#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdp s ASP 32 N 0.00 4.01 0.60 -2.13 2.15 -1.26 -4.98 116.67 115.06 2wdp s ASP 32 Ca 0.00 -1.40 0.29 0.00 0.43 0.00 0.00 52.55 51.87 2wdp s ASP 32 Cb 0.00 -1.19 1.63 0.00 -0.30 0.00 0.00 42.92 43.06 2wdp s ASP 32 CO 0.00 -0.29 2.02 -0.65 -0.17 0.00 0.00 175.17 176.08 2wdp h PRO 33 N 7.93 0.00 -0.72 4.34 0.11 -2.07 -0.62 132.00 140.97 2wdp h PRO 33 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2wdp h PRO 33 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2wdp h PRO 33 CO 0.44 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.23 2wdp n ALA 34 N -2.27 2.38 -1.73 -0.75 0.00 -1.26 -4.95 120.51 111.93 2wdp n ALA 34 Ca 0.03 -1.28 -0.42 0.00 0.00 0.00 0.00 53.44 51.77 2wdp n ALA 34 Cb 0.43 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 2wdp n ALA 34 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wdp n GLU 35 N 1.66 2.40 -4.26 0.00 2.13 -0.24 -4.84 120.64 117.49 2wdp n GLU 35 Ca 0.24 0.85 -0.17 0.00 0.66 0.00 0.00 57.16 58.74 2wdp n GLU 35 Cb 0.62 -2.52 -0.11 0.00 0.27 0.00 0.00 31.44 29.71 2wdp n GLU 35 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2wdp s LYS 36 N -1.56 1.08 0.42 5.31 -2.85 -1.26 -1.70 119.74 119.18 2wdp s LYS 36 Ca 0.58 -1.35 -0.26 0.00 -1.00 0.00 0.00 55.97 53.93 2wdp s LYS 36 Cb -0.53 -0.84 -0.10 0.00 -2.06 0.00 0.00 37.83 34.30 2wdp s LYS 36 CO 0.59 0.14 1.38 0.66 0.10 0.00 0.00 175.35 178.22 2wdp n TYR 37 N 0.18 2.54 -2.54 1.78 4.01 -0.36 -4.83 117.16 117.94 2wdp n TYR 37 Ca -0.13 0.47 -0.43 0.00 -0.16 0.00 0.00 57.90 57.65 2wdp n TYR 37 Cb 0.59 -2.44 -0.02 0.00 -0.31 0.00 0.00 39.34 37.15 2wdp n TYR 37 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2wdp s LYS 38 N -2.27 4.27 -0.31 -0.72 1.02 -1.26 -4.85 119.74 115.62 2wdp s LYS 38 Ca 0.59 1.53 0.10 0.00 0.02 0.00 0.00 55.97 58.21 2wdp s LYS 38 Cb -0.48 -3.68 0.46 0.00 -0.52 0.00 0.00 37.83 33.62 2wdp s LYS 38 CO 0.59 -0.61 1.15 -1.33 -0.92 0.00 0.00 175.35 174.22 2wdp n MET 39 N 6.20 3.12 -0.83 1.68 2.81 -1.26 -4.71 117.12 124.12 2wdp n MET 39 Ca 0.12 -4.07 0.01 0.00 -1.81 0.00 0.00 57.70 51.96 2wdp n MET 39 Cb 0.46 -2.10 0.18 0.00 -0.71 0.00 0.00 33.22 31.04 2wdp n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2wdp n ASP 40 N -0.61 2.19 -4.70 7.83 5.68 -1.26 -4.97 116.55 120.70 2wdp n ASP 40 Ca 0.35 -3.86 -0.29 0.00 -0.50 0.00 0.00 54.79 50.49 2wdp n ASP 40 Cb 0.88 -0.50 0.12 0.00 -1.14 0.00 0.00 41.12 40.48 2wdp n ASP 40 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2wdp s HIS 41 N -3.26 2.51 0.22 2.11 3.76 -1.26 -4.97 115.29 114.40 2wdp s HIS 41 Ca 0.40 0.70 -0.09 0.00 -0.15 0.00 0.00 55.06 55.93 2wdp s HIS 41 Cb 0.38 -3.56 0.22 0.00 1.11 0.00 0.00 32.58 30.72 2wdp s HIS 41 CO -0.05 -2.18 1.87 -0.09 -0.85 0.00 0.00 174.74 173.44 2wdp h ARG 42 N -1.35 0.99 -6.32 1.40 2.43 -1.88 -3.44 114.38 106.21 2wdp h ARG 42 Ca -0.47 -0.06 -0.59 0.00 -0.81 0.00 0.00 59.98 58.05 2wdp h ARG 42 Cb 1.31 -0.22 -0.22 0.00 -0.42 0.00 0.00 29.97 30.42 2wdp h ARG 42 CO 0.59 0.66 -0.84 1.03 -1.51 0.00 0.00 179.97 179.90 2wdp s ARG 43 N -6.11 1.19 0.14 0.20 0.52 0.21 -5.04 118.95 110.06 2wdp s ARG 43 Ca -0.13 -1.21 -0.14 0.00 -0.52 0.00 0.00 55.73 53.73 2wdp s ARG 43 Cb 0.16 -1.50 0.01 0.00 0.52 0.00 0.00 34.95 34.14 2wdp s ARG 43 CO 0.78 0.35 1.64 -0.09 0.02 0.00 0.00 175.30 178.00 2wdp h ARG 44 N 4.01 0.75 0.00 3.54 9.65 -1.85 -2.13 114.38 128.34 2wdp h ARG 44 Ca -0.47 -0.19 0.00 0.00 -1.10 0.00 0.00 59.98 58.22 2wdp h ARG 44 Cb 1.18 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 2wdp h ARG 44 CO 0.40 0.75 0.00 0.41 2.80 0.00 0.00 179.97 184.32 2wdp n GLY 45 N -0.57 0.76 3.84 2.80 0.00 -1.26 -1.65 105.19 109.10 2wdp n GLY 45 Ca 0.01 -2.22 -0.36 0.00 0.00 0.00 0.00 46.02 43.45 2wdp n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wdp s ILE 46 N -0.85 4.85 -0.34 -0.61 1.01 -1.26 -1.22 121.20 122.79 2wdp s ILE 46 Ca 0.00 0.87 -0.01 0.00 0.00 0.00 0.00 60.65 61.51 2wdp s ILE 46 Cb 0.00 -3.75 0.07 0.00 0.01 0.00 0.00 42.46 38.79 2wdp s ILE 46 CO 0.00 0.29 0.06 0.00 0.00 0.00 0.00 174.94 175.30 2wdp s ALA 47 N -1.41 2.92 -0.26 9.38 0.00 -0.37 -1.83 121.76 130.20 2wdp s ALA 47 Ca 0.36 -2.08 -0.20 0.00 0.00 0.00 0.00 51.96 50.05 2wdp s ALA 47 Cb -0.16 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.87 2wdp s ALA 47 CO 0.19 -1.47 0.60 -1.17 0.00 0.00 0.00 175.76 173.91 2wdp s LEU 48 N 1.18 4.06 -0.38 0.00 0.20 0.01 -0.80 118.68 122.95 2wdp s LEU 48 Ca 0.00 0.65 -0.09 0.00 0.69 0.00 0.00 54.13 55.39 2wdp s LEU 48 Cb -0.21 -2.81 0.05 0.00 -0.43 0.00 0.00 46.19 42.80 2wdp s LEU 48 CO -0.03 -0.35 0.19 -0.63 -0.29 0.00 0.00 176.35 175.24 2wdp s ILE 49 N 2.46 4.22 -0.27 6.68 1.01 0.62 0.12 121.20 136.04 2wdp s ILE 49 Ca 0.25 -1.13 -0.08 0.00 0.00 0.00 0.00 60.65 59.69 2wdp s ILE 49 Cb -0.15 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.85 2wdp s ILE 49 CO 0.09 -0.31 0.10 0.12 0.00 0.00 0.00 174.94 174.93 2wdp s PHE 50 N 1.46 3.12 -0.38 3.97 5.36 0.81 -1.43 117.98 130.90 2wdp s PHE 50 Ca 0.01 -0.50 -0.14 0.00 -0.96 0.00 0.00 56.93 55.34 2wdp s PHE 50 Cb -0.21 -2.27 0.01 0.00 -0.34 0.00 0.00 43.02 40.21 2wdp s PHE 50 CO 0.04 -0.40 0.28 -0.80 -1.46 0.00 0.00 175.22 172.88 2wdp s ASN 51 N 1.61 6.10 -0.52 6.13 -0.87 0.10 -0.89 114.94 126.60 2wdp s ASN 51 Ca 0.06 -0.70 -0.28 0.00 -1.57 0.00 0.00 52.86 50.36 2wdp s ASN 51 Cb -0.16 -2.15 0.02 0.00 -0.02 0.00 0.00 41.25 38.94 2wdp s ASN 51 CO 0.04 -0.37 1.26 -2.28 -2.57 0.00 0.00 177.10 173.19 2wdp s HIS 52 N 1.72 2.56 0.00 2.20 5.65 -0.34 -2.80 115.29 124.27 2wdp s HIS 52 Ca 0.06 0.56 0.00 0.00 0.25 0.00 0.00 55.06 55.93 2wdp s HIS 52 Cb -0.18 -4.44 0.00 0.00 -1.18 0.00 0.00 32.58 26.78 2wdp s HIS 52 CO 0.10 -1.65 0.00 0.39 -0.65 0.00 0.00 174.74 172.93 2wdp n GLU 53 N 8.26 3.04 -2.22 2.88 -0.58 -1.26 -4.54 120.64 126.22 2wdp n GLU 53 Ca 0.12 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.49 2wdp n GLU 53 Cb 0.49 -0.92 -0.01 0.00 -0.57 0.00 0.00 31.44 30.44 2wdp n GLU 53 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2wdp s ARG 54 N -1.81 3.73 0.00 3.49 1.70 -1.26 -2.76 118.95 122.04 2wdp s ARG 54 Ca 0.00 1.82 0.00 0.00 -0.47 0.00 0.00 55.73 57.08 2wdp s ARG 54 Cb 0.00 -2.42 0.00 0.00 -0.57 0.00 0.00 34.95 31.96 2wdp s ARG 54 CO 0.00 -0.58 0.00 1.19 -1.08 0.00 0.00 175.30 174.83 2wdp n PHE 55 N -0.48 0.00 -3.07 5.89 3.72 -1.26 -4.77 117.46 117.49 2wdp n PHE 55 Ca 0.07 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.16 2wdp n PHE 55 Cb 0.48 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.97 2wdp n PHE 55 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 2wdp s PHE 56 N -2.72 3.42 0.00 1.38 5.36 -1.11 -4.24 117.98 120.06 2wdp s PHE 56 Ca 0.00 1.09 0.00 0.00 -0.96 0.00 0.00 56.93 57.06 2wdp s PHE 56 Cb 0.00 -2.45 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 2wdp s PHE 56 CO 0.00 0.04 0.00 0.91 -1.46 0.00 0.00 175.22 174.71 2wdp n TRP 57 N -0.72 0.00 -2.23 10.12 5.03 -1.26 -4.95 117.44 123.42 2wdp n TRP 57 Ca 0.03 0.00 -0.43 0.00 3.03 0.00 0.00 57.50 60.13 2wdp n TRP 57 Cb 0.53 0.00 -0.02 0.00 -1.03 0.00 0.00 31.31 30.79 2wdp n TRP 57 CO 0.00 0.00 0.00 -1.01 -0.03 0.00 0.00 177.69 176.65 2wdp s HIS 58 N -0.46 2.23 -0.45 -5.99 3.76 -1.26 -4.89 115.29 108.24 2wdp s HIS 58 Ca 0.00 0.66 0.04 0.00 -0.15 0.00 0.00 55.06 55.61 2wdp s HIS 58 Cb 0.00 -4.19 0.43 0.00 1.11 0.00 0.00 32.58 29.92 2wdp s HIS 58 CO 0.00 -2.33 1.30 -0.11 -0.85 0.00 0.00 174.74 172.75 2wdp n LEU 59 N 9.08 5.30 -4.27 0.89 -0.00 -1.26 -5.02 117.00 121.71 2wdp n LEU 59 Ca 0.18 -4.95 -0.28 0.00 -0.00 0.00 0.00 56.01 50.96 2wdp n LEU 59 Cb 0.47 -0.52 0.23 0.00 -0.00 0.00 0.00 43.42 43.60 2wdp n LEU 59 CO 0.69 2.09 0.06 0.35 -0.00 0.00 0.00 177.39 180.57 2wdp n THR 60 N -0.60 0.00 -0.13 1.96 -2.24 -1.26 -4.45 114.28 107.56 2wdp n THR 60 Ca 0.44 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.83 2wdp n THR 60 Cb 0.72 -0.79 -0.09 0.00 -2.10 0.00 0.00 70.33 68.07 2wdp n THR 60 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2wdp h LEU 61 N -2.75 -1.78 -0.89 3.22 5.85 -1.99 -2.31 115.31 114.67 2wdp h LEU 61 Ca -0.49 0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.55 2wdp h LEU 61 Cb 1.25 0.73 -0.11 0.00 0.37 0.00 0.00 40.66 42.89 2wdp h LEU 61 CO 0.35 -0.39 -0.49 -2.65 -0.34 0.00 0.00 178.44 174.92 2wdp n PRO 62 N -5.24 -0.36 -0.16 5.25 -0.02 -1.26 -0.10 135.00 133.12 2wdp n PRO 62 Ca -0.03 1.35 -0.07 0.00 -2.02 0.00 0.00 63.50 62.72 2wdp n PRO 62 Cb 0.32 -1.98 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 2wdp n PRO 62 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2wdp h GLU 63 N 0.00 0.63 -0.28 -0.52 5.08 -1.77 0.31 114.58 118.04 2wdp h GLU 63 Ca 0.17 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.32 2wdp h GLU 63 Cb 0.40 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2wdp h GLU 63 CO -0.84 0.43 -0.51 -0.09 -1.00 0.00 0.00 179.01 176.99 2wdp h ARG 64 N 0.64 0.78 0.03 2.33 2.43 -1.15 -2.30 114.38 117.14 2wdp h ARG 64 Ca 0.17 -0.48 -0.25 0.00 -0.81 0.00 0.00 59.98 58.61 2wdp h ARG 64 Cb -0.06 0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2wdp h ARG 64 CO -0.04 1.11 -1.04 0.00 -1.51 0.00 0.00 179.97 178.49 2wdp h ARG 65 N 0.61 0.54 -0.16 0.20 3.08 -0.26 -3.05 114.38 115.33 2wdp h ARG 65 Ca 0.02 -0.61 0.05 0.00 0.07 0.00 0.00 59.98 59.51 2wdp h ARG 65 Cb 1.10 0.18 -0.05 0.00 0.08 0.00 0.00 29.97 31.28 2wdp h ARG 65 CO 0.11 1.23 -0.15 0.78 -1.07 0.00 0.00 179.97 180.87 2wdp h GLY 66 N 0.83 -0.05 0.68 0.04 0.00 -0.12 -1.28 103.07 103.18 2wdp h GLY 66 Ca -0.12 0.18 0.04 0.00 0.00 0.00 0.00 47.33 47.43 2wdp h GLY 66 CO 0.19 -0.15 0.08 -0.84 0.00 0.00 0.00 176.54 175.82 2wdp h THR 67 N -0.17 0.88 -0.36 4.70 2.02 -1.41 -0.35 112.91 118.22 2wdp h THR 67 Ca 0.10 -0.07 -0.14 0.00 0.77 0.00 0.00 66.41 67.08 2wdp h THR 67 Cb 0.32 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 2wdp h THR 67 CO -0.26 0.04 -0.33 0.00 0.37 0.00 0.00 175.52 175.34 2wdp h ALA 69 N 0.96 0.12 -0.41 0.00 0.00 -0.86 0.18 119.26 119.25 2wdp h ALA 69 Ca 0.07 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2wdp h ALA 69 Cb 0.87 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2wdp h ALA 69 CO 0.08 -0.53 0.20 -0.44 0.00 0.00 0.00 179.25 178.56 2wdp h ASP 70 N -0.09 0.53 -0.26 0.00 3.32 -0.83 0.10 116.42 119.19 2wdp h ASP 70 Ca 0.17 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2wdp h ASP 70 Cb 0.35 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 2wdp h ASP 70 CO -0.40 0.50 0.17 -0.09 -1.72 0.00 0.00 179.24 177.70 2wdp h ARG 71 N 0.52 0.34 -0.56 3.56 2.43 -0.68 0.12 114.38 120.13 2wdp h ARG 71 Ca 0.14 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.21 2wdp h ARG 71 Cb 0.11 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2wdp h ARG 71 CO -0.02 0.23 0.04 -0.44 -1.51 0.00 0.00 179.97 178.28 2wdp h ASP 72 N 0.35 0.93 0.11 -3.80 3.32 -0.44 -0.51 116.42 116.38 2wdp h ASP 72 Ca 0.10 -0.29 0.01 0.00 0.02 0.00 0.00 57.03 56.87 2wdp h ASP 72 Cb -0.04 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 2wdp h ASP 72 CO -0.02 0.98 -0.14 -1.13 -1.72 0.00 0.00 179.24 177.21 2wdp h ASN 73 N 0.84 -0.39 -0.70 6.45 -0.73 -0.50 -2.12 115.58 118.43 2wdp h ASN 73 Ca 0.16 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.36 2wdp h ASN 73 Cb 0.48 0.14 -0.03 0.00 0.27 0.00 0.00 38.32 39.18 2wdp h ASN 73 CO 0.02 -0.22 0.37 -0.07 -0.37 0.00 0.00 177.43 177.16 2wdp h LEU 74 N -0.30 0.90 -0.94 0.34 3.38 -0.64 -1.69 115.31 116.36 2wdp h LEU 74 Ca 0.01 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2wdp h LEU 74 Cb 0.30 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2wdp h LEU 74 CO -0.06 0.75 0.36 0.74 0.09 0.00 0.00 178.44 180.32 2wdp h THR 75 N 1.01 1.25 -0.09 0.22 2.02 -0.71 -1.26 112.91 115.34 2wdp h THR 75 Ca 0.25 -0.70 -0.11 0.00 0.77 0.00 0.00 66.41 66.62 2wdp h THR 75 Cb 0.07 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 2wdp h THR 75 CO -0.04 0.30 -0.36 -0.09 0.37 0.00 0.00 175.52 175.70 2wdp h ARG 76 N 1.11 0.41 -0.13 6.66 2.43 -1.08 -0.63 114.38 123.15 2wdp h ARG 76 Ca 0.27 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2wdp h ARG 76 Cb 0.13 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2wdp h ARG 76 CO -0.03 0.95 0.05 0.00 -1.51 0.00 0.00 179.97 179.42 2wdp h ARG 77 N -0.04 0.20 -0.31 0.20 2.47 -1.12 -1.91 114.38 113.87 2wdp h ARG 77 Ca -0.02 -0.04 -0.09 0.00 -1.26 0.00 0.00 59.98 58.57 2wdp h ARG 77 Cb 1.00 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.28 2wdp h ARG 77 CO 0.08 0.30 -0.20 0.74 0.56 0.00 0.00 179.97 181.44 2wdp h PHE 78 N 0.05 0.65 -0.56 3.04 0.04 -1.29 -2.63 116.94 116.24 2wdp h PHE 78 Ca 0.04 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 2wdp h PHE 78 Cb 0.18 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 2wdp h PHE 78 CO -0.01 0.75 0.31 0.77 -0.60 0.00 0.00 178.31 179.53 2wdp h SER 79 N 0.52 0.70 0.05 2.17 0.02 -1.00 -1.23 113.55 114.79 2wdp h SER 79 Ca 0.08 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2wdp h SER 79 Cb 0.64 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 2wdp h SER 79 CO 0.05 0.59 -0.02 0.44 -1.14 0.00 0.00 176.83 176.75 2wdp h ASP 80 N 0.76 0.00 -0.24 3.07 3.32 -1.11 0.31 116.42 122.53 2wdp h ASP 80 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2wdp h ASP 80 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2wdp h ASP 80 CO -0.03 0.02 0.00 0.18 -1.72 0.00 0.00 179.24 177.69 2wdp n LEU 81 N -3.79 1.83 0.00 1.55 4.77 -0.56 -4.89 117.00 115.90 2wdp n LEU 81 Ca -0.03 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 2wdp n LEU 81 Cb 0.10 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2wdp n LEU 81 CO 0.27 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 2wdp n GLY 82 N 1.13 0.15 3.77 -0.72 0.00 0.10 -4.89 105.19 104.72 2wdp n GLY 82 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2wdp n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wdp s PHE 83 N -2.00 2.64 -0.47 1.61 0.08 -0.64 -4.22 117.98 114.97 2wdp s PHE 83 Ca 0.00 1.54 -0.21 0.00 0.12 0.00 0.00 56.93 58.38 2wdp s PHE 83 Cb 0.00 -3.27 0.03 0.00 -0.57 0.00 0.00 43.02 39.22 2wdp s PHE 83 CO 0.00 -1.64 0.71 -2.00 -0.10 0.00 0.00 175.22 172.19 2wdp s GLU 84 N -3.50 3.27 -0.12 0.44 2.12 -0.36 -4.33 118.70 116.22 2wdp s GLU 84 Ca 0.71 -0.44 -0.23 0.00 0.36 0.00 0.00 54.97 55.38 2wdp s GLU 84 Cb -0.23 -4.00 -0.03 0.00 0.26 0.00 0.00 34.13 30.13 2wdp s GLU 84 CO 0.31 -1.15 0.70 0.08 -0.54 0.00 0.00 175.26 174.66 2wdp s VAL 85 N 3.02 5.01 -0.11 3.70 1.01 -1.26 -1.24 120.40 130.53 2wdp s VAL 85 Ca 0.23 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.64 2wdp s VAL 85 Cb -0.15 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.22 2wdp s VAL 85 CO 0.18 0.18 -0.18 -0.54 0.00 0.00 0.00 175.10 174.74 2wdp s LYS 86 N 1.29 2.48 -0.03 2.72 -0.14 0.02 -4.95 119.74 121.13 2wdp s LYS 86 Ca 0.35 -0.66 0.02 0.00 -1.36 0.00 0.00 55.97 54.33 2wdp s LYS 86 Cb -0.17 -2.05 -0.03 0.00 -1.68 0.00 0.00 37.83 33.90 2wdp s LYS 86 CO 0.15 -0.03 -0.08 0.00 -0.76 0.00 0.00 175.35 174.64 2wdp s PHE 88 N -0.89 0.18 0.31 0.00 -0.12 -0.51 -4.95 117.98 112.00 2wdp s PHE 88 Ca 0.14 -0.80 0.05 0.00 -0.05 0.00 0.00 56.93 56.27 2wdp s PHE 88 Cb -0.11 0.75 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2wdp s PHE 88 CO 0.04 -1.51 0.18 0.27 -0.05 0.00 0.00 175.22 174.15 2wdp n ASN 89 N -1.34 0.28 -0.85 1.98 0.23 -1.26 -0.72 115.26 113.58 2wdp n ASN 89 Ca -0.07 -2.83 0.08 0.00 -0.53 0.00 0.00 54.58 51.23 2wdp n ASN 89 Cb 0.60 1.14 0.23 0.00 -2.08 0.00 0.00 39.78 39.67 2wdp n ASN 89 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2wdp n ASP 90 N -1.76 3.65 -0.07 0.53 5.68 -1.12 -4.63 116.55 118.83 2wdp n ASP 90 Ca 0.01 -2.68 -0.00 0.00 -0.50 0.00 0.00 54.79 51.61 2wdp n ASP 90 Cb 0.51 -0.45 0.28 0.00 -1.14 0.00 0.00 41.12 40.32 2wdp n ASP 90 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2wdp h LEU 91 N 1.98 0.62 -9.17 -2.12 3.38 -1.93 -3.35 115.31 104.73 2wdp h LEU 91 Ca 0.00 -0.08 -0.64 0.00 0.09 0.00 0.00 57.88 57.25 2wdp h LEU 91 Cb 1.24 -0.16 -0.15 0.00 0.09 0.00 0.00 40.66 41.67 2wdp h LEU 91 CO 0.16 0.59 -0.58 -0.75 0.09 0.00 0.00 178.44 177.96 2wdp s LYS 92 N -5.25 3.69 0.54 1.13 2.20 -1.26 -4.93 119.74 115.86 2wdp s LYS 92 Ca -0.09 -0.35 0.22 0.00 -0.36 0.00 0.00 55.97 55.39 2wdp s LYS 92 Cb 0.16 -3.09 1.42 0.00 -1.51 0.00 0.00 37.83 34.81 2wdp s LYS 92 CO 0.77 0.41 2.12 0.00 -0.36 0.00 0.00 175.35 178.29 2wdp h ALA 93 N 6.19 2.04 0.01 3.13 0.00 -1.95 -3.37 119.26 125.32 2wdp h ALA 93 Ca -0.41 -0.01 -0.41 0.00 0.00 0.00 0.00 54.91 54.09 2wdp h ALA 93 Cb 1.18 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 2wdp h ALA 93 CO 0.65 -0.21 -2.41 -0.85 0.00 0.00 0.00 179.25 176.44 2wdp n GLU 94 N -4.32 0.63 -0.11 0.00 0.28 -1.26 -4.15 120.64 111.72 2wdp n GLU 94 Ca 0.01 0.22 0.08 0.00 -0.16 0.00 0.00 57.16 57.31 2wdp n GLU 94 Cb 0.25 -1.54 0.29 0.00 1.43 0.00 0.00 31.44 31.88 2wdp n GLU 94 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2wdp n GLU 95 N -3.67 1.70 0.03 3.44 0.28 -1.26 -3.35 120.64 117.81 2wdp n GLU 95 Ca -0.47 -1.07 -0.13 0.00 -0.16 0.00 0.00 57.16 55.33 2wdp n GLU 95 Cb 0.95 -1.33 -0.09 0.00 1.43 0.00 0.00 31.44 32.39 2wdp n GLU 95 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2wdp h LEU 96 N 1.98 -0.10 -0.73 -1.84 5.85 -1.72 -2.51 115.31 116.24 2wdp h LEU 96 Ca 0.00 -0.38 0.01 0.00 0.84 0.00 0.00 57.88 58.35 2wdp h LEU 96 Cb 0.44 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 2wdp h LEU 96 CO 0.00 0.35 0.48 -0.07 -0.34 0.00 0.00 178.44 178.86 2wdp h LEU 97 N -0.58 0.83 -0.26 2.25 4.07 -1.73 0.39 115.31 120.28 2wdp h LEU 97 Ca -0.01 -0.02 0.02 0.00 0.08 0.00 0.00 57.88 57.95 2wdp h LEU 97 Cb 0.48 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 2wdp h LEU 97 CO 0.02 0.60 -0.18 -0.07 -1.08 0.00 0.00 178.44 177.72 2wdp h LEU 98 N 0.98 -0.65 -1.73 1.67 4.07 -1.61 1.33 115.31 119.36 2wdp h LEU 98 Ca 0.27 0.10 0.12 0.00 0.08 0.00 0.00 57.88 58.45 2wdp h LEU 98 Cb -0.10 0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.89 2wdp h LEU 98 CO -0.06 -0.09 0.41 0.11 -1.08 0.00 0.00 178.44 177.73 2wdp h LYS 99 N -0.04 0.27 0.17 1.13 1.79 -0.93 0.15 116.57 119.11 2wdp h LYS 99 Ca 0.04 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 2wdp h LYS 99 Cb 0.15 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2wdp h LYS 99 CO -0.26 0.18 -0.08 0.82 -1.08 0.00 0.00 179.45 179.03 2wdp h ILE 100 N 0.28 0.90 0.00 1.86 2.04 0.20 -2.55 117.51 120.25 2wdp h ILE 100 Ca 0.29 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.09 2wdp h ILE 100 Cb 0.74 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2wdp h ILE 100 CO -0.07 0.22 0.00 1.57 0.00 0.00 0.00 178.15 179.87 2wdp n HIS 101 N -4.95 0.00 0.04 1.37 -0.00 0.43 -1.19 115.22 110.93 2wdp n HIS 101 Ca -0.08 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.00 2wdp n HIS 101 Cb 0.27 -0.34 -0.13 0.00 -0.12 0.00 0.00 29.99 29.66 2wdp n HIS 101 CO 0.00 0.00 0.00 1.49 0.46 0.00 0.00 176.34 178.29 2wdp h GLU 102 N 0.00 0.06 0.00 1.57 4.81 -0.61 -3.07 114.58 117.34 2wdp h GLU 102 Ca 0.00 -0.10 -0.20 0.00 -0.13 0.00 0.00 59.36 58.93 2wdp h GLU 102 Cb 0.28 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2wdp h GLU 102 CO 0.00 0.90 -1.06 -0.39 -0.73 0.00 0.00 179.01 177.73 2wdp h VAL 103 N 0.02 1.23 -0.99 0.32 -1.51 -0.72 -3.08 116.25 111.51 2wdp h VAL 103 Ca -0.13 -2.86 0.10 0.00 -1.23 0.00 0.00 66.70 62.58 2wdp h VAL 103 Cb 1.89 2.59 -0.08 0.00 -2.13 0.00 0.00 31.29 33.55 2wdp h VAL 103 CO 0.13 0.70 0.63 0.28 -1.23 0.00 0.00 177.57 178.08 2wdp h SER 104 N 0.00 0.95 -0.02 4.19 0.02 -1.34 -2.95 113.55 114.39 2wdp h SER 104 Ca -0.08 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2wdp h SER 104 Cb 1.71 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 64.08 2wdp h SER 104 CO 0.10 0.54 -0.14 1.07 -1.14 0.00 0.00 176.83 177.27 2wdp n THR 105 N -4.57 0.00 -2.11 -2.27 5.66 -1.16 -4.94 114.28 104.90 2wdp n THR 105 Ca 0.17 -0.43 -0.41 0.00 -3.05 0.00 0.00 64.05 60.33 2wdp n THR 105 Cb 0.29 1.31 -0.02 0.00 -1.55 0.00 0.00 70.33 70.36 2wdp n THR 105 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2wdp s VAL 106 N -1.68 2.72 0.05 1.08 1.01 -1.12 -4.99 120.40 117.47 2wdp s VAL 106 Ca 0.18 0.71 -0.27 0.00 0.00 0.00 0.00 61.98 62.60 2wdp s VAL 106 Cb 0.14 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 2wdp s VAL 106 CO 0.30 0.16 0.83 -0.55 0.00 0.00 0.00 175.10 175.85 2wdp s SER 107 N -0.38 7.29 -0.19 3.32 0.15 -1.26 -4.96 113.70 117.67 2wdp s SER 107 Ca 0.50 1.55 0.16 0.00 0.70 0.00 0.00 55.95 58.85 2wdp s SER 107 Cb -0.40 -2.51 0.64 0.00 -1.71 0.00 0.00 66.02 62.04 2wdp s SER 107 CO 0.52 -0.04 1.54 1.41 1.20 0.00 0.00 173.24 177.87 2wdp n HIS 108 N 2.95 1.36 -0.35 3.44 -0.00 -1.26 -4.68 115.22 116.68 2wdp n HIS 108 Ca -0.00 -0.81 0.13 0.00 -0.00 0.00 0.00 57.72 57.03 2wdp n HIS 108 Cb 0.50 -0.38 0.32 0.00 -0.00 0.00 0.00 29.99 30.43 2wdp n HIS 108 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2wdp h ALA 109 N 2.66 1.68 -0.58 -1.41 0.00 -1.93 -1.67 119.26 118.01 2wdp h ALA 109 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2wdp h ALA 109 Cb 1.62 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2wdp h ALA 109 CO 0.32 -0.04 0.00 -0.25 0.00 0.00 0.00 179.25 179.28 2wdp n ASP 110 N -4.74 5.74 -4.35 0.00 8.00 -1.26 -4.95 116.55 114.98 2wdp n ASP 110 Ca 0.23 -2.91 -0.28 0.00 0.71 0.00 0.00 54.79 52.54 2wdp n ASP 110 Cb 0.56 -0.68 -0.13 0.00 -0.02 0.00 0.00 41.12 40.84 2wdp n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wdp s ALA 111 N -2.73 2.21 0.08 2.24 0.00 -0.63 -0.62 121.76 122.31 2wdp s ALA 111 Ca 0.55 -1.37 -0.14 0.00 0.00 0.00 0.00 51.96 50.99 2wdp s ALA 111 Cb 0.42 -0.36 -0.17 0.00 0.00 0.00 0.00 23.12 23.00 2wdp s ALA 111 CO 0.17 0.49 1.27 -0.44 0.00 0.00 0.00 175.76 177.24 2wdp h ASP 112 N 4.09 0.85 -1.34 0.00 3.32 -0.81 -3.46 116.42 119.06 2wdp h ASP 112 Ca -0.49 -0.65 0.02 0.00 0.02 0.00 0.00 57.03 55.93 2wdp h ASP 112 Cb 1.17 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.46 2wdp h ASP 112 CO 0.40 1.36 0.12 0.00 -1.72 0.00 0.00 179.24 179.40 2wdp s PHE 114 N -6.05 -0.27 -0.04 0.00 5.36 -0.79 -4.02 117.98 112.18 2wdp s PHE 114 Ca 0.05 0.66 0.06 0.00 -0.96 0.00 0.00 56.93 56.75 2wdp s PHE 114 Cb -0.01 0.05 -0.01 0.00 -0.34 0.00 0.00 43.02 42.70 2wdp s PHE 114 CO 0.02 -0.17 -0.23 0.08 -1.46 0.00 0.00 175.22 173.46 2wdp s VAL 115 N 0.76 1.86 -0.05 3.12 1.01 -0.76 -1.07 120.40 125.26 2wdp s VAL 115 Ca -0.05 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 60.94 2wdp s VAL 115 Cb -0.07 -1.56 0.03 0.00 0.00 0.00 0.00 36.38 34.78 2wdp s VAL 115 CO -0.04 0.52 -0.00 0.00 0.00 0.00 0.00 175.10 175.57 2wdp s VAL 117 N 1.50 4.74 -0.34 0.00 1.01 0.12 -1.38 120.40 126.04 2wdp s VAL 117 Ca -0.03 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 2wdp s VAL 117 Cb -0.13 -3.17 0.03 0.00 0.00 0.00 0.00 36.38 33.11 2wdp s VAL 117 CO -0.03 0.41 0.15 0.12 0.00 0.00 0.00 175.10 175.75 2wdp s PHE 118 N 0.80 3.23 -0.09 5.22 5.36 0.66 -0.13 117.98 133.03 2wdp s PHE 118 Ca 0.04 -1.09 -0.09 0.00 -0.96 0.00 0.00 56.93 54.83 2wdp s PHE 118 Cb -0.13 -2.35 -0.04 0.00 -0.34 0.00 0.00 43.02 40.15 2wdp s PHE 118 CO 0.02 -0.65 0.21 -0.51 -1.46 0.00 0.00 175.22 172.83 2wdp s LEU 119 N 1.50 4.41 0.23 6.12 1.43 -0.07 -1.30 118.68 130.99 2wdp s LEU 119 Ca 0.01 0.60 -0.05 0.00 -1.03 0.00 0.00 54.13 53.66 2wdp s LEU 119 Cb -0.19 -2.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 2wdp s LEU 119 CO 0.05 0.39 0.26 -0.94 0.23 0.00 0.00 176.35 176.33 2wdp s SER 120 N -1.04 0.16 -0.21 2.29 1.04 -1.25 -1.20 113.70 113.48 2wdp s SER 120 Ca 0.17 -1.26 -0.13 0.00 0.48 0.00 0.00 55.95 55.21 2wdp s SER 120 Cb -0.13 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.41 2wdp s SER 120 CO 0.06 -0.96 0.29 -1.00 0.98 0.00 0.00 173.24 172.61 2wdp s HIS 121 N -4.05 3.36 0.07 5.02 0.09 -1.26 -4.97 115.29 113.55 2wdp s HIS 121 Ca 0.33 0.45 -0.31 0.00 -0.00 0.00 0.00 55.06 55.54 2wdp s HIS 121 Cb 0.04 -2.40 -0.07 0.00 -0.00 0.00 0.00 32.58 30.15 2wdp s HIS 121 CO 0.12 0.04 1.44 0.20 -0.00 0.00 0.00 174.74 176.54 2wdp s GLY 122 N 0.99 1.85 -0.56 -2.22 0.00 -1.26 -4.05 107.32 102.08 2wdp s GLY 122 Ca 0.14 1.05 -0.03 0.00 0.00 0.00 0.00 44.72 45.88 2wdp s GLY 122 CO 0.06 2.50 0.48 1.18 0.00 0.00 0.00 173.10 177.32 2wdp n GLU 123 N 4.74 -3.24 -1.66 2.90 4.71 -1.26 -4.78 120.64 122.05 2wdp n GLU 123 Ca 0.13 0.35 -0.31 0.00 -0.01 0.00 0.00 57.16 57.32 2wdp n GLU 123 Cb 0.42 -3.91 0.04 0.00 -1.01 0.00 0.00 31.44 26.98 2wdp n GLU 123 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2wdp s GLY 124 N -3.21 1.66 1.25 0.62 0.00 -1.05 -4.95 107.32 101.65 2wdp s GLY 124 Ca 0.20 0.02 -0.17 0.00 0.00 0.00 0.00 44.72 44.77 2wdp s GLY 124 CO 0.30 0.32 1.00 0.54 0.00 0.00 0.00 173.10 175.27 2wdp s ASN 125 N -3.91 0.31 0.30 1.64 2.20 -1.26 -4.04 114.94 110.18 2wdp s ASN 125 Ca 0.57 1.16 0.02 0.00 -0.94 0.00 0.00 52.86 53.67 2wdp s ASN 125 Cb -0.13 -1.75 0.47 0.00 -2.00 0.00 0.00 41.25 37.84 2wdp s ASN 125 CO 0.55 -4.56 1.78 0.45 -2.94 0.00 0.00 177.10 172.38 2wdp h HIS 126 N -2.87 0.59 0.39 1.54 3.86 -1.91 -1.69 115.15 115.07 2wdp h HIS 126 Ca -0.54 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 58.56 2wdp h HIS 126 Cb 1.34 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.65 2wdp h HIS 126 CO -1.18 0.65 -0.19 0.82 0.86 0.00 0.00 177.93 178.90 2wdp h ILE 127 N 0.51 0.55 -0.61 2.45 1.08 -1.92 0.76 117.51 120.32 2wdp h ILE 127 Ca 0.09 -0.50 0.13 0.00 -0.39 0.00 0.00 64.86 64.19 2wdp h ILE 127 Cb 0.51 0.77 -0.11 0.00 -3.07 0.00 0.00 36.82 34.91 2wdp h ILE 127 CO 0.03 0.08 -0.10 0.22 -0.69 0.00 0.00 178.15 177.70 2wdp h TYR 128 N -0.84 -0.22 -0.54 1.37 3.20 -1.71 0.80 116.97 119.02 2wdp h TYR 128 Ca -0.05 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2wdp h TYR 128 Cb 0.54 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 2wdp h TYR 128 CO 0.01 -0.23 0.29 0.00 -1.64 0.00 0.00 178.16 176.60 2wdp h ALA 129 N 1.60 0.70 -0.30 1.82 0.00 -1.23 -1.30 119.26 120.54 2wdp h ALA 129 Ca 0.31 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2wdp h ALA 129 Cb 0.48 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2wdp h ALA 129 CO -0.60 0.22 0.05 -0.92 0.00 0.00 0.00 179.25 178.01 2wdp h TYR 130 N 0.73 0.54 -0.17 0.00 3.20 -0.27 -2.78 116.97 118.22 2wdp h TYR 130 Ca 0.19 -0.08 0.05 0.00 3.14 0.00 0.00 58.73 62.03 2wdp h TYR 130 Cb 0.06 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.13 2wdp h TYR 130 CO -0.01 0.59 -0.16 0.22 -1.64 0.00 0.00 178.16 177.15 2wdp h ASP 131 N 0.32 -0.52 -0.85 -2.11 3.58 -0.79 -2.39 116.42 113.66 2wdp h ASP 131 Ca 0.09 0.10 0.20 0.00 0.42 0.00 0.00 57.03 57.84 2wdp h ASP 131 Cb 0.35 0.25 -0.12 0.00 1.72 0.00 0.00 39.33 41.53 2wdp h ASP 131 CO 0.01 -0.21 0.31 0.00 -2.88 0.00 0.00 179.24 176.47 2wdp h ALA 132 N 0.89 1.27 -0.25 -0.78 0.00 -1.00 -0.73 119.26 118.67 2wdp h ALA 132 Ca 0.11 0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.22 2wdp h ALA 132 Cb 0.35 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2wdp h ALA 132 CO -0.28 -0.34 0.07 0.87 0.00 0.00 0.00 179.25 179.57 2wdp h LYS 133 N 0.35 0.18 -0.53 0.00 1.57 -1.17 -1.00 116.57 115.97 2wdp h LYS 133 Ca 0.51 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.28 2wdp h LYS 133 Cb 0.95 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 2wdp h LYS 133 CO -0.53 0.12 0.31 0.82 -0.57 0.00 0.00 179.45 179.60 2wdp h ILE 134 N 0.18 1.16 -0.51 1.86 1.08 -1.01 -1.00 117.51 119.28 2wdp h ILE 134 Ca 0.11 -0.38 -0.07 0.00 -0.39 0.00 0.00 64.86 64.13 2wdp h ILE 134 Cb 0.09 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.27 2wdp h ILE 134 CO -0.12 0.17 0.04 -0.33 -0.69 0.00 0.00 178.15 177.21 2wdp h GLU 135 N 0.71 0.83 -0.14 2.37 5.08 -0.87 -0.19 114.58 122.37 2wdp h GLU 135 Ca 0.19 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 2wdp h GLU 135 Cb -0.00 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2wdp h GLU 135 CO -0.03 0.81 -0.38 0.82 -1.00 0.00 0.00 179.01 179.22 2wdp h ILE 136 N 0.78 1.36 -0.78 3.13 2.04 -0.95 0.60 117.51 123.69 2wdp h ILE 136 Ca 0.16 -1.67 0.10 0.00 1.00 0.00 0.00 64.86 64.45 2wdp h ILE 136 Cb 0.42 2.06 -0.08 0.00 -0.74 0.00 0.00 36.82 38.48 2wdp h ILE 136 CO 0.01 0.50 0.41 -0.61 0.00 0.00 0.00 178.15 178.47 2wdp h GLN 137 N 0.11 0.66 -0.04 2.37 4.15 -0.88 -1.33 115.11 120.15 2wdp h GLN 137 Ca -0.01 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 2wdp h GLN 137 Cb 1.00 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.54 2wdp h GLN 137 CO 0.08 0.44 -0.06 1.15 -1.93 0.00 0.00 178.83 178.51 2wdp h THR 138 N 0.68 1.42 0.28 2.39 2.02 -0.81 -2.12 112.91 116.77 2wdp h THR 138 Ca 0.39 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 2wdp h THR 138 Cb 0.41 2.21 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 2wdp h THR 138 CO -0.28 0.36 -0.13 -0.07 0.37 0.00 0.00 175.52 175.77 2wdp h LEU 139 N -0.39 -0.32 -0.76 2.58 3.38 -0.71 -2.64 115.31 116.45 2wdp h LEU 139 Ca 0.00 -0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.06 2wdp h LEU 139 Cb 0.62 0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.36 2wdp h LEU 139 CO 0.01 -0.16 0.33 0.71 0.09 0.00 0.00 178.44 179.43 2wdp h THR 140 N -0.46 0.71 0.00 0.22 1.35 -1.31 -2.02 112.91 111.40 2wdp h THR 140 Ca -0.04 -0.17 -0.02 0.00 -0.55 0.00 0.00 66.41 65.63 2wdp h THR 140 Cb 0.35 0.16 -0.00 0.00 -1.73 0.00 0.00 68.15 66.92 2wdp h THR 140 CO 0.06 0.09 -0.08 1.23 -0.25 0.00 0.00 175.52 176.58 2wdp h GLY 141 N 0.51 0.00 2.00 5.82 0.00 -1.02 -0.57 103.07 109.81 2wdp h GLY 141 Ca 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.73 2wdp h GLY 141 CO -0.37 0.00 -0.02 1.41 0.00 0.00 0.00 176.54 177.57 2wdp h LEU 142 N 0.00 0.00 -1.77 3.11 3.38 -1.15 -3.11 115.31 115.78 2wdp h LEU 142 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wdp h LEU 142 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2wdp h LEU 142 CO 0.01 0.02 0.00 0.49 0.09 0.00 0.00 178.44 179.05 2wdp n PHE 143 N -3.15 0.10 -1.62 1.13 3.72 -0.23 -4.41 117.46 113.00 2wdp n PHE 143 Ca -0.01 -0.14 -0.41 0.00 -0.05 0.00 0.00 57.45 56.84 2wdp n PHE 143 Cb 0.23 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 38.77 2wdp n PHE 143 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2wdp n LYS 144 N 0.42 1.36 -0.27 -1.08 5.02 -1.18 -4.59 118.16 117.84 2wdp n LYS 144 Ca 0.06 0.49 0.33 0.00 -2.02 0.00 0.00 58.31 57.17 2wdp n LYS 144 Cb 0.26 -2.08 0.73 0.00 -0.02 0.00 0.00 35.03 33.92 2wdp n LYS 144 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2wdp h GLY 145 N 1.49 0.00 2.00 0.72 0.00 -1.90 0.49 103.07 105.86 2wdp h GLY 145 Ca -0.45 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2wdp h GLY 145 CO 0.56 0.00 -0.06 -0.55 0.00 0.00 0.00 176.54 176.50 2wdp h ASP 146 N 0.00 0.00 0.00 0.19 3.45 -1.94 -3.20 116.42 114.91 2wdp h ASP 146 Ca 0.52 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.98 2wdp h ASP 146 Cb 2.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.98 2wdp h ASP 146 CO -0.01 0.06 -0.41 0.29 -1.57 0.00 0.00 179.24 177.60 2wdp n LYS 147 N -3.88 3.97 -3.61 3.56 5.02 0.16 -4.91 118.16 118.47 2wdp n LYS 147 Ca -0.03 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.97 2wdp n LYS 147 Cb 0.15 -0.70 -0.13 0.00 -0.02 0.00 0.00 35.03 34.34 2wdp n LYS 147 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wdp h HIS 149 N 6.88 0.04 0.00 0.00 3.86 -1.88 -2.15 115.15 121.91 2wdp h HIS 149 Ca 0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2wdp h HIS 149 Cb 0.95 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.41 2wdp h HIS 149 CO 0.46 0.53 0.00 -1.13 0.86 0.00 0.00 177.93 178.65 2wdp n SER 150 N -3.95 0.00 -0.68 2.45 3.41 -1.26 -1.84 113.62 111.75 2wdp n SER 150 Ca -0.02 -0.28 0.07 0.00 -0.26 0.00 0.00 58.87 58.38 2wdp n SER 150 Cb 0.52 -0.21 0.14 0.00 -0.26 0.00 0.00 64.21 64.40 2wdp n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wdp n LEU 151 N -1.21 2.76 -4.73 1.04 4.77 -0.82 -4.24 117.00 114.56 2wdp n LEU 151 Ca 0.14 -1.65 -0.42 0.00 -0.03 0.00 0.00 56.01 54.06 2wdp n LEU 151 Cb 0.17 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 2wdp n LEU 151 CO 0.18 0.64 1.19 -0.69 -1.33 0.00 0.00 177.39 177.38 2wdp s VAL 152 N -1.04 2.51 0.00 4.08 1.01 -0.77 -0.60 120.40 125.59 2wdp s VAL 152 Ca 0.23 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2wdp s VAL 152 Cb 0.13 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.26 2wdp s VAL 152 CO 0.18 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2wdp n GLY 153 N 2.83 0.81 3.71 4.51 0.00 -1.26 -5.02 105.19 110.77 2wdp n GLY 153 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 2wdp n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdp s LYS 154 N -0.18 2.59 0.18 1.61 1.02 0.23 -4.97 119.74 120.21 2wdp s LYS 154 Ca 0.00 -0.92 -0.31 0.00 0.02 0.00 0.00 55.97 54.75 2wdp s LYS 154 Cb 0.00 -2.51 -0.10 0.00 -0.52 0.00 0.00 37.83 34.70 2wdp s LYS 154 CO 0.00 0.50 1.58 -2.14 -0.92 0.00 0.00 175.35 174.37 2wdp s PRO 155 N -2.68 4.21 -0.26 -1.68 0.02 -1.26 -4.79 135.00 128.55 2wdp s PRO 155 Ca 0.28 2.39 0.01 0.00 0.02 0.00 0.00 61.00 63.70 2wdp s PRO 155 Cb -0.11 -3.14 0.07 0.00 0.02 0.00 0.00 34.50 31.34 2wdp s PRO 155 CO 0.20 -0.61 -0.03 0.15 -0.33 0.00 0.00 177.00 176.37 2wdp s LYS 156 N 1.02 1.57 -0.25 5.54 1.02 -0.37 -1.89 119.74 126.38 2wdp s LYS 156 Ca 0.70 -1.13 -0.02 0.00 0.02 0.00 0.00 55.97 55.53 2wdp s LYS 156 Cb -0.44 -2.63 0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2wdp s LYS 156 CO 0.32 -0.67 -0.05 0.42 -0.92 0.00 0.00 175.35 174.45 2wdp s ILE 157 N 1.33 2.97 -0.18 2.17 1.01 -0.23 -0.76 121.20 127.50 2wdp s ILE 157 Ca -0.03 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 59.64 2wdp s ILE 157 Cb -0.19 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 2wdp s ILE 157 CO -0.08 0.22 -0.07 -0.36 0.00 0.00 0.00 174.94 174.65 2wdp s PHE 158 N 1.35 2.93 -0.27 3.97 0.08 -0.22 -1.00 117.98 124.81 2wdp s PHE 158 Ca 0.01 -0.74 -0.07 0.00 0.12 0.00 0.00 56.93 56.25 2wdp s PHE 158 Cb -0.16 -2.00 -0.00 0.00 -0.57 0.00 0.00 43.02 40.28 2wdp s PHE 158 CO -0.04 -0.36 0.07 0.42 -0.10 0.00 0.00 175.22 175.21 2wdp s ILE 159 N 0.94 4.01 -0.19 0.64 1.01 -0.48 0.71 121.20 127.85 2wdp s ILE 159 Ca -0.01 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.13 2wdp s ILE 159 Cb -0.15 -2.99 0.02 0.00 0.01 0.00 0.00 42.46 39.36 2wdp s ILE 159 CO 0.00 0.19 -0.19 -0.63 0.00 0.00 0.00 174.94 174.32 2wdp s ILE 160 N 1.53 2.09 -0.62 2.92 1.01 0.23 -0.24 121.20 128.12 2wdp s ILE 160 Ca 0.04 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.47 2wdp s ILE 160 Cb -0.16 -1.92 0.09 0.00 0.01 0.00 0.00 42.46 40.47 2wdp s ILE 160 CO 0.02 0.47 0.82 -1.58 0.00 0.00 0.00 174.94 174.67 2wdp s GLN 161 N 1.27 3.08 0.59 2.79 0.74 -0.42 -1.25 119.66 126.46 2wdp s GLN 161 Ca 0.03 -1.06 -0.17 0.00 0.05 0.00 0.00 55.36 54.22 2wdp s GLN 161 Cb -0.14 -4.24 -0.04 0.00 1.10 0.00 0.00 33.01 29.70 2wdp s GLN 161 CO -0.12 -1.65 1.08 0.00 -0.55 0.00 0.00 175.29 174.05 2wdp s ALA 162 N 3.32 2.68 0.06 1.58 0.00 -1.26 -3.88 121.76 124.26 2wdp s ALA 162 Ca 0.17 0.53 0.06 0.00 0.00 0.00 0.00 51.96 52.71 2wdp s ALA 162 Cb -0.20 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 2wdp s ALA 162 CO 0.09 -0.86 -0.16 0.00 0.00 0.00 0.00 175.76 174.82 2wdp s ARG 164 N -1.48 3.49 0.31 0.00 1.81 -1.26 -4.92 118.95 116.89 2wdp s ARG 164 Ca 0.02 -0.27 0.25 0.00 -1.72 0.00 0.00 55.73 54.01 2wdp s ARG 164 Cb -0.09 -3.05 0.68 0.00 -0.45 0.00 0.00 34.95 32.05 2wdp s ARG 164 CO 0.02 0.62 1.72 0.78 -0.68 0.00 0.00 175.30 177.77 2wdp h GLY 165 N 3.52 0.00 0.00 -3.53 0.00 -1.83 -2.77 103.07 98.45 2wdp h GLY 165 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2wdp h GLY 165 CO 0.71 0.00 0.00 2.41 0.00 0.00 0.00 176.54 179.66 2wdp n THR 199 N -2.58 0.00 -0.73 4.70 -1.04 -1.26 -4.75 114.28 108.62 2wdp n THR 199 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2wdp n THR 199 Cb 0.45 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 2wdp n THR 199 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2wdp n LEU 200 N 0.00 0.00 -4.80 -4.42 7.94 -1.26 -5.11 117.00 109.36 2wdp n LEU 200 Ca 0.00 0.00 -0.36 0.00 -1.11 0.00 0.00 56.01 54.54 2wdp n LEU 200 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 2wdp n LEU 200 CO 0.00 0.01 0.55 -2.84 -1.11 0.00 0.00 177.39 174.00 2wdp s PRO 201 N 0.00 4.42 -0.28 1.96 0.02 -1.26 -5.07 135.00 134.79 2wdp s PRO 201 Ca 0.00 1.11 -0.25 0.00 0.02 0.00 0.00 61.00 61.88 2wdp s PRO 201 Cb 0.00 -2.80 0.13 0.00 0.02 0.00 0.00 34.50 31.85 2wdp s PRO 201 CO 0.00 0.31 1.07 0.00 -0.33 0.00 0.00 177.00 178.05 2wdp s ALA 202 N -1.61 -2.00 0.27 -1.55 0.00 -1.26 -4.98 121.76 110.64 2wdp s ALA 202 Ca 0.48 1.86 -0.18 0.00 0.00 0.00 0.00 51.96 54.11 2wdp s ALA 202 Cb -0.17 -1.47 0.07 0.00 0.00 0.00 0.00 23.12 21.54 2wdp s ALA 202 CO 0.22 -0.22 0.92 0.41 0.00 0.00 0.00 175.76 177.09 2wdp n GLY 203 N 2.16 0.77 3.76 0.00 0.00 -1.26 -5.06 105.19 105.56 2wdp n GLY 203 Ca -0.12 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 2wdp n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdp s ALA 204 N -2.05 3.53 -0.48 4.61 0.00 -1.26 -2.46 121.76 123.65 2wdp s ALA 204 Ca 0.20 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.42 2wdp s ALA 204 Cb -0.04 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2wdp s ALA 204 CO 0.08 -0.65 0.00 -0.25 0.00 0.00 0.00 175.76 174.94 2wdp n ASP 205 N 1.34 -4.30 -4.83 0.00 8.00 -0.36 -4.89 116.55 111.52 2wdp n ASP 205 Ca 0.02 0.11 -0.35 0.00 0.71 0.00 0.00 54.79 55.28 2wdp n ASP 205 Cb 0.42 -2.20 -0.06 0.00 -0.02 0.00 0.00 41.12 39.26 2wdp n ASP 205 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2wdp s PHE 206 N -1.92 3.56 -0.15 1.24 0.08 -1.03 -1.24 117.98 118.52 2wdp s PHE 206 Ca 0.00 1.32 -0.01 0.00 0.12 0.00 0.00 56.93 58.36 2wdp s PHE 206 Cb 0.00 -2.58 0.04 0.00 -0.57 0.00 0.00 43.02 39.91 2wdp s PHE 206 CO 0.00 0.27 -0.03 -1.17 -0.10 0.00 0.00 175.22 174.19 2wdp s LEU 207 N -2.29 1.33 -0.21 -0.37 2.96 0.06 -0.53 118.68 119.64 2wdp s LEU 207 Ca 0.46 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.74 2wdp s LEU 207 Cb -0.15 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.73 2wdp s LEU 207 CO 0.20 -0.20 0.06 -0.04 -1.32 0.00 0.00 176.35 175.05 2wdp s MET 208 N 1.73 3.85 -0.15 1.98 -1.94 0.11 -1.06 119.30 123.83 2wdp s MET 208 Ca 0.02 -0.40 0.01 0.00 -1.71 0.00 0.00 55.69 53.61 2wdp s MET 208 Cb -0.15 -3.25 0.00 0.00 2.01 0.00 0.00 34.83 33.45 2wdp s MET 208 CO -0.07 0.10 -0.18 0.00 -0.01 0.00 0.00 175.02 174.86 2wdp s TYR 210 N 0.82 2.52 0.44 0.00 2.02 -0.24 0.74 117.35 123.65 2wdp s TYR 210 Ca -0.06 -0.74 0.20 0.00 -0.37 0.00 0.00 57.07 56.10 2wdp s TYR 210 Cb -0.15 -1.65 1.22 0.00 -0.40 0.00 0.00 41.96 40.98 2wdp s TYR 210 CO -0.01 -0.23 2.04 0.66 -1.57 0.00 0.00 175.55 176.44 2wdp h SER 211 N 6.20 0.00 -4.44 2.29 4.64 -1.47 -2.20 113.55 118.58 2wdp h SER 211 Ca -0.30 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.94 2wdp h SER 211 Cb 1.19 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.07 2wdp h SER 211 CO 0.48 0.15 -0.01 0.54 -0.87 0.00 0.00 176.83 177.12 2wdp s VAL 212 N -4.45 0.01 0.78 0.95 0.11 -1.26 -3.82 120.40 112.71 2wdp s VAL 212 Ca -0.04 -0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 58.82 2wdp s VAL 212 Cb 0.15 -0.83 0.06 0.00 -1.53 0.00 0.00 36.38 34.22 2wdp s VAL 212 CO 0.64 -0.05 1.10 0.00 -3.33 0.00 0.00 175.10 173.47 2wdp s ALA 213 N -0.42 2.44 -0.66 1.54 0.00 -1.09 -4.83 121.76 118.73 2wdp s ALA 213 Ca -0.06 -0.29 0.05 0.00 0.00 0.00 0.00 51.96 51.67 2wdp s ALA 213 Cb -0.03 -3.07 0.28 0.00 0.00 0.00 0.00 23.12 20.30 2wdp s ALA 213 CO 0.04 -1.58 1.10 -1.91 0.00 0.00 0.00 175.76 173.41 2wdp n GLU 214 N -3.32 0.03 -0.05 0.00 4.07 -1.26 -4.11 120.64 116.00 2wdp n GLU 214 Ca 0.07 0.48 -0.06 0.00 -0.06 0.00 0.00 57.16 57.60 2wdp n GLU 214 Cb 0.57 -1.69 -0.02 0.00 -0.06 0.00 0.00 31.44 30.24 2wdp n GLU 214 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2wdp n GLY 215 N -1.39 -0.47 0.00 8.31 0.00 -1.26 -5.11 105.19 105.27 2wdp n GLY 215 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2wdp n GLY 215 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wdp n TYR 216 N -3.80 -3.28 -0.50 1.61 9.36 -1.26 -5.11 117.16 114.18 2wdp n TYR 216 Ca -0.09 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 60.85 2wdp n TYR 216 Cb 0.33 0.00 0.26 0.00 -0.63 0.00 0.00 39.34 39.30 2wdp n TYR 216 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 2wdp s TYR 217 N -0.92 1.26 0.00 2.98 6.14 -1.26 -4.89 117.35 120.66 2wdp s TYR 217 Ca 0.00 1.14 0.00 0.00 0.64 0.00 0.00 57.07 58.85 2wdp s TYR 217 Cb 0.00 -3.07 0.00 0.00 0.42 0.00 0.00 41.96 39.31 2wdp s TYR 217 CO 0.00 -4.04 0.00 0.45 0.64 0.00 0.00 175.55 172.60 2wdp n SER 218 N -5.04 0.00 -4.42 4.32 2.88 -1.26 -3.87 113.62 106.23 2wdp n SER 218 Ca 0.02 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.14 2wdp n SER 218 Cb 0.54 0.47 0.00 0.00 -0.75 0.00 0.00 64.21 64.48 2wdp n SER 218 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2wdp n HIS 219 N -2.49 -0.84 -2.10 0.66 -0.00 -1.26 -5.00 115.22 104.20 2wdp n HIS 219 Ca 0.00 0.62 -0.30 0.00 0.46 0.00 0.00 57.72 58.50 2wdp n HIS 219 Cb 0.00 -1.94 0.01 0.00 -0.12 0.00 0.00 29.99 27.94 2wdp n HIS 219 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 2wdp s ARG 220 N -1.43 3.41 0.31 1.57 1.70 -1.26 -4.90 118.95 118.35 2wdp s ARG 220 Ca 0.62 0.51 -0.29 0.00 -0.47 0.00 0.00 55.73 56.11 2wdp s ARG 220 Cb -0.62 -2.16 -0.10 0.00 -0.57 0.00 0.00 34.95 31.50 2wdp s ARG 220 CO 0.59 -0.57 1.35 -2.00 -1.08 0.00 0.00 175.30 173.59 2wdp s GLU 221 N -5.09 4.32 0.42 3.89 2.56 -1.26 -4.78 118.70 118.76 2wdp s GLU 221 Ca 0.54 2.25 0.00 0.00 0.00 0.00 0.00 54.97 57.76 2wdp s GLU 221 Cb -0.11 -3.07 -0.00 0.00 2.00 0.00 0.00 34.13 32.95 2wdp s GLU 221 CO 0.51 -0.26 0.00 0.25 -0.56 0.00 0.00 175.26 175.20 2wdp n THR 222 N 1.13 0.00 -0.34 -1.70 -2.24 -0.56 -4.57 114.28 106.00 2wdp n THR 222 Ca 0.02 -1.97 0.11 0.00 -2.27 0.00 0.00 64.05 59.93 2wdp n THR 222 Cb 0.41 0.40 0.31 0.00 -2.10 0.00 0.00 70.33 69.35 2wdp n THR 222 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2wdp h VAL 223 N 1.22 0.80 -0.32 2.28 2.07 -1.91 -0.16 116.25 120.22 2wdp h VAL 223 Ca -0.35 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2wdp h VAL 223 Cb 1.05 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2wdp h VAL 223 CO 0.57 0.15 0.00 0.59 0.02 0.00 0.00 177.57 178.90 2wdp n ASN 224 N -4.67 1.81 0.00 0.57 3.02 -1.26 -3.81 115.26 110.92 2wdp n ASN 224 Ca 0.21 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.80 2wdp n ASN 224 Cb 0.49 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 2wdp n ASN 224 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wdp n GLY 225 N 1.06 -1.55 3.84 7.41 0.00 -0.10 -4.73 105.19 111.12 2wdp n GLY 225 Ca 0.12 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.78 2wdp n GLY 225 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wdp s SER 226 N -4.00 5.89 0.18 1.61 1.04 -1.26 -1.49 113.70 115.68 2wdp s SER 226 Ca 0.00 0.11 -0.20 0.00 0.48 0.00 0.00 55.95 56.34 2wdp s SER 226 Cb 0.00 -1.69 0.12 0.00 0.10 0.00 0.00 66.02 64.55 2wdp s SER 226 CO 0.00 0.17 1.59 -0.50 0.98 0.00 0.00 173.24 175.48 2wdp h TRP 227 N 3.20 -0.85 -0.55 5.02 6.55 -1.90 0.41 115.95 127.83 2wdp h TRP 227 Ca -0.46 0.07 -0.01 0.00 0.95 0.00 0.00 58.89 59.44 2wdp h TRP 227 Cb 1.16 0.45 -0.03 0.00 -0.86 0.00 0.00 29.16 29.89 2wdp h TRP 227 CO 0.61 -0.37 0.31 -0.92 -1.05 0.00 0.00 178.44 177.02 2wdp h TYR 228 N -0.16 0.74 -0.25 0.49 3.20 -1.95 0.22 116.97 119.26 2wdp h TYR 228 Ca 0.23 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 2wdp h TYR 228 Cb 0.54 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 2wdp h TYR 228 CO -0.60 0.53 -0.21 0.82 -1.64 0.00 0.00 178.16 177.06 2wdp h ILE 229 N 0.73 1.31 -0.57 1.81 1.08 -1.91 0.90 117.51 120.87 2wdp h ILE 229 Ca 0.19 -1.36 0.03 0.00 -0.39 0.00 0.00 64.86 63.33 2wdp h ILE 229 Cb 0.03 1.64 -0.04 0.00 -3.07 0.00 0.00 36.82 35.38 2wdp h ILE 229 CO -0.03 0.43 0.34 1.56 -0.69 0.00 0.00 178.15 179.75 2wdp h GLN 230 N 0.29 0.65 -0.21 2.37 4.20 -0.68 -0.22 115.11 121.51 2wdp h GLN 230 Ca 0.04 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2wdp h GLN 230 Cb 0.76 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.39 2wdp h GLN 230 CO 0.05 0.43 -0.26 -0.44 -0.67 0.00 0.00 178.83 177.94 2wdp h ASP 231 N 0.67 0.59 -0.28 1.46 3.32 -0.85 -0.65 116.42 120.67 2wdp h ASP 231 Ca 0.23 -0.50 0.07 0.00 0.02 0.00 0.00 57.03 56.85 2wdp h ASP 231 Cb 0.05 -0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.36 2wdp h ASP 231 CO -0.11 0.97 -0.17 0.25 -1.72 0.00 0.00 179.24 178.46 2wdp h LEU 232 N 0.22 -0.56 -1.19 1.55 5.85 -0.74 -2.01 115.31 118.43 2wdp h LEU 232 Ca 0.03 0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 2wdp h LEU 232 Cb 0.83 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2wdp h LEU 232 CO 0.06 -0.21 -0.21 0.00 -0.34 0.00 0.00 178.44 177.74 2wdp h GLU 234 N 0.28 0.88 -0.33 0.00 4.81 -0.82 -1.27 114.58 118.13 2wdp h GLU 234 Ca 0.05 -0.35 -0.16 0.00 -0.13 0.00 0.00 59.36 58.77 2wdp h GLU 234 Cb 0.53 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 2wdp h GLU 234 CO 0.04 0.99 -0.42 0.52 -0.73 0.00 0.00 179.01 179.41 2wdp h MET 235 N 0.71 0.86 -0.68 1.92 2.86 -0.99 -2.31 114.93 117.31 2wdp h MET 235 Ca 0.11 -0.49 0.08 0.00 -2.06 0.00 0.00 59.70 57.34 2wdp h MET 235 Cb 0.68 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.31 2wdp h MET 235 CO 0.05 1.13 0.34 -0.07 1.06 0.00 0.00 176.91 179.42 2wdp h LEU 236 N 0.65 0.46 -0.73 1.22 3.38 -0.73 0.31 115.31 119.87 2wdp h LEU 236 Ca 0.04 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 2wdp h LEU 236 Cb 1.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 2wdp h LEU 236 CO 0.10 0.27 -0.31 1.23 0.09 0.00 0.00 178.44 179.82 2wdp h GLY 237 N 0.60 0.68 0.94 0.83 0.00 -1.03 0.93 103.07 106.01 2wdp h GLY 237 Ca 0.32 -0.62 -0.35 0.00 0.00 0.00 0.00 47.33 46.69 2wdp h GLY 237 CO -0.24 0.56 -1.75 1.70 0.00 0.00 0.00 176.54 176.81 2wdp h LYS 238 N 0.53 0.35 0.00 4.80 3.64 -1.07 -3.42 116.57 121.40 2wdp h LYS 238 Ca 0.06 -0.60 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2wdp h LYS 238 Cb 0.80 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2wdp h LYS 238 CO 0.07 1.26 0.00 0.66 -2.27 0.00 0.00 179.45 179.16 2wdp n TYR 239 N -3.54 0.00 -0.36 1.91 4.01 0.10 -4.83 117.16 114.46 2wdp n TYR 239 Ca -0.24 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.56 2wdp n TYR 239 Cb 1.07 0.00 0.23 0.00 -0.31 0.00 0.00 39.34 40.32 2wdp n TYR 239 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2wdp h GLY 240 N 0.00 1.58 -0.60 2.72 0.00 -0.64 -0.71 103.07 105.42 2wdp h GLY 240 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2wdp h GLY 240 CO 0.00 0.22 0.00 -1.14 0.00 0.00 0.00 176.54 175.62 2wdp n SER 241 N -4.57 1.29 0.00 0.19 3.41 -1.26 -4.16 113.62 108.52 2wdp n SER 241 Ca 0.18 -1.73 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 2wdp n SER 241 Cb 0.30 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 2wdp n SER 241 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wdp n SER 242 N 0.10 1.49 -4.83 4.04 3.41 -0.39 -4.05 113.62 113.39 2wdp n SER 242 Ca 0.14 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.42 2wdp n SER 242 Cb 0.25 0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.15 2wdp n SER 242 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2wdp s LEU 243 N -3.59 4.06 0.29 1.04 1.43 -0.53 -4.94 118.68 116.44 2wdp s LEU 243 Ca 0.00 1.44 -0.29 0.00 -1.03 0.00 0.00 54.13 54.25 2wdp s LEU 243 Cb 0.00 -4.19 -0.13 0.00 0.03 0.00 0.00 46.19 41.90 2wdp s LEU 243 CO 0.00 -0.23 1.26 1.21 0.23 0.00 0.00 176.35 178.82 2wdp n GLU 244 N -0.33 1.89 -0.23 1.70 0.00 -1.26 -4.66 120.64 117.74 2wdp n GLU 244 Ca 0.04 0.67 -0.07 0.00 0.00 0.00 0.00 57.16 57.80 2wdp n GLU 244 Cb 0.53 -2.22 0.06 0.00 0.00 0.00 0.00 31.44 29.81 2wdp n GLU 244 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2wdp h PHE 245 N 2.98 1.15 0.00 4.31 3.57 -1.11 0.32 116.94 128.16 2wdp h PHE 245 Ca -0.44 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 60.83 2wdp h PHE 245 Cb 1.30 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 2wdp h PHE 245 CO 0.52 0.95 -0.37 1.79 -2.23 0.00 0.00 178.31 178.97 2wdp h THR 246 N 1.03 0.98 -0.56 4.41 1.35 -1.91 0.18 112.91 118.40 2wdp h THR 246 Ca 0.21 -1.43 -0.10 0.00 -0.55 0.00 0.00 66.41 64.53 2wdp h THR 246 Cb 0.40 1.84 -0.02 0.00 -1.73 0.00 0.00 68.15 68.64 2wdp h THR 246 CO 0.01 0.37 -0.06 -0.33 -0.25 0.00 0.00 175.52 175.25 2wdp h GLU 247 N 0.00 1.01 0.00 4.72 5.08 -1.64 -1.25 114.58 122.50 2wdp h GLU 247 Ca -0.00 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2wdp h GLU 247 Cb 0.81 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2wdp h GLU 247 CO 0.05 1.03 -0.00 1.25 -1.00 0.00 0.00 179.01 180.33 2wdp h LEU 248 N 0.91 -0.00 -2.40 1.33 6.46 -0.17 -2.31 115.31 119.12 2wdp h LEU 248 Ca 0.15 -0.13 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 2wdp h LEU 248 Cb 0.61 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.54 2wdp h LEU 248 CO 0.04 0.13 -0.00 -0.07 -0.62 0.00 0.00 178.44 177.91 2wdp h LEU 249 N -0.14 0.00 -0.46 2.25 3.38 -0.55 -1.24 115.31 118.56 2wdp h LEU 249 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2wdp h LEU 249 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2wdp h LEU 249 CO 0.00 0.00 -0.37 0.74 0.09 0.00 0.00 178.44 178.91 2wdp h THR 250 N 0.00 1.28 -0.84 0.22 2.02 -0.74 -0.06 112.91 114.79 2wdp h THR 250 Ca -0.00 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 2wdp h THR 250 Cb 0.01 1.37 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 2wdp h THR 250 CO 0.00 0.51 0.50 -0.07 0.37 0.00 0.00 175.52 176.83 2wdp h LEU 251 N 0.73 1.01 -1.00 2.58 3.38 -0.80 -1.99 115.31 119.22 2wdp h LEU 251 Ca 0.06 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2wdp h LEU 251 Cb 0.94 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2wdp h LEU 251 CO 0.09 0.78 0.10 0.58 0.09 0.00 0.00 178.44 180.09 2wdp h VAL 252 N 1.15 1.23 -0.83 1.22 2.07 -0.89 -0.95 116.25 119.26 2wdp h VAL 252 Ca 0.30 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 67.04 2wdp h VAL 252 Cb -0.03 0.71 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 2wdp h VAL 252 CO -0.06 0.32 0.48 0.78 0.02 0.00 0.00 177.57 179.12 2wdp h ASN 253 N 0.80 0.71 0.04 0.57 2.35 -0.31 -1.85 115.58 117.90 2wdp h ASN 253 Ca 0.17 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2wdp h ASN 253 Cb 0.33 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.60 2wdp h ASN 253 CO 0.00 0.42 -0.02 -0.09 -1.65 0.00 0.00 177.43 176.10 2wdp h ARG 254 N 0.83 -0.06 -0.26 0.81 2.43 -0.90 -2.19 114.38 115.05 2wdp h ARG 254 Ca 0.39 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.60 2wdp h ARG 254 Cb 0.30 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 2wdp h ARG 254 CO -0.22 0.41 0.02 -0.22 -1.51 0.00 0.00 179.97 178.45 2wdp h LYS 255 N -0.55 0.10 -0.31 0.20 1.63 -1.03 -1.08 116.57 115.54 2wdp h LYS 255 Ca -0.01 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.76 2wdp h LYS 255 Cb 0.49 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2wdp h LYS 255 CO 0.01 0.07 0.08 0.28 -3.45 0.00 0.00 179.45 176.43 2wdp h VAL 256 N 0.10 1.22 0.00 2.00 2.07 -1.40 -2.70 116.25 117.53 2wdp h VAL 256 Ca 0.12 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.92 2wdp h VAL 256 Cb 0.15 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2wdp h VAL 256 CO -0.19 0.24 0.00 -1.54 0.02 0.00 0.00 177.57 176.10 2wdp n SER 257 N -4.66 0.43 -0.10 0.57 3.41 -0.82 -1.78 113.62 110.67 2wdp n SER 257 Ca -0.02 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.31 2wdp n SER 257 Cb 0.19 -0.69 0.23 0.00 -0.26 0.00 0.00 64.21 63.67 2wdp n SER 257 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wdp n GLN 258 N -1.97 0.33 -1.49 4.33 6.02 -0.44 -4.62 117.38 119.54 2wdp n GLN 258 Ca 0.03 -0.21 -0.32 0.00 -0.01 0.00 0.00 57.00 56.49 2wdp n GLN 258 Cb 0.23 -1.50 0.07 0.00 1.02 0.00 0.00 30.24 30.07 2wdp n GLN 258 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2wdp s ARG 259 N -2.82 2.44 0.00 -1.09 0.52 -0.73 -5.07 118.95 112.20 2wdp s ARG 259 Ca 0.15 1.37 0.00 0.00 -0.52 0.00 0.00 55.73 56.73 2wdp s ARG 259 Cb 0.18 -1.91 0.00 0.00 0.52 0.00 0.00 34.95 33.74 2wdp s ARG 259 CO 0.66 -1.53 0.00 2.89 0.02 0.00 0.00 175.30 177.34 2wdp n ARG 260 N -2.92 1.61 0.05 3.54 1.85 -1.26 -4.92 116.66 114.60 2wdp n ARG 260 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.95 2wdp n ARG 260 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 2wdp n ARG 260 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 177.63 179.17 2wdp n VAL 261 N 0.00 0.60 -0.67 8.89 3.14 -1.26 -5.12 118.33 123.91 2wdp n VAL 261 Ca 0.00 0.20 0.00 0.00 -2.96 0.00 0.00 64.34 61.58 2wdp n VAL 261 Cb 0.00 -1.30 0.00 0.00 -1.06 0.00 0.00 33.84 31.48 2wdp n VAL 261 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2wdp n ASP 262 N -3.28 -1.81 -0.04 6.55 -0.08 -1.26 -4.49 116.55 112.15 2wdp n ASP 262 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2wdp n ASP 262 Cb 0.14 -2.69 0.01 0.00 2.34 0.00 0.00 41.12 40.91 2wdp n ASP 262 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 2wdp n PHE 263 N -2.01 0.00 -1.15 -0.67 -1.74 -1.26 -5.08 117.46 105.55 2wdp n PHE 263 Ca 0.00 -0.21 0.00 0.00 -0.56 0.00 0.00 57.45 56.68 2wdp n PHE 263 Cb 0.15 -0.03 0.00 0.00 1.52 0.00 0.00 39.48 41.12 2wdp n PHE 263 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2wdp s LYS 265 N 0.00 2.21 0.00 0.00 -0.14 -1.26 -5.10 119.74 115.45 2wdp s LYS 265 Ca 0.00 -1.40 0.00 0.00 -1.36 0.00 0.00 55.97 53.21 2wdp s LYS 265 Cb 0.00 -2.56 0.00 0.00 -1.68 0.00 0.00 37.83 33.59 2wdp s LYS 265 CO 0.00 -0.94 0.49 -3.47 -0.76 0.00 0.00 175.35 170.67 2wdp n ASP 266 N -2.37 0.00 0.00 2.83 4.64 -1.26 -5.05 116.55 115.34 2wdp n ASP 266 Ca 0.14 -1.22 0.00 0.00 -1.38 0.00 0.00 54.79 52.33 2wdp n ASP 266 Cb 0.61 -0.04 0.00 0.00 -1.04 0.00 0.00 41.12 40.64 2wdp n ASP 266 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2wdp n PRO 267 N 0.00 0.70 -0.00 -0.67 -0.04 -1.26 -4.99 135.00 128.74 2wdp n PRO 267 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2wdp n PRO 267 Cb 0.54 -0.58 0.24 0.00 -0.04 0.00 0.00 33.50 33.66 2wdp n PRO 267 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2wdp n SER 268 N -0.75 0.04 -0.09 3.54 3.41 -1.26 0.36 113.62 118.87 2wdp n SER 268 Ca 0.00 -1.75 0.14 0.00 -0.26 0.00 0.00 58.87 57.00 2wdp n SER 268 Cb 0.08 -0.00 0.61 0.00 -0.26 0.00 0.00 64.21 64.64 2wdp n SER 268 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wdp n ALA 269 N -0.60 2.75 -1.96 7.33 0.00 -1.26 -4.88 120.51 121.89 2wdp n ALA 269 Ca 0.06 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 2wdp n ALA 269 Cb 0.03 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 2wdp n ALA 269 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wdp s ILE 270 N -2.55 2.89 0.00 0.00 1.01 0.16 -0.82 121.20 121.89 2wdp s ILE 270 Ca 0.27 0.71 0.00 0.00 0.00 0.00 0.00 60.65 61.62 2wdp s ILE 270 Cb 0.20 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 39.22 2wdp s ILE 270 CO 0.49 0.09 0.00 0.61 0.00 0.00 0.00 174.94 176.13 2wdp n GLY 271 N 2.66 1.69 3.79 6.18 0.00 -1.26 -5.02 105.19 113.23 2wdp n GLY 271 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2wdp n GLY 271 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdp s LYS 272 N -0.06 4.44 0.06 1.61 1.02 0.00 -5.07 119.74 121.74 2wdp s LYS 272 Ca 0.00 1.09 0.08 0.00 0.02 0.00 0.00 55.97 57.16 2wdp s LYS 272 Cb 0.00 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 34.32 2wdp s LYS 272 CO 0.00 0.41 -0.21 0.15 -0.92 0.00 0.00 175.35 174.78 2wdp s LYS 273 N -1.78 1.92 -0.21 1.68 1.02 -1.26 -5.08 119.74 116.03 2wdp s LYS 273 Ca 0.43 -1.07 -0.26 0.00 0.02 0.00 0.00 55.97 55.10 2wdp s LYS 273 Cb -0.19 -2.11 -0.01 0.00 -0.52 0.00 0.00 37.83 35.01 2wdp s LYS 273 CO 0.23 0.52 0.88 -1.14 -0.92 0.00 0.00 175.35 174.92 2wdp s GLN 274 N -1.54 4.25 -0.21 1.68 0.74 -1.26 -4.35 119.66 118.98 2wdp s GLN 274 Ca 0.14 1.08 0.01 0.00 0.05 0.00 0.00 55.36 56.64 2wdp s GLN 274 Cb -0.10 -3.61 0.05 0.00 1.10 0.00 0.00 33.01 30.44 2wdp s GLN 274 CO 0.05 -0.46 -0.10 0.08 -0.55 0.00 0.00 175.29 174.31 2wdp s VAL 275 N 2.61 1.66 0.99 1.34 1.01 -1.25 -2.77 120.40 123.99 2wdp s VAL 275 Ca 0.39 -1.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.14 2wdp s VAL 275 Cb -0.16 -1.76 0.22 0.00 0.00 0.00 0.00 36.38 34.69 2wdp s VAL 275 CO 0.09 0.13 1.34 -2.84 0.00 0.00 0.00 175.10 173.83 2wdp s PRO 276 N 1.38 0.40 0.24 2.72 0.02 -1.25 -2.67 135.00 135.84 2wdp s PRO 276 Ca -0.02 -0.49 -0.21 0.00 0.02 0.00 0.00 61.00 60.30 2wdp s PRO 276 Cb -0.17 -1.83 0.03 0.00 0.02 0.00 0.00 34.50 32.56 2wdp s PRO 276 CO -0.08 -2.57 0.65 0.00 -0.33 0.00 0.00 177.00 174.68 2wdp s PHE 278 N -3.88 0.75 -0.15 0.00 -0.12 -1.26 -1.08 117.98 112.24 2wdp s PHE 278 Ca 0.09 -0.66 0.00 0.00 -0.05 0.00 0.00 56.93 56.31 2wdp s PHE 278 Cb -0.04 -0.44 0.03 0.00 -0.63 0.00 0.00 43.02 41.94 2wdp s PHE 278 CO 0.01 -0.11 -0.10 0.00 -0.05 0.00 0.00 175.22 174.97 2wdp s ALA 279 N -2.24 1.66 -0.19 1.99 0.00 0.22 -4.99 121.76 118.21 2wdp s ALA 279 Ca -0.02 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 2wdp s ALA 279 Cb -0.04 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 2wdp s ALA 279 CO -0.02 -0.53 -0.04 0.45 0.00 0.00 0.00 175.76 175.62 2wdp s SER 280 N 1.56 4.49 -0.25 0.00 0.15 -1.26 -0.71 113.70 117.68 2wdp s SER 280 Ca 0.03 -0.28 0.12 0.00 0.70 0.00 0.00 55.95 56.52 2wdp s SER 280 Cb -0.14 -1.75 0.50 0.00 -1.71 0.00 0.00 66.02 62.92 2wdp s SER 280 CO -0.09 0.07 1.44 0.23 1.20 0.00 0.00 173.24 176.08 2wdp n MET 281 N 4.21 2.11 -1.58 5.44 2.81 0.31 -5.03 117.12 125.39 2wdp n MET 281 Ca -0.18 -3.06 -0.33 0.00 -1.81 0.00 0.00 57.70 52.33 2wdp n MET 281 Cb 0.52 -1.81 0.06 0.00 -0.71 0.00 0.00 33.22 31.28 2wdp n MET 281 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2wdp s LEU 282 N -3.11 3.28 0.00 4.03 1.43 -1.23 -1.22 118.68 121.86 2wdp s LEU 282 Ca 0.43 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.51 2wdp s LEU 282 Cb 0.38 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 42.06 2wdp s LEU 282 CO 0.02 -1.81 0.61 0.35 0.23 0.00 0.00 176.35 175.76 2wdp n THR 283 N -2.76 0.29 -4.14 5.49 -2.24 -1.26 -4.90 114.28 104.76 2wdp n THR 283 Ca 0.10 -0.60 -0.11 0.00 -2.27 0.00 0.00 64.05 61.17 2wdp n THR 283 Cb 0.52 0.92 -0.09 0.00 -2.10 0.00 0.00 70.33 69.58 2wdp n THR 283 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wdp s LYS 284 N -0.29 1.20 0.53 -0.78 1.02 -1.26 -5.02 119.74 115.14 2wdp s LYS 284 Ca 0.00 -1.50 -0.18 0.00 0.02 0.00 0.00 55.97 54.31 2wdp s LYS 284 Cb 0.00 0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 37.55 2wdp s LYS 284 CO 0.00 -0.41 1.03 0.15 -0.92 0.00 0.00 175.35 175.20 2wdp s LYS 285 N -4.10 3.65 -0.11 1.68 1.02 -0.69 -4.78 119.74 116.41 2wdp s LYS 285 Ca 0.32 1.23 -0.00 0.00 0.02 0.00 0.00 55.97 57.54 2wdp s LYS 285 Cb 0.06 -2.08 0.02 0.00 -0.52 0.00 0.00 37.83 35.31 2wdp s LYS 285 CO 0.09 -0.54 -0.08 -1.17 -0.92 0.00 0.00 175.35 172.73 2wdp s LEU 286 N -3.96 1.20 0.04 3.17 2.96 -1.26 -1.22 118.68 119.61 2wdp s LEU 286 Ca 0.64 -0.30 0.06 0.00 -0.22 0.00 0.00 54.13 54.31 2wdp s LEU 286 Cb -0.15 -0.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.68 2wdp s LEU 286 CO 0.28 -0.11 -0.17 -1.00 -1.32 0.00 0.00 176.35 174.03 2wdp s HIS 287 N 1.67 1.49 -0.64 5.38 3.76 -1.26 -0.39 115.29 125.29 2wdp s HIS 287 Ca 0.04 -0.35 0.02 0.00 -0.15 0.00 0.00 55.06 54.62 2wdp s HIS 287 Cb -0.13 -0.89 0.38 0.00 1.11 0.00 0.00 32.58 33.05 2wdp s HIS 287 CO -0.08 0.06 1.41 1.19 -0.85 0.00 0.00 174.74 176.47 2wdp n PHE 288 N 1.94 3.34 -1.71 1.40 3.72 -1.26 -4.94 117.46 119.96 2wdp n PHE 288 Ca -0.17 -2.99 -0.40 0.00 -0.05 0.00 0.00 57.45 53.83 2wdp n PHE 288 Cb 0.54 -0.57 0.02 0.00 -0.94 0.00 0.00 39.48 38.53 2wdp n PHE 288 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2wdp n PHE 289 N -0.41 2.11 -1.58 1.38 3.72 -1.26 -4.28 117.46 117.14 2wdp n PHE 289 Ca 0.43 0.48 -0.54 0.00 -0.05 0.00 0.00 57.45 57.77 2wdp n PHE 289 Cb 0.45 -2.37 -0.06 0.00 -0.94 0.00 0.00 39.48 36.56 2wdp n PHE 289 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2wdp n PRO 290 N -0.17 0.91 -2.69 -1.08 -0.02 -1.26 -4.88 135.00 125.80 2wdp n PRO 290 Ca 0.07 0.33 -0.39 0.00 -2.02 0.00 0.00 63.50 61.49 2wdp n PRO 290 Cb 0.41 -1.95 -0.06 0.00 -0.02 0.00 0.00 33.50 31.89 2wdp n PRO 290 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wdp s LYS 291 N 0.57 4.69 -1.17 -0.52 1.02 -1.26 -4.93 119.74 118.15 2wdp s LYS 291 Ca 0.87 1.50 -0.10 0.00 0.02 0.00 0.00 55.97 58.26 2wdp s LYS 291 Cb -1.03 -3.08 0.23 0.00 -0.52 0.00 0.00 37.83 33.43 2wdp s LYS 291 CO 0.50 0.35 1.34 0.45 -0.92 0.00 0.00 175.35 177.07 2wdp n SER 292 N 1.07 5.45 -0.81 2.83 2.88 -1.26 -5.15 113.62 118.63 2wdp n SER 292 Ca -0.00 -3.05 0.10 0.00 -1.33 0.00 0.00 58.87 54.58 2wdp n SER 292 Cb 0.48 -1.46 0.08 0.00 -0.75 0.00 0.00 64.21 62.56 2wdp n SER 292 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61