILE 65 N -0.41 0.87 -0.06 3.13 2.04 -1.24 0.32 117.51 122.16 2b3w h ILE 65 Ca -0.03 -0.48 -0.18 0.00 1.00 0.00 0.00 64.86 65.17 2b3w h ILE 65 Cb 0.31 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2b3w h ILE 65 CO 0.05 0.13 -0.72 -0.09 0.00 0.00 0.00 178.15 177.52 2b3w h ARG 66 N 0.00 0.33 0.00 2.37 2.43 -1.23 -3.31 114.38 114.96 2b3w h ARG 66 Ca -0.00 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 2b3w h ARG 66 Cb 0.27 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2b3w h ARG 66 CO 0.02 0.91 -1.59 0.54 -1.51 0.00 0.00 179.97 178.34 2b3w n ARG 67 N -3.82 0.43 -2.20 0.20 1.74 -0.74 -4.89 116.66 107.38 2b3w n ARG 67 Ca -0.04 -0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.51 2b3w n ARG 67 Cb 0.70 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 2b3w n ARG 67 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2b3w s VAL 68 N -3.34 3.52 -0.01 1.55 0.11 0.03 -4.91 120.40 117.35 2b3w s VAL 68 Ca -0.02 1.02 -0.02 0.00 -2.93 0.00 0.00 61.98 60.04 2b3w s VAL 68 Cb 0.14 -3.66 -0.27 0.00 -1.53 0.00 0.00 36.38 31.07 2b3w s VAL 68 CO 0.88 0.04 0.82 0.77 -3.33 0.00 0.00 175.10 174.29 2b3w h SER 69 N 7.26 0.35 -2.10 3.54 4.64 -1.90 -3.46 113.55 121.88 2b3w h SER 69 Ca -0.40 -0.51 -0.57 0.00 -0.47 0.00 0.00 61.79 59.83 2b3w h SER 69 Cb 1.20 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2b3w h SER 69 CO 0.88 1.43 1.31 -1.20 -0.87 0.00 0.00 176.83 178.38 2b3w n SER 70 N -3.42 3.64 -0.05 4.97 7.64 -1.26 -4.89 113.62 120.26 2b3w n SER 70 Ca -0.17 0.65 -0.15 0.00 1.01 0.00 0.00 58.87 60.22 2b3w n SER 70 Cb 1.04 -1.50 -0.07 0.00 -1.01 0.00 0.00 64.21 62.67 2b3w n SER 70 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2b3w h PRO 71 N 11.96 0.50 -0.56 1.43 0.11 -1.99 -2.54 132.00 140.91 2b3w h PRO 71 Ca -0.45 -0.34 -0.04 0.00 0.11 0.00 0.00 66.00 65.28 2b3w h PRO 71 Cb 1.25 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 2b3w h PRO 71 CO 0.95 0.96 0.20 1.98 -0.21 0.00 0.00 178.00 181.88 2b3w h MET 72 N 0.11 0.84 -0.59 1.05 -1.53 -1.98 -2.10 114.93 110.74 2b3w h MET 72 Ca -0.00 -0.16 -0.08 0.00 -3.44 0.00 0.00 59.70 56.01 2b3w h MET 72 Cb 0.97 -0.13 -0.02 0.00 -0.55 0.00 0.00 31.60 31.87 2b3w h MET 72 CO 0.08 0.75 0.07 0.28 0.14 0.00 0.00 176.91 178.22 2b3w h VAL 73 N 0.77 1.26 -0.56 -5.77 2.07 -1.97 -0.42 116.25 111.62 2b3w h VAL 73 Ca 0.18 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.69 2b3w h VAL 73 Cb 0.23 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 2b3w h VAL 73 CO -0.01 0.38 0.35 0.00 0.02 0.00 0.00 177.57 178.30 2b3w h ALA 74 N 1.00 0.73 -0.06 1.67 0.00 -1.08 -0.49 119.26 121.04 2b3w h ALA 74 Ca 0.17 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.88 2b3w h ALA 74 Cb 0.46 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2b3w h ALA 74 CO 0.02 0.07 -0.78 0.00 0.00 0.00 0.00 179.25 178.56 2b3w h ALA 75 N 1.24 0.56 -0.28 0.00 0.00 -1.29 0.51 119.26 120.00 2b3w h ALA 75 Ca 0.23 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2b3w h ALA 75 Cb 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2b3w h ALA 75 CO -0.09 0.79 0.04 -0.09 0.00 0.00 0.00 179.25 179.90 2b3w h ARG 76 N 0.25 0.46 -0.02 0.00 9.65 -0.51 -2.30 114.38 121.91 2b3w h ARG 76 Ca -0.04 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 2b3w h ARG 76 Cb 1.36 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.89 2b3w h ARG 76 CO 0.13 0.58 -0.14 0.00 2.80 0.00 0.00 179.97 183.33 2b3w n MET 77 N -4.65 1.54 -0.08 0.20 0.00 -0.24 -4.33 117.12 109.56 2b3w n MET 77 Ca -0.03 -1.09 -0.14 0.00 0.00 0.00 0.00 57.70 56.45 2b3w n MET 77 Cb 0.21 -1.48 -0.11 0.00 0.00 0.00 0.00 33.22 31.84 2b3w n MET 77 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 2b3w h GLY 78 N 4.84 0.00 -1.83 3.17 0.00 -0.52 -3.30 103.07 105.42 2b3w h GLY 78 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2b3w h GLY 78 CO 0.00 0.00 0.05 0.54 0.00 0.00 0.00 176.54 177.13 2b3w n ARG 79 N -4.59 1.34 -1.71 4.80 1.74 -0.90 -4.86 116.66 112.49 2b3w n ARG 79 Ca -0.14 -0.41 -0.32 0.00 -0.77 0.00 0.00 57.85 56.21 2b3w n ARG 79 Cb 0.47 -1.37 0.04 0.00 -1.02 0.00 0.00 32.46 30.59 2b3w n ARG 79 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2b3w s ASP 80 N 0.32 5.37 0.00 0.55 2.15 -1.24 -5.00 116.67 118.82 2b3w s ASP 80 Ca 0.08 1.75 0.00 0.00 0.43 0.00 0.00 52.55 54.80 2b3w s ASP 80 Cb 0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2b3w s ASP 80 CO 0.02 -1.45 0.86 0.54 -0.17 0.00 0.00 175.17 174.97 2b3w n ARG 81 N -2.75 2.12 0.20 4.34 1.74 -1.26 -4.54 116.66 116.51 2b3w n ARG 81 Ca 0.08 -1.23 0.05 0.00 -0.77 0.00 0.00 57.85 55.98 2b3w n ARG 81 Cb 0.53 -0.93 0.40 0.00 -1.02 0.00 0.00 32.46 31.44 2b3w n ARG 81 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2b3w h SER 82 N 0.00 0.00 -3.03 0.55 0.02 -1.97 -3.43 113.55 105.68 2b3w h SER 82 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2b3w h SER 82 Cb 0.51 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 2b3w h SER 82 CO 0.00 0.35 -0.24 -0.54 -1.14 0.00 0.00 176.83 175.26 2b3w s LYS 83 N -3.99 3.58 1.04 3.45 -0.14 -1.26 -5.09 119.74 117.33 2b3w s LYS 83 Ca -0.02 -0.16 -0.14 0.00 -1.36 0.00 0.00 55.97 54.29 2b3w s LYS 83 Cb 0.13 -2.74 0.21 0.00 -1.68 0.00 0.00 37.83 33.75 2b3w s LYS 83 CO 0.69 0.31 1.11 -1.25 -0.76 0.00 0.00 175.35 175.45 2b3w s PRO 84 N -3.41 0.08 0.38 -1.68 0.04 -1.26 -5.04 135.00 124.11 2b3w s PRO 84 Ca 0.41 0.32 0.04 0.00 0.04 0.00 0.00 61.00 61.81 2b3w s PRO 84 Cb -0.11 -1.71 -0.05 0.00 0.04 0.00 0.00 34.50 32.67 2b3w s PRO 84 CO 0.29 -2.93 0.07 -0.51 0.04 0.00 0.00 177.00 173.97 2b3w s LEU 85 N -6.53 2.20 0.40 -3.56 1.43 -1.26 -4.81 118.68 106.55 2b3w s LEU 85 Ca 0.67 -1.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.13 2b3w s LEU 85 Cb -0.16 -0.39 -0.08 0.00 0.03 0.00 0.00 46.19 45.59 2b3w s LEU 85 CO 0.57 -0.72 0.82 -0.13 0.23 0.00 0.00 176.35 177.11 2b3w s ARG 86 N -3.82 3.93 0.16 1.70 0.52 -1.26 -4.93 118.95 115.24 2b3w s ARG 86 Ca 0.29 0.69 0.08 0.00 -0.52 0.00 0.00 55.73 56.27 2b3w s ARG 86 Cb 0.06 -2.33 -0.09 0.00 0.52 0.00 0.00 34.95 33.10 2b3w s ARG 86 CO 0.14 -0.02 1.35 -0.22 0.02 0.00 0.00 175.30 176.57 2b3w h LYS 87 N 1.57 0.00 -0.56 3.54 3.64 -2.01 -2.95 116.57 119.81 2b3w h LYS 87 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2b3w h LYS 87 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2b3w h LYS 87 CO 0.64 0.89 0.00 0.27 -2.27 0.00 0.00 179.45 178.98 2b3w n ASN 88 N -3.40 2.96 0.16 4.20 0.23 -1.26 -4.29 115.26 113.86 2b3w n ASN 88 Ca 0.00 -2.20 0.14 0.00 -0.53 0.00 0.00 54.58 51.98 2b3w n ASN 88 Cb 0.87 -0.41 0.68 0.00 -2.08 0.00 0.00 39.78 38.84 2b3w n ASN 88 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 2b3w h TRP 89 N 2.59 0.00 -0.58 -2.53 -0.00 -1.91 0.16 115.95 113.68 2b3w h TRP 89 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 58.84 2b3w h TRP 89 Cb 0.89 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 30.03 2b3w h TRP 89 CO 0.44 0.00 0.14 0.93 -0.00 0.00 0.00 178.44 179.94 2b3w h GLU 90 N 0.00 0.89 0.00 2.65 4.39 -1.83 -2.81 114.58 117.87 2b3w h GLU 90 Ca 0.10 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 2b3w h GLU 90 Cb 0.43 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2b3w h GLU 90 CO -0.00 0.80 -1.09 0.45 -1.16 0.00 0.00 179.01 178.01 2b3w n SER 91 N -4.26 0.83 -0.35 1.42 2.88 -0.05 -4.24 113.62 109.84 2b3w n SER 91 Ca 0.04 0.33 0.10 0.00 -1.33 0.00 0.00 58.87 58.01 2b3w n SER 91 Cb 0.23 0.45 -0.03 0.00 -0.75 0.00 0.00 64.21 64.11 2b3w n SER 91 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2b3w n VAL 92 N -2.70 0.00 0.09 2.46 0.24 -0.62 -4.12 118.33 113.69 2b3w n VAL 92 Ca -0.02 -0.22 -0.09 0.00 -2.04 0.00 0.00 64.34 61.98 2b3w n VAL 92 Cb 0.59 1.18 -0.05 0.00 -1.47 0.00 0.00 33.84 34.10 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 1.73 -0.42 -0.00 7.34 1.57 -1.67 0.25 116.57 125.37 2b3w h LYS 93 Ca 0.00 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2b3w h LYS 93 Cb 0.65 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2b3w h LYS 93 CO 0.00 -0.28 -0.17 0.39 -0.57 0.00 0.00 179.45 178.82 2b3w n GLU 94 N -3.94 0.72 -0.02 3.15 1.02 -1.26 -2.35 120.64 117.96 2b3w n GLU 94 Ca -0.05 -0.32 -0.17 0.00 -0.02 0.00 0.00 57.16 56.59 2b3w n GLU 94 Cb 0.22 -1.49 -0.14 0.00 -0.02 0.00 0.00 31.44 30.01 2b3w n GLU 94 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2b3w h GLN 95 N 0.78 0.14 -0.52 3.49 4.15 -1.65 -2.59 115.11 118.91 2b3w h GLN 95 Ca 0.00 -0.24 -0.09 0.00 0.77 0.00 0.00 58.65 59.10 2b3w h GLN 95 Cb 0.42 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 2b3w h GLN 95 CO 0.00 1.11 -0.03 0.28 -1.93 0.00 0.00 178.83 178.27 2b3w h VAL 96 N -0.70 1.26 -0.56 2.39 2.07 -0.51 -2.28 116.25 117.92 2b3w h VAL 96 Ca -0.10 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 2b3w h VAL 96 Cb 1.33 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 2b3w h VAL 96 CO 0.05 0.39 0.30 0.24 0.02 0.00 0.00 177.57 178.57 2b3w h MET 97 N 0.83 0.78 -0.60 1.57 2.86 -1.58 0.14 114.93 118.93 2b3w h MET 97 Ca 0.15 -0.10 0.06 0.00 -2.06 0.00 0.00 59.70 57.75 2b3w h MET 97 Cb 0.53 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 31.99 2b3w h MET 97 CO 0.03 0.61 0.31 -0.09 1.06 0.00 0.00 176.91 178.83 2b3w h ARG 98 N 0.75 0.56 -0.56 1.72 2.43 -1.26 0.32 114.38 118.34 2b3w h ARG 98 Ca 0.19 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2b3w h ARG 98 Cb 0.07 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 2b3w h ARG 98 CO -0.03 0.37 0.26 -0.22 -1.51 0.00 0.00 179.97 178.84 2b3w h LYS 99 N 0.57 0.81 -0.37 0.20 3.64 -0.82 -0.49 116.57 120.11 2b3w h LYS 99 Ca 0.27 -0.13 -0.13 0.00 -1.27 0.00 0.00 60.65 59.40 2b3w h LYS 99 Cb 0.20 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2b3w h LYS 99 CO -0.19 0.67 -0.28 0.00 -2.27 0.00 0.00 179.45 177.38 2b3w h ALA 100 N 1.10 0.81 -0.51 5.00 0.00 -0.23 -0.98 119.26 124.44 2b3w h ALA 100 Ca 0.19 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2b3w h ALA 100 Cb 0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2b3w h ALA 100 CO -0.02 0.65 0.20 -0.07 0.00 0.00 0.00 179.25 180.00 2b3w h LEU 101 N 0.67 0.71 -0.59 0.00 3.38 -0.07 0.85 115.31 120.26 2b3w h LEU 101 Ca 0.08 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2b3w h LEU 101 Cb 0.81 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2b3w h LEU 101 CO 0.07 0.69 0.26 -0.09 0.09 0.00 0.00 178.44 179.46 2b3w h ARG 102 N 0.69 0.87 -0.50 1.13 2.43 -0.93 -1.88 114.38 116.19 2b3w h ARG 102 Ca 0.17 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2b3w h ARG 102 Cb 0.20 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2b3w h ARG 102 CO -0.01 0.72 0.31 0.00 -1.51 0.00 0.00 179.97 179.47 2b3w h ALA 103 N 1.10 0.64 0.56 2.80 0.00 -0.83 0.29 119.26 123.82 2b3w h ALA 103 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2b3w h ALA 103 Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2b3w h ALA 103 CO -0.02 0.01 -0.45 -0.22 0.00 0.00 0.00 179.25 178.57 2b3w h LYS 104 N 0.61 -0.96 0.19 0.00 3.64 -0.47 -2.36 116.57 117.23 2b3w h LYS 104 Ca 0.20 0.07 -0.25 0.00 -1.27 0.00 0.00 60.65 59.39 2b3w h LYS 104 Cb -0.00 0.22 0.03 0.00 -0.41 0.00 0.00 32.23 32.07 2b3w h LYS 104 CO -0.08 -0.64 -1.12 0.74 -2.27 0.00 0.00 179.45 176.09 2b3w h PHE 105 N -0.99 0.74 0.00 1.91 0.04 -1.28 -2.98 116.94 114.38 2b3w h PHE 105 Ca -0.07 -0.54 -0.04 0.00 2.80 0.00 0.00 57.97 60.12 2b3w h PHE 105 Cb 0.84 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.96 2b3w h PHE 105 CO -0.19 1.43 -0.19 1.49 -0.60 0.00 0.00 178.31 180.25 2b3w h GLU 106 N -0.14 0.00 0.17 1.51 4.81 -0.51 -2.94 114.58 117.47 2b3w h GLU 106 Ca -0.20 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.71 2b3w h GLU 106 Cb 1.88 0.00 0.01 0.00 0.63 0.00 0.00 28.75 31.27 2b3w h GLU 106 CO 0.21 0.19 -1.57 1.96 -0.73 0.00 0.00 179.01 179.07 2b3w h GLN 107 N 0.00 0.35 -4.46 1.92 7.50 -1.53 -3.43 115.11 115.46 2b3w h GLN 107 Ca -0.00 -0.60 -0.73 0.00 0.50 0.00 0.00 58.65 57.82 2b3w h GLN 107 Cb 0.88 0.22 -0.21 0.00 0.05 0.00 0.00 27.48 28.42 2b3w h GLN 107 CO 0.02 1.25 -0.21 -1.01 -1.50 0.00 0.00 178.83 177.38 2b3w s HIS 108 N -2.61 3.19 0.52 2.96 3.76 -1.12 -4.91 115.29 117.08 2b3w s HIS 108 Ca -0.11 -0.87 0.20 0.00 -0.15 0.00 0.00 55.06 54.14 2b3w s HIS 108 Cb 0.06 -3.35 1.32 0.00 1.11 0.00 0.00 32.58 31.72 2b3w s HIS 108 CO 0.87 -0.90 2.09 0.00 -0.85 0.00 0.00 174.74 175.95 2b3w h ALA 109 N 8.85 2.21 -0.01 -1.40 0.00 -1.83 0.23 119.26 127.30 2b3w h ALA 109 Ca -0.28 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.64 2b3w h ALA 109 Cb 1.10 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2b3w h ALA 109 CO 0.92 -0.27 -0.14 0.93 0.00 0.00 0.00 179.25 180.69 2b3w h GLU 110 N 0.00 -0.22 0.03 0.00 3.07 -1.91 0.02 114.58 115.57 2b3w h GLU 110 Ca 0.11 0.02 -0.22 0.00 -0.50 0.00 0.00 59.36 58.76 2b3w h GLU 110 Cb 0.42 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 2b3w h GLU 110 CO -0.00 -0.15 -1.01 -0.07 -1.40 0.00 0.00 179.01 176.39 2b3w h LEU 111 N -0.23 0.13 -0.50 1.33 3.38 -1.49 -2.43 115.31 115.51 2b3w h LEU 111 Ca 0.05 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2b3w h LEU 111 Cb 0.30 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2b3w h LEU 111 CO -0.15 1.05 0.21 -0.09 0.09 0.00 0.00 178.44 179.55 2b3w h ARG 112 N 0.03 0.74 -0.27 1.13 2.43 -0.44 0.15 114.38 118.15 2b3w h ARG 112 Ca -0.04 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 58.89 2b3w h ARG 112 Cb 1.73 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 31.14 2b3w h ARG 112 CO 0.14 0.65 -0.31 0.00 -1.51 0.00 0.00 179.97 178.94 2b3w h ALA 113 N 1.05 0.95 -0.51 2.80 0.00 -1.00 -2.01 119.26 120.56 2b3w h ALA 113 Ca 0.17 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2b3w h ALA 113 Cb 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2b3w h ALA 113 CO -0.02 0.61 0.11 1.25 0.00 0.00 0.00 179.25 181.20 2b3w h LEU 114 N 0.49 0.78 -0.76 0.00 5.85 -0.95 0.89 115.31 121.61 2b3w h LEU 114 Ca 0.06 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 2b3w h LEU 114 Cb 0.78 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2b3w h LEU 114 CO 0.06 0.82 0.37 0.25 -0.34 0.00 0.00 178.44 179.60 2b3w h LEU 115 N 0.71 0.99 -0.14 2.25 5.85 -0.56 -1.56 115.31 122.84 2b3w h LEU 115 Ca 0.16 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2b3w h LEU 115 Cb 0.36 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.13 2b3w h LEU 115 CO 0.00 0.84 0.00 0.18 -0.34 0.00 0.00 178.44 179.13 2b3w n LEU 116 N -4.39 0.68 0.09 2.25 4.77 -0.77 -2.88 117.00 116.75 2b3w n LEU 116 Ca 0.07 0.58 -0.15 0.00 -0.03 0.00 0.00 56.01 56.48 2b3w n LEU 116 Cb 0.13 -0.39 -0.14 0.00 -2.33 0.00 0.00 43.42 40.69 2b3w n LEU 116 CO 0.39 -0.24 -0.10 0.00 -1.33 0.00 0.00 177.39 176.11 2b3w h ALA 117 N 2.52 0.17 0.00 -1.18 0.00 0.06 -3.21 119.26 117.62 2b3w h ALA 117 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2b3w h ALA 117 Cb 0.62 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2b3w h ALA 117 CO 0.00 1.04 0.00 0.25 0.00 0.00 0.00 179.25 180.54 2b3w n THR 118 N -3.49 0.57 -1.71 0.00 -2.24 -0.67 -4.23 114.28 102.52 2b3w n THR 118 Ca -0.10 0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.31 2b3w n THR 118 Cb 1.02 -0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 2b3w n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b3w n ALA 119 N -1.61 1.90 -3.11 6.98 0.00 -1.17 0.20 120.51 123.70 2b3w n ALA 119 Ca 0.05 0.39 -0.38 0.00 0.00 0.00 0.00 53.44 53.50 2b3w n ALA 119 Cb 0.29 -2.38 -0.02 0.00 0.00 0.00 0.00 19.45 17.34 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 2.22 3.94 -2.88 0.00 -0.04 -1.26 -4.51 135.00 132.47 2b3w n PRO 120 Ca 0.10 -4.61 -0.27 0.00 -0.04 0.00 0.00 63.50 58.68 2b3w n PRO 120 Cb 0.34 -2.43 -0.01 0.00 -0.04 0.00 0.00 33.50 31.36 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 -2.80 3.47 -0.53 0.55 0.00 0.13 -4.18 121.76 118.39 2b3w s ALA 121 Ca 0.34 -0.52 -0.23 0.00 0.00 0.00 0.00 51.96 51.55 2b3w s ALA 121 Cb 0.09 -2.50 0.04 0.00 0.00 0.00 0.00 23.12 20.76 2b3w s ALA 121 CO 0.06 -0.16 0.86 0.21 0.00 0.00 0.00 175.76 176.73 2b3w s LYS 122 N -4.37 3.29 -0.25 0.00 2.20 0.25 -4.89 119.74 115.97 2b3w s LYS 122 Ca 0.46 -0.39 -0.28 0.00 -0.36 0.00 0.00 55.97 55.40 2b3w s LYS 122 Cb -0.10 -4.06 0.01 0.00 -1.51 0.00 0.00 37.83 32.17 2b3w s LYS 122 CO 0.39 -1.41 1.00 -0.51 -0.36 0.00 0.00 175.35 174.47 2b3w s LEU 123 N 3.62 4.06 -0.06 5.43 1.43 -1.26 -1.79 118.68 130.10 2b3w s LEU 123 Ca 0.27 1.23 -0.00 0.00 -1.03 0.00 0.00 54.13 54.59 2b3w s LEU 123 Cb -0.14 -3.46 0.03 0.00 0.03 0.00 0.00 46.19 42.64 2b3w s LEU 123 CO 0.18 -0.69 -0.02 -0.69 0.23 0.00 0.00 176.35 175.36 2b3w s VAL 124 N 3.22 0.45 -0.13 -1.59 1.01 -0.78 -4.36 120.40 118.23 2b3w s VAL 124 Ca 0.42 0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.33 2b3w s VAL 124 Cb -0.14 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2b3w s VAL 124 CO 0.08 0.25 0.18 -0.70 0.00 0.00 0.00 175.10 174.92 2b3w s GLU 125 N 1.57 3.72 -1.12 2.72 2.12 -1.26 -0.95 118.70 125.49 2b3w s GLU 125 Ca -0.01 -0.06 -0.08 0.00 0.36 0.00 0.00 54.97 55.18 2b3w s GLU 125 Cb -0.13 -3.26 0.28 0.00 0.26 0.00 0.00 34.13 31.27 2b3w s GLU 125 CO -0.04 0.62 1.25 1.58 -0.54 0.00 0.00 175.26 178.13 2b3w n HIS 126 N 2.41 4.54 -3.32 5.30 -0.00 -0.71 -0.43 115.22 123.02 2b3w n HIS 126 Ca -0.18 -3.55 -0.46 0.00 -0.00 0.00 0.00 57.72 53.53 2b3w n HIS 126 Cb 0.54 -1.65 -0.04 0.00 -0.00 0.00 0.00 29.99 28.84 2b3w n HIS 126 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 2b3w s THR 127 N -1.36 5.41 -1.51 3.57 -1.32 -0.33 -4.79 115.64 115.31 2b3w s THR 127 Ca 0.32 -1.99 0.03 0.00 -1.21 0.00 0.00 61.69 58.84 2b3w s THR 127 Cb -0.06 -4.40 0.12 0.00 -1.51 0.00 0.00 72.50 66.65 2b3w s THR 127 CO -0.03 -0.95 0.92 -1.84 -2.21 0.00 0.00 174.62 170.51 2b3w n GLU 128 N 4.60 1.44 -0.07 7.08 0.28 -1.26 -3.47 120.64 129.24 2b3w n GLU 128 Ca 0.00 -0.48 -0.13 0.00 -0.16 0.00 0.00 57.16 56.39 2b3w n GLU 128 Cb 0.44 -1.33 -0.10 0.00 1.43 0.00 0.00 31.44 31.87 2b3w n GLU 128 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 2b3w h ASN 129 N 0.69 0.00 -2.56 -1.84 -0.73 -1.90 -3.46 115.58 105.78 2b3w h ASN 129 Ca 0.00 -0.71 -0.35 0.00 1.87 0.00 0.00 56.30 57.11 2b3w h ASN 129 Cb 0.42 0.00 -0.36 0.00 0.27 0.00 0.00 38.32 38.64 2b3w h ASN 129 CO 0.04 1.01 -0.65 -0.62 -0.37 0.00 0.00 177.43 176.84 2b3w s ASP 130 N -6.22 1.65 -1.12 1.15 -1.08 -1.23 -5.08 116.67 104.74 2b3w s ASP 130 Ca -0.18 -0.39 -0.21 0.00 -0.52 0.00 0.00 52.55 51.25 2b3w s ASP 130 Cb -0.01 0.28 0.04 0.00 -1.46 0.00 0.00 42.92 41.77 2b3w s ASP 130 CO 0.55 -0.34 1.63 0.00 0.52 0.00 0.00 175.17 177.53 2b3w s ALA 131 N 2.29 2.75 0.00 3.66 0.00 -1.26 -3.51 121.76 125.70 2b3w s ALA 131 Ca 0.07 -2.41 0.00 0.00 0.00 0.00 0.00 51.96 49.62 2b3w s ALA 131 Cb -0.16 -4.58 0.00 0.00 0.00 0.00 0.00 23.12 18.38 2b3w s ALA 131 CO -0.15 -3.74 0.00 0.98 0.00 0.00 0.00 175.76 172.85 2b3w n TYR 132 N 9.59 0.00 -3.55 0.00 9.36 -1.26 -4.79 117.16 126.51 2b3w n TYR 132 Ca 0.40 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 61.27 2b3w n TYR 132 Cb 0.49 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.13 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 -0.23 3.82 0.00 2.98 7.02 -1.23 -4.38 117.44 125.42 2b3w n TRP 133 Ca 0.00 -3.97 0.00 0.00 -1.02 0.00 0.00 57.50 52.51 2b3w n TRP 133 Cb 0.00 -1.01 0.00 0.00 -2.42 0.00 0.00 31.31 27.88 2b3w n TRP 133 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2b3w n GLY 134 N 1.90 0.41 3.74 6.99 0.00 0.67 -4.75 105.19 114.16 2b3w n GLY 134 Ca 0.24 -1.77 -0.40 0.00 0.00 0.00 0.00 46.02 44.09 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 -4.00 7.07 -0.11 1.61 2.15 0.43 -0.12 116.67 123.70 2b3w s ASP 135 Ca 0.00 1.28 0.01 0.00 0.43 0.00 0.00 52.55 54.26 2b3w s ASP 135 Cb 0.00 -2.42 0.14 0.00 -0.30 0.00 0.00 42.92 40.34 2b3w s ASP 135 CO 0.00 -0.01 1.40 0.61 -0.17 0.00 0.00 175.17 177.00 2b3w n GLY 136 N 2.66 2.73 1.90 2.66 0.00 -1.26 -1.18 105.19 112.71 2b3w n GLY 136 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 0.32 0.48 0.11 -0.02 0.00 -1.24 -4.65 105.19 100.19 2b3w n GLY 137 Ca 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.95 0.00 -0.06 1.61 1.44 -1.26 -4.92 115.22 109.08 2b3w n HIS 138 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2b3w n HIS 138 Cb 0.00 0.12 0.00 0.00 0.12 0.00 0.00 29.99 30.23 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 0.77 3.11 -1.39 0.00 -1.26 -5.01 105.19 101.41 2b3w n GLY 139 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2b3w n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b3w s LYS 140 N -0.94 0.40 0.07 1.61 2.20 -1.26 -4.97 119.74 116.85 2b3w s LYS 140 Ca 0.00 0.21 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 2b3w s LYS 140 Cb 0.00 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.45 2b3w s LYS 140 CO 0.00 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 174.71 2b3w n GLY 141 N 4.94 -0.02 2.68 5.54 0.00 -1.25 -4.44 105.19 112.64 2b3w n GLY 141 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 2b3w n GLY 141 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b3w s LYS 142 N -1.51 0.10 0.00 1.61 2.20 0.83 -4.71 119.74 118.27 2b3w s LYS 142 Ca 0.00 -0.08 0.05 0.00 -0.36 0.00 0.00 55.97 55.58 2b3w s LYS 142 Cb 0.00 0.00 0.28 0.00 -1.51 0.00 0.00 37.83 36.60 2b3w s LYS 142 CO 0.00 -0.13 0.66 -1.71 -0.36 0.00 0.00 175.35 173.81 2b3w n ASN 143 N 2.95 0.00 0.29 1.43 4.05 -1.13 -0.24 115.26 122.61 2b3w n ASN 143 Ca 0.08 -0.48 0.15 0.00 0.45 0.00 0.00 54.58 54.79 2b3w n ASN 143 Cb 0.65 0.00 0.87 0.00 1.23 0.00 0.00 39.78 42.53 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 0.00 1.20 2.43 -1.86 -1.25 114.38 114.90 2b3w h ARG 144 Ca 0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2b3w h ARG 144 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2b3w h ARG 144 CO 0.00 0.05 -0.05 1.25 -1.51 0.00 0.00 179.97 179.71 2b3w h LEU 145 N 0.00 -0.16 -1.44 3.80 5.85 -1.83 0.31 115.31 121.84 2b3w h LEU 145 Ca -0.00 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 2b3w h LEU 145 Cb 0.16 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2b3w h LEU 145 CO 0.01 -0.08 -0.28 1.23 -0.34 0.00 0.00 178.44 178.97 2b3w h GLY 146 N -0.10 0.00 1.23 3.75 0.00 -1.46 -2.22 103.07 104.28 2b3w h GLY 146 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.22 2b3w h GLY 146 CO -0.06 0.00 -0.30 -1.82 0.00 0.00 0.00 176.54 174.36 2b3w h TYR 147 N 0.00 1.00 -0.71 5.60 3.20 -0.57 -0.11 116.97 125.39 2b3w h TYR 147 Ca -0.00 -0.26 -0.01 0.00 3.14 0.00 0.00 58.73 61.59 2b3w h TYR 147 Cb 0.54 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 2b3w h TYR 147 CO 0.00 1.05 0.40 -0.07 -1.64 0.00 0.00 178.16 177.89 2b3w h LEU 148 N 0.73 0.86 -0.87 2.82 3.38 -0.01 0.22 115.31 122.44 2b3w h LEU 148 Ca 0.08 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2b3w h LEU 148 Cb 0.86 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2b3w h LEU 148 CO 0.08 0.69 0.06 -0.07 0.09 0.00 0.00 178.44 179.28 2b3w h LEU 149 N 0.98 0.86 0.15 1.67 3.38 -0.90 0.12 115.31 121.58 2b3w h LEU 149 Ca 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2b3w h LEU 149 Cb 0.01 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2b3w h LEU 149 CO -0.04 0.88 -0.07 0.24 0.09 0.00 0.00 178.44 179.54 2b3w h MET 150 N 0.84 -0.20 -0.58 1.13 2.86 -0.06 0.25 114.93 119.17 2b3w h MET 150 Ca 0.17 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.84 2b3w h MET 150 Cb 0.42 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 2b3w h MET 150 CO 0.01 -0.01 0.37 1.49 1.06 0.00 0.00 176.91 179.83 2b3w h GLU 151 N -0.36 0.71 -0.55 1.72 4.57 -0.83 -1.40 114.58 118.45 2b3w h GLU 151 Ca -0.02 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.00 2b3w h GLU 151 Cb 0.28 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.69 2b3w h GLU 151 CO 0.03 0.47 -0.10 1.25 -1.18 0.00 0.00 179.01 179.49 2b3w h LEU 152 N 0.73 1.03 -0.69 1.64 5.85 -0.92 -2.81 115.31 120.14 2b3w h LEU 152 Ca 0.23 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.64 2b3w h LEU 152 Cb -0.01 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.69 2b3w h LEU 152 CO -0.08 1.13 0.41 -0.09 -0.34 0.00 0.00 178.44 179.47 2b3w h ARG 153 N 0.91 0.76 -0.45 1.25 2.43 0.14 0.15 114.38 119.57 2b3w h ARG 153 Ca 0.14 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2b3w h ARG 153 Cb 0.66 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 2b3w h ARG 153 CO 0.05 0.50 0.21 0.93 -1.51 0.00 0.00 179.97 180.15 2b3w h GLU 154 N 0.79 0.41 0.13 0.20 3.07 -1.18 -1.14 114.58 116.86 2b3w h GLU 154 Ca 0.29 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.12 2b3w h GLU 154 Cb 0.10 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2b3w h GLU 154 CO -0.14 0.27 -0.06 0.37 -1.40 0.00 0.00 179.01 178.04 2b3w h GLN 155 N 0.42 -0.17 -0.06 2.33 -0.00 -0.97 -1.14 115.11 115.52 2b3w h GLN 155 Ca 0.20 0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.83 2b3w h GLN 155 Cb 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.64 2b3w h GLN 155 CO -0.16 -0.07 -0.13 -0.07 0.00 0.00 0.00 178.83 178.40 2b3w h LEU 156 N -0.23 0.09 -0.08 -2.39 3.38 -0.58 0.26 115.31 115.75 2b3w h LEU 156 Ca -0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2b3w h LEU 156 Cb 0.18 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2b3w h LEU 156 CO 0.03 0.23 -0.06 0.00 0.09 0.00 0.00 178.44 178.74 2b3w h ALA 157 N 1.78 0.12 -0.68 1.53 0.00 -0.97 -2.94 119.26 118.10 2b3w h ALA 157 Ca 0.02 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2b3w h ALA 157 Cb 0.29 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2b3w h ALA 157 CO 0.02 -0.10 0.20 0.82 0.00 0.00 0.00 179.25 180.19 2b3w h ILE 158 N -0.21 1.25 -0.42 0.00 2.04 -0.22 0.19 117.51 120.14 2b3w h ILE 158 Ca 0.02 -0.90 0.05 0.00 1.00 0.00 0.00 64.86 65.03 2b3w h ILE 158 Cb 0.53 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 2b3w h ILE 158 CO 0.02 0.35 0.15 -0.08 0.00 0.00 0.00 178.15 178.58 2b3w h GLU 159 N 1.02 0.30 0.00 2.37 4.22 -0.55 -0.85 114.58 121.09 2b3w h GLU 159 Ca 0.22 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.64 2b3w h GLU 159 Cb 0.31 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2b3w h GLU 159 CO -0.00 0.20 -0.32 -0.22 -2.18 0.00 0.00 179.01 176.48 2b3w h LYS 160 N 0.31 0.00 0.00 1.92 3.64 -1.32 -2.95 116.57 118.16 2b3w h LYS 160 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2b3w h LYS 160 Cb 0.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2b3w h LYS 160 CO -0.20 0.00 0.00 1.25 -2.27 0.00 0.00 179.45 178.23 2b3w h LEU 161 N 0.00 0.00 -0.08 5.20 5.85 0.54 -2.47 115.31 124.34 2b3w h LEU 161 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2b3w h LEU 161 Cb 0.80 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.83 2b3w h LEU 161 CO 0.00 0.00 0.00 -0.62 -0.34 0.00 0.00 178.44 177.48 2b3w n GLU 162 N -2.94 0.73 -1.55 1.25 1.02 -0.44 -4.78 120.64 113.93 2b3w n GLU 162 Ca 0.02 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.91 2b3w n GLU 162 Cb 0.34 -1.03 -0.07 0.00 -0.02 0.00 0.00 31.44 30.66 2b3w n GLU 162 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2b3w n HIS 163 N -0.45 1.18 -3.79 -0.32 1.44 -0.93 -4.88 115.22 107.47 2b3w n HIS 163 Ca 0.00 0.06 -0.34 0.00 -2.01 0.00 0.00 57.72 55.43 2b3w n HIS 163 Cb 0.02 -2.49 -0.11 0.00 0.12 0.00 0.00 29.99 27.52 2b3w n HIS 163 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 2b3w s HIS 164 N 12.59 3.35 -0.37 -1.40 -3.43 -1.26 -4.78 115.29 119.99 2b3w s HIS 164 Ca 1.00 -2.86 0.00 0.00 -0.80 0.00 0.00 55.06 52.40 2b3w s HIS 164 Cb -0.25 -3.08 0.00 0.00 -1.43 0.00 0.00 32.58 27.81 2b3w s HIS 164 CO 0.21 -0.82 0.00 1.58 -2.00 0.00 0.00 174.74 173.71 2b3w n HIS 165 N 3.40 0.00 -0.21 0.38 -0.00 -1.26 -4.82 115.22 112.71 2b3w n HIS 165 Ca 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.71 2b3w n HIS 165 Cb 0.36 -1.90 0.03 0.00 -0.00 0.00 0.00 29.99 28.48 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 0.90 0.00 1.57 6.17 -1.93 -3.40 115.15 118.46 2b3w h HIS 166 Ca -0.07 -0.07 0.00 0.00 0.71 0.00 0.00 60.37 60.94 2b3w h HIS 166 Cb 0.87 -0.27 0.00 0.00 2.52 0.00 0.00 27.41 30.54 2b3w h HIS 166 CO 0.51 0.72 -0.10 1.58 0.71 0.00 0.00 177.93 181.34 2b3w n HIS 167 N -4.47 0.00 -1.70 5.26 -0.00 -1.26 -5.23 115.22 107.82 2b3w n HIS 167 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.75 2b3w n HIS 167 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.15 2b3w n HIS 167 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92