#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrl h LYS 3 N 0.00 0.00 -4.60 0.54 3.11 -2.09 -3.47 116.57 110.06 2wrl h LYS 3 Ca 0.00 0.00 -0.30 0.00 -2.81 0.00 0.00 60.65 57.54 2wrl h LYS 3 Cb 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 31.09 2wrl h LYS 3 CO 0.00 0.13 -0.53 -1.01 -2.81 0.00 0.00 179.45 175.22 2wrl s HIS 4 N -3.18 1.28 0.70 1.91 3.76 -1.26 -5.17 115.29 113.33 2wrl s HIS 4 Ca 0.03 -1.42 -0.11 0.00 -0.15 0.00 0.00 55.06 53.41 2wrl s HIS 4 Cb 0.07 -0.54 0.01 0.00 1.11 0.00 0.00 32.58 33.23 2wrl s HIS 4 CO 0.73 -0.75 1.08 0.20 -0.85 0.00 0.00 174.74 175.16 2wrl s GLY 5 N -3.21 1.64 -0.01 -2.22 0.00 -1.26 -4.95 107.32 97.30 2wrl s GLY 5 Ca 0.38 -0.27 -0.24 0.00 0.00 0.00 0.00 44.72 44.59 2wrl s GLY 5 CO 0.17 0.09 1.17 1.70 0.00 0.00 0.00 173.10 176.22 2wrl h LYS 6 N -0.63 -0.28 -0.59 2.90 3.64 -2.01 -2.20 116.57 117.40 2wrl h LYS 6 Ca -0.45 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.07 2wrl h LYS 6 Cb 1.24 0.06 -0.11 0.00 -0.41 0.00 0.00 32.23 33.01 2wrl h LYS 6 CO 0.63 0.08 -0.14 -0.09 -2.27 0.00 0.00 179.45 177.66 2wrl h ARG 7 N -0.72 0.00 0.30 1.90 2.43 -1.99 -2.23 114.38 114.08 2wrl h ARG 7 Ca -0.03 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2wrl h ARG 7 Cb 0.49 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 2wrl h ARG 7 CO 0.05 0.00 -0.49 -0.92 -1.51 0.00 0.00 179.97 177.11 2wrl h TYR 8 N 0.00 -1.38 -0.97 2.20 3.20 -1.93 -2.27 116.97 115.83 2wrl h TYR 8 Ca 0.29 0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.40 2wrl h TYR 8 Cb 0.44 0.56 -0.12 0.00 1.54 0.00 0.00 36.73 39.15 2wrl h TYR 8 CO -0.48 -0.60 0.54 0.00 -1.64 0.00 0.00 178.16 175.98 2wrl h ARG 9 N -0.83 0.57 0.00 1.82 3.08 -0.99 1.34 114.38 119.38 2wrl h ARG 9 Ca -0.03 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2wrl h ARG 9 Cb 0.77 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2wrl h ARG 9 CO -0.16 0.38 0.00 0.00 -1.07 0.00 0.00 179.97 179.11 2wrl n ALA 10 N -2.36 1.35 -0.06 0.04 0.00 -0.88 -2.50 120.51 116.10 2wrl n ALA 10 Ca 0.24 0.03 -0.22 0.00 0.00 0.00 0.00 53.44 53.50 2wrl n ALA 10 Cb 0.66 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.78 2wrl n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wrl n LEU 11 N -1.77 2.16 0.27 0.00 4.77 0.46 -4.01 117.00 118.88 2wrl n LEU 11 Ca 0.01 0.34 0.04 0.00 -0.03 0.00 0.00 56.01 56.37 2wrl n LEU 11 Cb 0.10 -1.03 0.09 0.00 -2.33 0.00 0.00 43.42 40.26 2wrl n LEU 11 CO 0.10 0.50 1.04 -0.07 -1.33 0.00 0.00 177.39 177.63 2wrl h LEU 12 N -0.58 0.00 0.03 2.23 3.38 -1.15 -0.54 115.31 118.67 2wrl h LEU 12 Ca -0.38 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.61 2wrl h LEU 12 Cb 1.59 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.29 2wrl h LEU 12 CO -0.10 0.00 -0.53 -0.33 0.09 0.00 0.00 178.44 177.57 2wrl h GLU 13 N 0.00 -0.67 -2.06 1.13 4.39 -1.70 -3.05 114.58 112.63 2wrl h GLU 13 Ca 0.06 0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 2wrl h GLU 13 Cb 2.04 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 30.82 2wrl h GLU 13 CO -0.00 -0.44 -0.07 1.63 -1.16 0.00 0.00 179.01 178.97 2wrl n LYS 14 N -5.44 1.06 -3.41 2.33 4.01 -0.21 -4.73 118.16 111.77 2wrl n LYS 14 Ca -0.08 -0.25 -0.02 0.00 -0.51 0.00 0.00 58.31 57.46 2wrl n LYS 14 Cb 0.40 -1.34 -0.05 0.00 -0.51 0.00 0.00 35.03 33.53 2wrl n LYS 14 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2wrl s VAL 15 N 0.68 -0.86 -0.67 -0.18 -7.23 -1.15 -5.04 120.40 105.93 2wrl s VAL 15 Ca 0.17 0.01 -0.27 0.00 -1.81 0.00 0.00 61.98 60.08 2wrl s VAL 15 Cb 0.08 -0.91 0.03 0.00 0.56 0.00 0.00 36.38 36.14 2wrl s VAL 15 CO 0.00 -0.01 1.28 -0.62 -0.31 0.00 0.00 175.10 175.44 2wrl s ASP 16 N 2.77 6.22 0.00 4.85 -1.08 -1.26 -4.86 116.67 123.30 2wrl s ASP 16 Ca 0.08 -0.20 0.00 0.00 -0.52 0.00 0.00 52.55 51.91 2wrl s ASP 16 Cb -0.14 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 2wrl s ASP 16 CO -0.18 -1.74 0.16 -0.81 0.52 0.00 0.00 175.17 173.12 2wrl n PRO 17 N 9.04 0.00 0.00 4.34 -0.04 -1.26 -0.51 135.00 146.57 2wrl n PRO 17 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2wrl n PRO 17 Cb 0.49 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2wrl n PRO 17 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2wrl n ASN 18 N -0.60 0.00 -4.80 3.54 6.94 -1.26 -5.07 115.26 114.01 2wrl n ASN 18 Ca 0.00 -0.16 -0.32 0.00 -0.02 0.00 0.00 54.58 54.08 2wrl n ASN 18 Cb 0.00 0.31 0.03 0.00 -2.36 0.00 0.00 39.78 37.76 2wrl n ASN 18 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2wrl s LYS 19 N -0.31 3.09 -0.54 -3.83 2.20 0.34 -5.01 119.74 115.68 2wrl s LYS 19 Ca 0.00 1.17 0.04 0.00 -0.36 0.00 0.00 55.97 56.82 2wrl s LYS 19 Cb 0.00 -2.00 0.14 0.00 -1.51 0.00 0.00 37.83 34.45 2wrl s LYS 19 CO 0.00 -0.99 0.30 0.08 -0.36 0.00 0.00 175.35 174.37 2wrl s VAL 20 N -2.60 2.51 0.57 4.02 1.01 -1.26 -4.67 120.40 119.98 2wrl s VAL 20 Ca 0.63 -3.40 -0.20 0.00 0.00 0.00 0.00 61.98 59.01 2wrl s VAL 20 Cb -0.16 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 2wrl s VAL 20 CO 0.43 -0.84 1.23 -0.31 0.00 0.00 0.00 175.10 175.60 2wrl s TYR 21 N -0.42 2.42 0.50 5.22 1.51 -1.14 -4.57 117.35 120.88 2wrl s TYR 21 Ca 0.18 1.49 -0.17 0.00 -1.01 0.00 0.00 57.07 57.56 2wrl s TYR 21 Cb -0.22 -3.53 -0.08 0.00 -0.11 0.00 0.00 41.96 38.02 2wrl s TYR 21 CO -0.03 -2.26 0.98 0.95 -1.11 0.00 0.00 175.55 174.08 2wrl s THR 22 N -1.53 4.45 0.18 -0.71 -4.23 -1.26 -1.65 115.64 110.90 2wrl s THR 22 Ca 0.75 1.25 -0.17 0.00 -1.18 0.00 0.00 61.69 62.34 2wrl s THR 22 Cb -0.32 -3.67 0.14 0.00 1.34 0.00 0.00 72.50 69.99 2wrl s THR 22 CO 0.36 -0.60 1.64 0.40 -0.54 0.00 0.00 174.62 175.87 2wrl h ILE 23 N 1.09 0.43 -0.52 2.99 2.04 -1.81 0.49 117.51 122.23 2wrl h ILE 23 Ca -0.47 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.47 2wrl h ILE 23 Cb 1.19 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 2wrl h ILE 23 CO 0.61 0.00 0.12 0.44 0.00 0.00 0.00 178.15 179.32 2wrl h ASP 24 N -0.06 0.04 0.23 1.72 3.32 -1.93 0.15 116.42 119.90 2wrl h ASP 24 Ca 0.23 0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 2wrl h ASP 24 Cb 0.41 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 2wrl h ASP 24 CO -0.53 0.05 -0.45 -0.08 -1.72 0.00 0.00 179.24 176.51 2wrl h GLU 25 N 0.27 0.27 -0.13 3.56 4.81 -1.40 -2.84 114.58 119.12 2wrl h GLU 25 Ca 0.26 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 2wrl h GLU 25 Cb 0.34 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 2wrl h GLU 25 CO -0.32 0.67 -0.19 0.00 -0.73 0.00 0.00 179.01 178.44 2wrl h ALA 26 N 1.32 0.20 0.38 2.92 0.00 0.76 -3.00 119.26 121.83 2wrl h ALA 26 Ca 0.02 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2wrl h ALA 26 Cb 0.88 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2wrl h ALA 26 CO 0.07 0.13 -0.50 0.00 0.00 0.00 0.00 179.25 178.95 2wrl h ALA 27 N 0.57 -1.06 0.00 0.00 0.00 -0.71 0.32 119.26 118.38 2wrl h ALA 27 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2wrl h ALA 27 Cb 0.75 0.76 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2wrl h ALA 27 CO 0.04 -1.15 0.08 0.54 0.00 0.00 0.00 179.25 178.76 2wrl n ARG 28 N -5.54 0.03 0.00 0.00 1.74 -1.08 -3.03 116.66 108.78 2wrl n ARG 28 Ca -0.11 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.45 2wrl n ARG 28 Cb 0.44 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 2wrl n ARG 28 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2wrl n LEU 29 N -1.63 0.03 -0.02 0.55 0.00 0.24 -4.58 117.00 111.59 2wrl n LEU 29 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2wrl n LEU 29 Cb 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 43.42 43.33 2wrl n LEU 29 CO 0.02 -0.17 0.03 0.52 0.00 0.00 0.00 177.39 177.79 2wrl n VAL 30 N -1.83 -0.02 -0.27 1.96 0.31 0.89 0.27 118.33 119.64 2wrl n VAL 30 Ca 0.00 0.11 0.06 0.00 -0.01 0.00 0.00 64.34 64.51 2wrl n VAL 30 Cb 0.00 -0.15 0.14 0.00 -0.91 0.00 0.00 33.84 32.92 2wrl n VAL 30 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2wrl n LYS 31 N -4.07 -0.07 -0.20 5.55 0.00 -1.17 0.25 118.16 118.45 2wrl n LYS 31 Ca 0.01 1.17 -0.02 0.00 0.00 0.00 0.00 58.31 59.47 2wrl n LYS 31 Cb 0.02 -1.78 0.05 0.00 0.00 0.00 0.00 35.03 33.33 2wrl n LYS 31 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2wrl n GLU 32 N -5.18 1.43 0.00 1.64 0.28 0.78 -3.15 120.64 116.44 2wrl n GLU 32 Ca 0.14 -0.55 0.01 0.00 -0.16 0.00 0.00 57.16 56.59 2wrl n GLU 32 Cb 0.44 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.92 2wrl n GLU 32 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2wrl n LEU 33 N 0.17 0.90 -4.21 -1.84 4.77 0.69 -4.83 117.00 112.65 2wrl n LEU 33 Ca 0.08 -0.89 -0.43 0.00 -0.03 0.00 0.00 56.01 54.74 2wrl n LEU 33 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2wrl n LEU 33 CO 0.09 0.21 1.55 0.00 -1.33 0.00 0.00 177.39 177.91 2wrl n ALA 34 N -0.16 4.51 0.48 -1.18 0.00 -1.19 -4.40 120.51 118.58 2wrl n ALA 34 Ca 0.01 -4.33 0.10 0.00 0.00 0.00 0.00 53.44 49.22 2wrl n ALA 34 Cb 0.04 -2.95 0.26 0.00 0.00 0.00 0.00 19.45 16.79 2wrl n ALA 34 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wrl n THR 35 N 3.84 0.57 -1.41 0.00 -2.24 -1.26 -4.88 114.28 108.90 2wrl n THR 35 Ca 0.37 -0.65 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 2wrl n THR 35 Cb 0.40 0.50 0.21 0.00 -2.10 0.00 0.00 70.33 69.34 2wrl n THR 35 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wrl s ALA 36 N -1.43 1.26 -1.17 6.98 0.00 -1.26 -4.96 121.76 121.19 2wrl s ALA 36 Ca 0.36 -1.00 -0.04 0.00 0.00 0.00 0.00 51.96 51.28 2wrl s ALA 36 Cb 0.19 -2.86 0.23 0.00 0.00 0.00 0.00 23.12 20.68 2wrl s ALA 36 CO 0.26 -3.09 1.99 1.63 0.00 0.00 0.00 175.76 176.56 2wrl n LYS 37 N -4.34 4.85 -3.67 0.00 5.02 -1.26 -4.87 118.16 113.88 2wrl n LYS 37 Ca 0.13 -4.10 0.00 0.00 -2.02 0.00 0.00 58.31 52.32 2wrl n LYS 37 Cb 0.59 -2.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.03 2wrl n LYS 37 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 2wrl n PHE 38 N 1.14 0.00 -2.99 2.13 -1.74 -1.26 -5.06 117.46 109.69 2wrl n PHE 38 Ca 0.49 0.00 -0.44 0.00 -0.56 0.00 0.00 57.45 56.94 2wrl n PHE 38 Cb 0.27 0.00 -0.00 0.00 1.52 0.00 0.00 39.48 41.27 2wrl n PHE 38 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 2wrl s ASP 39 N -4.00 7.02 0.54 5.98 -1.08 -1.26 -4.98 116.67 118.90 2wrl s ASP 39 Ca 0.00 -2.91 -0.18 0.00 -0.52 0.00 0.00 52.55 48.95 2wrl s ASP 39 Cb 0.00 -2.38 -0.12 0.00 -1.46 0.00 0.00 42.92 38.96 2wrl s ASP 39 CO 0.00 -0.75 0.14 -0.62 0.52 0.00 0.00 175.17 174.46 2wrl n GLU 40 N 5.49 0.21 -3.63 4.34 1.02 -1.26 -4.47 120.64 122.33 2wrl n GLU 40 Ca 0.33 0.08 -0.37 0.00 -0.02 0.00 0.00 57.16 57.18 2wrl n GLU 40 Cb 0.43 -1.30 -0.06 0.00 -0.02 0.00 0.00 31.44 30.49 2wrl n GLU 40 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2wrl s THR 41 N -1.89 5.26 -0.58 2.62 2.01 -1.26 -0.79 115.64 121.02 2wrl s THR 41 Ca 0.62 0.55 -0.20 0.00 0.31 0.00 0.00 61.69 62.96 2wrl s THR 41 Cb -0.47 -3.59 0.08 0.00 0.01 0.00 0.00 72.50 68.53 2wrl s THR 41 CO 0.61 0.53 0.77 -0.69 -0.69 0.00 0.00 174.62 175.16 2wrl s VAL 42 N -0.59 4.66 0.21 3.82 1.01 0.62 -0.47 120.40 129.66 2wrl s VAL 42 Ca 0.19 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 2wrl s VAL 42 Cb -0.14 -4.49 -0.05 0.00 0.00 0.00 0.00 36.38 31.70 2wrl s VAL 42 CO 0.08 -1.12 0.45 -1.83 0.00 0.00 0.00 175.10 172.67 2wrl s GLU 43 N 3.15 3.62 -0.11 2.72 -1.05 -0.34 -0.69 118.70 126.00 2wrl s GLU 43 Ca 0.17 -0.09 0.02 0.00 -0.15 0.00 0.00 54.97 54.93 2wrl s GLU 43 Cb -0.20 -2.77 0.01 0.00 -0.44 0.00 0.00 34.13 30.74 2wrl s GLU 43 CO 0.10 0.36 -0.18 0.08 0.95 0.00 0.00 175.26 176.57 2wrl s VAL 44 N -1.85 1.69 0.11 1.83 1.01 -0.39 -2.02 120.40 120.78 2wrl s VAL 44 Ca 0.42 -0.77 0.11 0.00 0.00 0.00 0.00 61.98 61.73 2wrl s VAL 44 Cb -0.11 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2wrl s VAL 44 CO 0.27 0.48 -0.27 -1.00 0.00 0.00 0.00 175.10 174.58 2wrl s HIS 45 N 0.80 2.31 -0.25 5.22 3.76 -0.58 -1.89 115.29 124.67 2wrl s HIS 45 Ca -0.10 -0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 54.31 2wrl s HIS 45 Cb -0.16 -1.29 0.09 0.00 1.11 0.00 0.00 32.58 32.33 2wrl s HIS 45 CO 0.01 0.28 0.59 0.00 -0.85 0.00 0.00 174.74 174.77 2wrl s ALA 46 N -0.99 -1.67 -0.14 -1.40 0.00 -0.80 -0.53 121.76 116.23 2wrl s ALA 46 Ca 0.13 2.12 -0.26 0.00 0.00 0.00 0.00 51.96 53.95 2wrl s ALA 46 Cb -0.10 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 2wrl s ALA 46 CO 0.05 -0.55 0.84 0.21 0.00 0.00 0.00 175.76 176.31 2wrl s LYS 47 N 2.06 4.34 0.01 0.00 2.47 0.16 -1.36 119.74 127.42 2wrl s LYS 47 Ca -0.08 1.06 0.00 0.00 -1.56 0.00 0.00 55.97 55.40 2wrl s LYS 47 Cb -0.08 -3.55 -0.04 0.00 -1.46 0.00 0.00 37.83 32.70 2wrl s LYS 47 CO -0.17 -0.27 0.06 -0.51 0.16 0.00 0.00 175.35 174.62 2wrl s LEU 48 N 1.92 3.81 -1.37 5.43 1.02 -1.02 -1.74 118.68 126.73 2wrl s LEU 48 Ca 0.40 0.09 -0.13 0.00 0.02 0.00 0.00 54.13 54.51 2wrl s LEU 48 Cb -0.17 -2.25 0.09 0.00 0.02 0.00 0.00 46.19 43.88 2wrl s LEU 48 CO 0.14 0.26 2.01 0.61 0.02 0.00 0.00 176.35 179.39 2wrl n GLY 49 N 1.12 4.25 2.96 -3.19 0.00 0.12 -4.87 105.19 105.58 2wrl n GLY 49 Ca -0.13 -1.76 -0.16 0.00 0.00 0.00 0.00 46.02 43.96 2wrl n GLY 49 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2wrl n ILE 50 N 4.66 0.00 -3.94 -0.61 -5.35 -1.26 -4.51 119.36 108.34 2wrl n ILE 50 Ca 0.47 -2.05 -0.35 0.00 -0.27 0.00 0.00 62.75 60.55 2wrl n ILE 50 Cb 0.39 1.08 -0.13 0.00 -1.74 0.00 0.00 39.64 39.24 2wrl n ILE 50 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2wrl s ASP 51 N -3.08 4.66 0.27 7.28 2.15 -1.26 -5.01 116.67 121.68 2wrl s ASP 51 Ca 0.34 -0.29 0.06 0.00 0.43 0.00 0.00 52.55 53.09 2wrl s ASP 51 Cb 0.01 -1.81 0.35 0.00 -0.30 0.00 0.00 42.92 41.17 2wrl s ASP 51 CO 0.24 0.01 1.62 1.55 -0.17 0.00 0.00 175.17 178.42 2wrl h PRO 52 N 7.91 0.18 0.00 4.34 0.13 -1.87 -3.26 132.00 139.44 2wrl h PRO 52 Ca -0.39 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2wrl h PRO 52 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wrl h PRO 52 CO 0.60 0.68 -0.00 0.07 -0.23 0.00 0.00 178.00 179.12 2wrl h ARG 53 N 0.14 0.00 -6.58 0.86 -0.00 -1.95 -3.43 114.38 103.41 2wrl h ARG 53 Ca 0.00 0.00 -0.56 0.00 -0.00 0.00 0.00 59.98 59.42 2wrl h ARG 53 Cb 1.00 0.00 -0.08 0.00 -0.00 0.00 0.00 29.97 30.90 2wrl h ARG 53 CO 0.08 0.00 0.91 1.03 -0.00 0.00 0.00 179.97 181.99 2wrl s ARG 54 N -3.17 3.61 0.19 0.08 1.81 -1.23 -4.92 118.95 115.31 2wrl s ARG 54 Ca 0.08 0.37 -0.22 0.00 -1.72 0.00 0.00 55.73 54.24 2wrl s ARG 54 Cb 0.08 -3.96 0.10 0.00 -0.45 0.00 0.00 34.95 30.72 2wrl s ARG 54 CO 0.64 -1.50 1.57 1.03 -0.68 0.00 0.00 175.30 176.37 2wrl h SER 55 N 9.35 -1.36 0.00 0.23 0.87 -1.89 0.13 113.55 120.89 2wrl h SER 55 Ca -0.24 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2wrl h SER 55 Cb 1.06 0.65 0.00 0.00 -0.44 0.00 0.00 62.40 63.67 2wrl h SER 55 CO 1.14 -0.31 0.16 -2.24 -0.53 0.00 0.00 176.83 175.05 2wrl h ASP 56 N -0.16 0.00 -0.30 6.23 2.03 -1.95 -2.53 116.42 119.74 2wrl h ASP 56 Ca 0.23 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.52 2wrl h ASP 56 Cb 0.56 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.05 2wrl h ASP 56 CO -0.74 0.00 0.00 1.67 -1.03 0.00 0.00 179.24 179.15 2wrl n GLN 57 N -2.86 3.07 -3.56 4.15 7.27 0.46 -4.83 117.38 121.08 2wrl n GLN 57 Ca -0.02 -2.90 -0.36 0.00 0.07 0.00 0.00 57.00 53.79 2wrl n GLN 57 Cb 0.21 -1.89 -0.06 0.00 2.41 0.00 0.00 30.24 30.91 2wrl n GLN 57 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 2wrl s ASN 58 N -1.84 6.71 -0.12 1.69 -0.87 -0.95 -4.56 114.94 114.98 2wrl s ASN 58 Ca 0.44 0.85 -0.05 0.00 -1.57 0.00 0.00 52.86 52.54 2wrl s ASN 58 Cb 0.35 -2.21 -0.04 0.00 -0.02 0.00 0.00 41.25 39.34 2wrl s ASN 58 CO 0.09 0.26 0.05 -0.69 -2.57 0.00 0.00 177.10 174.24 2wrl s VAL 59 N -1.22 4.69 0.14 1.60 1.01 -1.26 -4.97 120.40 120.38 2wrl s VAL 59 Ca 0.27 -0.09 -0.24 0.00 0.00 0.00 0.00 61.98 61.92 2wrl s VAL 59 Cb -0.15 -3.03 0.07 0.00 0.00 0.00 0.00 36.38 33.27 2wrl s VAL 59 CO 0.15 0.56 0.63 -0.60 0.00 0.00 0.00 175.10 175.84 2wrl s ARG 60 N -0.48 1.23 0.00 2.72 3.52 -1.26 -2.88 118.95 121.79 2wrl s ARG 60 Ca 0.10 -0.43 0.00 0.00 -0.13 0.00 0.00 55.73 55.27 2wrl s ARG 60 Cb -0.12 0.57 0.00 0.00 -1.56 0.00 0.00 34.95 33.84 2wrl s ARG 60 CO 0.02 -0.53 0.00 0.41 -0.81 0.00 0.00 175.30 174.39 2wrl n GLY 61 N -0.32 -1.00 3.60 8.12 0.00 -1.12 -5.01 105.19 109.46 2wrl n GLY 61 Ca -0.16 -1.63 -0.28 0.00 0.00 0.00 0.00 46.02 43.95 2wrl n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wrl s THR 62 N -1.53 0.96 -0.28 2.61 -4.23 -1.26 -1.35 115.64 110.55 2wrl s THR 62 Ca 0.00 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.29 2wrl s THR 62 Cb 0.00 -2.37 0.12 0.00 1.34 0.00 0.00 72.50 71.59 2wrl s THR 62 CO 0.00 0.00 0.99 0.54 -0.54 0.00 0.00 174.62 175.61 2wrl s VAL 63 N -3.06 0.00 -0.41 2.29 0.11 -0.71 -4.97 120.40 113.65 2wrl s VAL 63 Ca 0.19 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.09 2wrl s VAL 63 Cb 0.03 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.90 2wrl s VAL 63 CO 0.11 0.00 0.30 -0.44 -3.33 0.00 0.00 175.10 171.74 2wrl s SER 64 N 0.61 6.10 0.44 3.54 0.01 -1.26 -1.44 113.70 121.70 2wrl s SER 64 Ca -0.01 -0.90 -0.25 0.00 1.31 0.00 0.00 55.95 56.09 2wrl s SER 64 Cb -0.05 -2.16 -0.08 0.00 0.21 0.00 0.00 66.02 63.94 2wrl s SER 64 CO -0.09 -0.45 1.40 -0.76 0.41 0.00 0.00 173.24 173.75 2wrl s LEU 65 N 1.68 4.14 0.23 2.44 1.43 -1.15 -4.91 118.68 122.53 2wrl s LEU 65 Ca 0.05 2.87 -0.06 0.00 -1.03 0.00 0.00 54.13 55.96 2wrl s LEU 65 Cb -0.19 -3.92 0.37 0.00 0.03 0.00 0.00 46.19 42.48 2wrl s LEU 65 CO 0.10 -1.10 1.77 -0.65 0.23 0.00 0.00 176.35 176.69 2wrl h PRO 66 N 2.41 0.56 -0.50 1.29 0.11 -1.92 -1.70 132.00 132.24 2wrl h PRO 66 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2wrl h PRO 66 Cb 1.26 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2wrl h PRO 66 CO 0.61 0.37 0.00 0.72 -0.21 0.00 0.00 178.00 179.49 2wrl n HIS 67 N -4.89 0.66 -1.19 0.65 8.25 -1.26 -5.08 115.22 112.36 2wrl n HIS 67 Ca 0.12 -0.34 0.14 0.00 -0.26 0.00 0.00 57.72 57.38 2wrl n HIS 67 Cb 0.31 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.37 2wrl n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wrl n GLY 68 N 1.50 -1.81 0.00 -1.41 0.00 -0.64 -4.19 105.19 98.65 2wrl n GLY 68 Ca 0.21 -0.83 0.12 0.00 0.00 0.00 0.00 46.02 45.51 2wrl n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wrl n LEU 69 N -3.63 0.00 -3.75 0.99 4.77 -1.26 -4.68 117.00 109.45 2wrl n LEU 69 Ca -0.02 0.41 -0.24 0.00 -0.03 0.00 0.00 56.01 56.13 2wrl n LEU 69 Cb 0.64 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2wrl n LEU 69 CO 0.02 -0.07 -0.17 0.61 -1.33 0.00 0.00 177.39 176.44 2wrl n GLY 70 N 0.90 -1.25 0.00 -0.72 0.00 -1.26 -4.59 105.19 98.27 2wrl n GLY 70 Ca 0.08 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.66 2wrl n GLY 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2wrl n LYS 71 N -2.83 0.00 -4.37 1.61 4.81 -1.26 -4.90 118.16 111.21 2wrl n LYS 71 Ca -0.26 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 56.89 2wrl n LYS 71 Cb 0.66 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.58 2wrl n LYS 71 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 2wrl s GLN 72 N 1.08 1.50 -0.22 1.64 2.00 -1.26 -5.09 119.66 119.30 2wrl s GLN 72 Ca 0.00 -1.32 -0.07 0.00 -2.00 0.00 0.00 55.36 51.97 2wrl s GLN 72 Cb 0.00 -1.95 0.10 0.00 0.80 0.00 0.00 33.01 31.97 2wrl s GLN 72 CO 0.00 0.45 0.45 0.54 -0.50 0.00 0.00 175.29 176.24 2wrl s VAL 73 N -1.11 -0.71 -0.93 1.34 0.11 -1.26 -5.08 120.40 112.76 2wrl s VAL 73 Ca 0.15 0.11 -0.12 0.00 -2.93 0.00 0.00 61.98 59.20 2wrl s VAL 73 Cb -0.10 -0.74 0.24 0.00 -1.53 0.00 0.00 36.38 34.25 2wrl s VAL 73 CO 0.07 0.04 0.88 0.00 -3.33 0.00 0.00 175.10 172.76 2wrl s ARG 74 N 2.66 3.79 0.58 1.54 1.70 -1.26 -4.87 118.95 123.09 2wrl s ARG 74 Ca -0.00 -2.75 -0.19 0.00 -0.47 0.00 0.00 55.73 52.33 2wrl s ARG 74 Cb -0.12 -4.45 -0.06 0.00 -0.57 0.00 0.00 34.95 29.74 2wrl s ARG 74 CO -0.14 -1.27 0.85 0.28 -1.08 0.00 0.00 175.30 173.94 2wrl n VAL 75 N 3.48 3.24 -5.21 4.99 0.31 -1.26 -2.14 118.33 121.75 2wrl n VAL 75 Ca 0.17 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.70 2wrl n VAL 75 Cb 0.44 -1.02 -0.16 0.00 -0.91 0.00 0.00 33.84 32.18 2wrl n VAL 75 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2wrl s LEU 76 N -1.20 2.04 0.02 7.52 2.96 0.91 -3.28 118.68 127.66 2wrl s LEU 76 Ca 0.73 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 54.26 2wrl s LEU 76 Cb -0.43 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 2wrl s LEU 76 CO 0.50 0.26 -0.24 0.00 -1.32 0.00 0.00 176.35 175.55 2wrl s ALA 77 N -0.35 2.33 -0.37 5.97 0.00 0.36 -1.59 121.76 128.11 2wrl s ALA 77 Ca 0.03 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 50.81 2wrl s ALA 77 Cb -0.11 -0.58 0.15 0.00 0.00 0.00 0.00 23.12 22.58 2wrl s ALA 77 CO 0.01 0.54 0.33 0.42 0.00 0.00 0.00 175.76 177.07 2wrl s ILE 78 N -0.78 -0.18 0.00 0.00 1.01 -1.20 -3.65 121.20 116.40 2wrl s ILE 78 Ca 0.12 -1.26 0.00 0.00 0.00 0.00 0.00 60.65 59.51 2wrl s ILE 78 Cb -0.10 -0.80 0.00 0.00 0.01 0.00 0.00 42.46 41.56 2wrl s ILE 78 CO 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 174.94 174.24 2wrl n ALA 79 N 4.11 0.00 -3.53 9.38 0.00 -1.04 -2.98 120.51 126.45 2wrl n ALA 79 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 2wrl n ALA 79 Cb 0.43 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.75 2wrl n ALA 79 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2wrl s LYS 80 N 1.00 0.17 7.11 0.00 2.20 -1.26 -3.74 119.74 125.23 2wrl s LYS 80 Ca 0.00 0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.90 2wrl s LYS 80 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 37.83 35.32 2wrl s LYS 80 CO 0.00 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 174.82 2wrl n GLY 81 N 5.32 3.90 0.60 5.54 0.00 -1.26 -3.12 105.19 116.18 2wrl n GLY 81 Ca -0.05 0.07 0.41 0.00 0.00 0.00 0.00 46.02 46.45 2wrl n GLY 81 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2wrl n GLU 82 N 14.00 0.01 0.14 1.61 0.28 -1.26 0.13 120.64 135.55 2wrl n GLU 82 Ca 0.00 1.00 0.06 0.00 -0.16 0.00 0.00 57.16 58.06 2wrl n GLU 82 Cb 0.00 -2.37 0.05 0.00 1.43 0.00 0.00 31.44 30.55 2wrl n GLU 82 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 2wrl h LYS 83 N 0.00 0.00 -0.13 3.44 1.79 -1.95 -2.87 116.57 116.85 2wrl h LYS 83 Ca 0.72 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 59.14 2wrl h LYS 83 Cb 3.25 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 33.89 2wrl h LYS 83 CO -0.01 0.25 -0.11 0.82 -1.08 0.00 0.00 179.45 179.32 2wrl h ILE 84 N 0.00 1.16 0.07 1.86 2.04 0.88 -1.53 117.51 121.99 2wrl h ILE 84 Ca -0.02 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 2wrl h ILE 84 Cb 1.24 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 2wrl h ILE 84 CO 0.03 0.21 -0.03 0.11 0.00 0.00 0.00 178.15 178.47 2wrl h LYS 85 N 0.20 -0.09 -0.14 2.37 6.56 -1.59 -2.50 116.57 121.37 2wrl h LYS 85 Ca 0.04 0.01 0.04 0.00 -1.06 0.00 0.00 60.65 59.68 2wrl h LYS 85 Cb 0.32 0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.00 2wrl h LYS 85 CO 0.02 0.16 0.53 1.49 -2.06 0.00 0.00 179.45 179.60 2wrl h GLU 86 N -1.00 0.00 0.05 3.15 4.81 -1.42 0.61 114.58 120.78 2wrl h GLU 86 Ca -0.01 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 2wrl h GLU 86 Cb 0.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2wrl h GLU 86 CO 0.02 0.00 -0.83 0.00 -0.73 0.00 0.00 179.01 177.46 2wrl h ALA 87 N 1.07 0.11 -0.44 2.92 0.00 -1.33 -0.48 119.26 121.11 2wrl h ALA 87 Ca 0.07 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.10 2wrl h ALA 87 Cb 1.14 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 2wrl h ALA 87 CO -0.00 0.46 0.27 0.93 0.00 0.00 0.00 179.25 180.92 2wrl h GLU 88 N -0.73 0.59 -0.55 0.00 5.08 -0.14 -1.25 114.58 117.57 2wrl h GLU 88 Ca -0.20 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2wrl h GLU 88 Cb 1.37 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2wrl h GLU 88 CO -0.02 0.42 0.27 0.93 -1.00 0.00 0.00 179.01 179.61 2wrl h GLU 89 N 0.58 0.79 -0.01 2.33 5.08 -0.09 -1.86 114.58 121.40 2wrl h GLU 89 Ca 0.16 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wrl h GLU 89 Cb -0.03 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 2wrl h GLU 89 CO -0.03 0.64 0.10 0.00 -1.00 0.00 0.00 179.01 178.72 2wrl h ALA 90 N 1.11 1.13 0.00 3.43 0.00 -0.50 -3.45 119.26 120.97 2wrl h ALA 90 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2wrl h ALA 90 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2wrl h ALA 90 CO -0.03 -0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.53 2wrl n GLY 91 N -1.13 1.14 3.73 0.00 0.00 -0.70 -4.53 105.19 103.69 2wrl n GLY 91 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2wrl n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrl s ALA 92 N -2.00 3.85 0.33 4.61 0.00 -0.53 -4.88 121.76 123.14 2wrl s ALA 92 Ca 0.00 1.60 0.05 0.00 0.00 0.00 0.00 51.96 53.61 2wrl s ALA 92 Cb 0.00 -3.68 0.57 0.00 0.00 0.00 0.00 23.12 20.02 2wrl s ALA 92 CO 0.00 -0.97 1.82 -0.44 0.00 0.00 0.00 175.76 176.17 2wrl h ASP 93 N 5.84 0.39 -2.82 0.00 5.19 -1.88 -3.40 116.42 119.75 2wrl h ASP 93 Ca -0.45 -0.10 -0.54 0.00 -0.62 0.00 0.00 57.03 55.32 2wrl h ASP 93 Cb 1.21 -0.11 -0.40 0.00 0.18 0.00 0.00 39.33 40.22 2wrl h ASP 93 CO 0.88 0.58 -0.78 -0.31 -3.12 0.00 0.00 179.24 176.48 2wrl s TYR 94 N -4.68 0.52 0.31 4.55 2.02 -1.21 -5.07 117.35 113.79 2wrl s TYR 94 Ca -0.06 -1.05 0.06 0.00 -0.37 0.00 0.00 57.07 55.64 2wrl s TYR 94 Cb 0.15 -1.00 -0.02 0.00 -0.40 0.00 0.00 41.96 40.70 2wrl s TYR 94 CO 0.76 -0.83 0.45 0.08 -1.57 0.00 0.00 175.55 174.44 2wrl s VAL 95 N 1.94 4.43 -0.34 0.71 1.01 -1.26 -0.49 120.40 126.40 2wrl s VAL 95 Ca 0.10 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2wrl s VAL 95 Cb -0.17 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2wrl s VAL 95 CO -0.32 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.17 2wrl n GLY 96 N -1.60 -0.82 0.00 4.51 0.00 -1.24 -4.91 105.19 101.14 2wrl n GLY 96 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2wrl n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wrl n GLY 97 N 0.00 4.17 0.00 -0.02 0.00 -1.26 -2.49 105.19 105.59 2wrl n GLY 97 Ca 0.00 -1.20 0.05 0.00 0.00 0.00 0.00 46.02 44.86 2wrl n GLY 97 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wrl n GLU 98 N 0.00 0.06 -0.13 1.61 1.02 -1.24 -2.16 120.64 119.80 2wrl n GLU 98 Ca 0.00 0.28 -0.02 0.00 -0.02 0.00 0.00 57.16 57.40 2wrl n GLU 98 Cb 0.00 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 29.93 2wrl n GLU 98 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2wrl n GLU 99 N -1.41 1.08 0.00 3.49 1.02 -1.26 -3.21 120.64 120.35 2wrl n GLU 99 Ca 0.03 -0.19 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2wrl n GLU 99 Cb 0.10 -1.07 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 2wrl n GLU 99 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2wrl n ILE 100 N 0.49 0.00 0.24 -3.67 2.08 -0.92 -4.81 119.36 112.78 2wrl n ILE 100 Ca 0.04 0.00 0.05 0.00 0.56 0.00 0.00 62.75 63.40 2wrl n ILE 100 Cb 0.57 0.02 0.26 0.00 -0.75 0.00 0.00 39.64 39.74 2wrl n ILE 100 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 2wrl h ILE 101 N 0.00 0.00 0.03 1.39 5.03 -1.76 -2.90 117.51 119.30 2wrl h ILE 101 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.74 2wrl h ILE 101 Cb 0.07 0.21 0.00 0.00 -3.03 0.00 0.00 36.82 34.07 2wrl h ILE 101 CO 0.00 0.00 -0.01 -0.61 -0.68 0.00 0.00 178.15 176.85 2wrl h GLN 102 N 0.00 -0.04 -0.86 2.37 5.75 -1.87 -2.00 115.11 118.47 2wrl h GLN 102 Ca 0.00 0.00 0.13 0.00 -0.15 0.00 0.00 58.65 58.63 2wrl h GLN 102 Cb 1.22 0.01 -0.14 0.00 1.07 0.00 0.00 27.48 29.65 2wrl h GLN 102 CO 0.00 -0.02 -0.35 1.63 -2.65 0.00 0.00 178.83 177.43 2wrl n LYS 103 N -2.18 -0.22 0.14 1.69 5.02 -1.09 0.16 118.16 121.67 2wrl n LYS 103 Ca -0.00 1.32 0.00 0.00 -2.02 0.00 0.00 58.31 57.61 2wrl n LYS 103 Cb 0.02 -1.96 0.27 0.00 -0.02 0.00 0.00 35.03 33.34 2wrl n LYS 103 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2wrl h ILE 104 N 0.00 1.31 0.00 -0.18 2.04 -1.72 -2.07 117.51 116.90 2wrl h ILE 104 Ca 0.28 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.63 2wrl h ILE 104 Cb 0.50 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 2wrl h ILE 104 CO -0.85 0.44 0.00 -0.11 0.00 0.00 0.00 178.15 177.63 2wrl n LEU 105 N -4.02 0.00 -0.08 1.44 7.94 0.42 -2.46 117.00 120.24 2wrl n LEU 105 Ca -0.02 0.38 -0.09 0.00 -1.11 0.00 0.00 56.01 55.17 2wrl n LEU 105 Cb 0.47 -0.38 -0.10 0.00 0.53 0.00 0.00 43.42 43.94 2wrl n LEU 105 CO 0.41 -0.25 -1.02 0.47 -1.11 0.00 0.00 177.39 175.89 2wrl n ASP 106 N -1.38 2.01 0.00 1.96 8.00 -0.60 -5.01 116.55 121.53 2wrl n ASP 106 Ca 0.04 -0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2wrl n ASP 106 Cb 0.10 0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 2wrl n ASP 106 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wrl n GLY 107 N 2.36 0.00 3.66 0.44 0.00 -1.03 -5.13 105.19 105.49 2wrl n GLY 107 Ca -0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 2wrl n GLY 107 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2wrl s TRP 108 N 0.00 1.34 0.00 1.61 -0.00 -1.12 -4.84 118.94 115.93 2wrl s TRP 108 Ca 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 56.10 55.70 2wrl s TRP 108 Cb 0.00 -4.21 0.00 0.00 -0.00 0.00 0.00 33.47 29.26 2wrl s TRP 108 CO 0.00 -5.41 0.55 -1.33 -0.00 0.00 0.00 176.95 170.76 2wrl n MET 109 N 7.51 0.73 -0.77 5.86 2.81 -1.26 -4.33 117.12 127.67 2wrl n MET 109 Ca 0.20 -0.69 -0.25 0.00 -1.81 0.00 0.00 57.70 55.15 2wrl n MET 109 Cb 0.41 -0.70 -0.02 0.00 -0.71 0.00 0.00 33.22 32.20 2wrl n MET 109 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2wrl n ASP 110 N -0.14 4.24 -3.78 7.83 8.00 -1.26 -4.78 116.55 126.65 2wrl n ASP 110 Ca 0.00 -2.37 -0.13 0.00 0.71 0.00 0.00 54.79 53.01 2wrl n ASP 110 Cb 0.33 -1.07 -0.10 0.00 -0.02 0.00 0.00 41.12 40.26 2wrl n ASP 110 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2wrl s PHE 111 N 3.78 -0.19 0.00 1.24 -0.12 -1.26 -5.09 117.98 116.33 2wrl s PHE 111 Ca 0.40 0.39 0.00 0.00 -0.05 0.00 0.00 56.93 57.67 2wrl s PHE 111 Cb 0.10 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.57 2wrl s PHE 111 CO -0.00 -0.29 0.00 -0.25 -0.05 0.00 0.00 175.22 174.63 2wrl n ASP 112 N 1.89 0.00 -4.94 1.98 9.92 -0.91 -4.99 116.55 119.50 2wrl n ASP 112 Ca -0.19 0.26 -0.26 0.00 -0.53 0.00 0.00 54.79 54.07 2wrl n ASP 112 Cb 0.57 -0.37 -0.03 0.00 -0.64 0.00 0.00 41.12 40.64 2wrl n ASP 112 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2wrl s ALA 113 N -3.33 3.92 -0.27 2.24 0.00 -1.12 -4.93 121.76 118.26 2wrl s ALA 113 Ca 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 2wrl s ALA 113 Cb 0.00 -1.84 0.10 0.00 0.00 0.00 0.00 23.12 21.38 2wrl s ALA 113 CO 0.00 0.44 0.16 0.08 0.00 0.00 0.00 175.76 176.45 2wrl s VAL 114 N -1.83 -0.15 0.24 0.00 1.01 -1.26 -0.06 120.40 118.35 2wrl s VAL 114 Ca 0.36 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.84 2wrl s VAL 114 Cb -0.11 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2wrl s VAL 114 CO 0.29 -0.58 0.01 0.68 0.00 0.00 0.00 175.10 175.50 2wrl s VAL 115 N 2.17 3.59 0.05 2.92 -7.23 -0.62 -3.81 120.40 117.47 2wrl s VAL 115 Ca 0.08 -1.76 -0.25 0.00 -1.81 0.00 0.00 61.98 58.23 2wrl s VAL 115 Cb -0.16 -2.90 0.06 0.00 0.56 0.00 0.00 36.38 33.95 2wrl s VAL 115 CO -0.31 -0.31 0.59 0.00 -0.31 0.00 0.00 175.10 174.77 2wrl s ALA 116 N -2.17 -1.55 0.09 1.32 0.00 -1.04 -3.22 121.76 115.19 2wrl s ALA 116 Ca 0.31 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 2wrl s ALA 116 Cb -0.07 0.41 -0.06 0.00 0.00 0.00 0.00 23.12 23.40 2wrl s ALA 116 CO 0.20 -0.54 0.46 0.95 0.00 0.00 0.00 175.76 176.83 2wrl s THR 117 N -2.43 4.99 -0.05 0.00 -4.23 -1.16 -3.29 115.64 109.48 2wrl s THR 117 Ca -0.05 0.66 0.15 0.00 -1.18 0.00 0.00 61.69 61.27 2wrl s THR 117 Cb -0.01 -3.69 0.15 0.00 1.34 0.00 0.00 72.50 70.29 2wrl s THR 117 CO -0.01 0.33 1.39 -2.65 -0.54 0.00 0.00 174.62 173.13 2wrl n PRO 118 N 1.03 0.10 -0.06 3.99 -0.02 -1.26 -1.07 135.00 137.72 2wrl n PRO 118 Ca -0.08 0.58 0.10 0.00 -2.02 0.00 0.00 63.50 62.09 2wrl n PRO 118 Cb 0.52 -2.05 0.42 0.00 -0.02 0.00 0.00 33.50 32.37 2wrl n PRO 118 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2wrl n ASP 119 N -2.10 1.28 -1.05 2.55 5.68 -1.26 -3.41 116.55 118.25 2wrl n ASP 119 Ca -0.01 -1.64 0.01 0.00 -0.50 0.00 0.00 54.79 52.65 2wrl n ASP 119 Cb 0.24 -0.08 -0.00 0.00 -1.14 0.00 0.00 41.12 40.14 2wrl n ASP 119 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2wrl n VAL 120 N 0.07 0.00 0.09 2.12 0.24 -0.23 -4.88 118.33 115.73 2wrl n VAL 120 Ca 0.16 -0.47 -0.02 0.00 -2.04 0.00 0.00 64.34 61.97 2wrl n VAL 120 Cb 0.27 0.68 -0.05 0.00 -1.47 0.00 0.00 33.84 33.27 2wrl n VAL 120 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2wrl h MET 121 N 0.47 0.00 -0.19 7.34 2.86 -1.54 -3.27 114.93 120.59 2wrl h MET 121 Ca -0.20 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.46 2wrl h MET 121 Cb 1.60 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.22 2wrl h MET 121 CO -0.00 0.65 -0.28 0.78 1.06 0.00 0.00 176.91 179.12 2wrl h GLY 122 N 3.35 -1.47 1.46 8.32 0.00 -1.90 0.75 103.07 113.59 2wrl h GLY 122 Ca -0.05 0.77 -0.12 0.00 0.00 0.00 0.00 47.33 47.94 2wrl h GLY 122 CO 0.09 -0.43 -0.30 0.00 0.00 0.00 0.00 176.54 175.90 2wrl h ALA 123 N -0.69 0.93 -0.08 3.60 0.00 -1.99 -2.84 119.26 118.19 2wrl h ALA 123 Ca 0.03 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2wrl h ALA 123 Cb 0.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2wrl h ALA 123 CO -0.29 0.61 -0.27 0.28 0.00 0.00 0.00 179.25 179.58 2wrl h VAL 124 N 0.52 1.23 0.05 0.00 2.07 -1.49 0.20 116.25 118.84 2wrl h VAL 124 Ca 0.06 -1.08 -0.23 0.00 0.82 0.00 0.00 66.70 66.27 2wrl h VAL 124 Cb 0.78 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 2wrl h VAL 124 CO 0.06 0.32 -1.05 1.23 0.02 0.00 0.00 177.57 178.16 2wrl h GLY 125 N 0.94 0.23 0.00 2.17 0.00 0.70 -3.34 103.07 103.77 2wrl h GLY 125 Ca 0.02 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2wrl h GLY 125 CO 0.04 0.45 -0.58 1.44 0.00 0.00 0.00 176.54 177.89 2wrl n SER 126 N -3.56 1.18 -0.52 0.19 7.64 -1.09 -4.11 113.62 113.34 2wrl n SER 126 Ca -0.05 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.03 2wrl n SER 126 Cb 0.92 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 2wrl n SER 126 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2wrl n LYS 127 N -3.68 0.30 -1.20 1.43 5.02 0.05 -2.45 118.16 117.62 2wrl n LYS 127 Ca -0.08 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.15 2wrl n LYS 127 Cb 0.30 -1.16 -0.04 0.00 -0.02 0.00 0.00 35.03 34.12 2wrl n LYS 127 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2wrl n LEU 128 N 0.37 -0.97 -0.46 -0.35 7.94 -1.24 -4.90 117.00 117.39 2wrl n LEU 128 Ca 0.00 -1.99 0.11 0.00 -1.11 0.00 0.00 56.01 53.02 2wrl n LEU 128 Cb 0.08 0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.06 2wrl n LEU 128 CO 0.00 1.44 0.30 0.61 -1.11 0.00 0.00 177.39 178.63 2wrl n GLY 129 N -0.22 -0.04 0.79 -3.96 0.00 -1.03 -3.32 105.19 97.42 2wrl n GLY 129 Ca -0.24 -0.63 0.08 0.00 0.00 0.00 0.00 46.02 45.22 2wrl n GLY 129 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wrl n ARG 130 N -0.12 2.87 0.00 1.61 3.00 -1.26 -3.22 116.66 119.54 2wrl n ARG 130 Ca 0.09 -2.62 0.00 0.00 -0.00 0.00 0.00 57.85 55.32 2wrl n ARG 130 Cb 0.46 -1.68 0.00 0.00 0.00 0.00 0.00 32.46 31.24 2wrl n ARG 130 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2wrl n ILE 131 N -0.28 0.00 -0.21 5.15 5.41 -1.26 -4.81 119.36 123.36 2wrl n ILE 131 Ca 0.18 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.93 2wrl n ILE 131 Cb 0.76 -0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.69 2wrl n ILE 131 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2wrl n LEU 132 N -0.54 1.15 -0.08 1.39 4.77 -1.21 -4.64 117.00 117.85 2wrl n LEU 132 Ca 0.00 -1.15 -0.10 0.00 -0.03 0.00 0.00 56.01 54.73 2wrl n LEU 132 Cb 0.04 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.08 2wrl n LEU 132 CO 0.00 0.29 -0.36 1.23 -1.33 0.00 0.00 177.39 177.21 2wrl h GLY 133 N 0.00 0.00 1.26 -0.72 0.00 -1.77 1.62 103.07 103.46 2wrl h GLY 133 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wrl h GLY 133 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 176.54 175.49 2wrl n PRO 134 N -4.57 0.27 0.00 4.80 -0.02 -1.26 -1.05 135.00 133.17 2wrl n PRO 134 Ca -0.15 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2wrl n PRO 134 Cb 0.38 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 2wrl n PRO 134 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wrl n ARG 135 N -1.13 1.41 0.00 -0.52 3.00 -1.26 -4.99 116.66 113.17 2wrl n ARG 135 Ca 0.07 -1.00 0.00 0.00 -0.01 0.00 0.00 57.85 56.91 2wrl n ARG 135 Cb 0.06 -0.87 0.00 0.00 0.00 0.00 0.00 32.46 31.66 2wrl n ARG 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2wrl n GLY 136 N -0.27 0.42 0.21 -0.13 0.00 -0.21 -4.74 105.19 100.47 2wrl n GLY 136 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2wrl n GLY 136 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wrl h LEU 137 N 0.00 0.00 -9.11 0.99 3.38 -1.20 -3.43 115.31 105.94 2wrl h LEU 137 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 2wrl h LEU 137 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2wrl h LEU 137 CO 0.00 0.00 1.25 -0.22 0.09 0.00 0.00 178.44 179.56 2wrl s LEU 138 N -4.60 3.93 -0.45 1.67 1.98 0.53 -4.36 118.68 117.38 2wrl s LEU 138 Ca -0.02 1.98 -0.44 0.00 -2.89 0.00 0.00 54.13 52.76 2wrl s LEU 138 Cb 0.05 -3.53 -0.19 0.00 0.66 0.00 0.00 46.19 43.19 2wrl s LEU 138 CO 0.17 -1.38 1.76 -2.65 -1.89 0.00 0.00 176.35 172.36 2wrl n PRO 139 N 7.91 0.29 -4.93 0.98 -0.02 -1.25 -4.91 135.00 133.08 2wrl n PRO 139 Ca 0.22 0.10 -0.27 0.00 -2.02 0.00 0.00 63.50 61.53 2wrl n PRO 139 Cb 0.44 -1.67 -0.16 0.00 -0.02 0.00 0.00 33.50 32.09 2wrl n PRO 139 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2wrl s ASN 140 N 3.86 2.32 0.31 2.55 3.84 -1.26 -4.77 114.94 121.78 2wrl s ASN 140 Ca 1.07 -0.37 0.03 0.00 0.21 0.00 0.00 52.86 53.79 2wrl s ASN 140 Cb -1.38 -0.51 0.62 0.00 -0.55 0.00 0.00 41.25 39.43 2wrl s ASN 140 CO 0.74 0.20 1.88 -0.65 -2.79 0.00 0.00 177.10 176.48 2wrl h PRO 141 N 6.02 0.90 -0.59 0.43 0.11 -1.91 0.21 132.00 137.17 2wrl h PRO 141 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2wrl h PRO 141 Cb 1.16 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2wrl h PRO 141 CO 0.48 0.59 0.00 1.63 -0.21 0.00 0.00 178.00 180.49 2wrl n LYS 142 N -4.54 1.73 0.00 1.05 5.02 -1.26 -3.14 118.16 117.03 2wrl n LYS 142 Ca 0.16 -0.73 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 2wrl n LYS 142 Cb 0.31 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 2wrl n LYS 142 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wrl n ALA 143 N 0.10 1.88 -3.08 7.82 0.00 0.69 -4.07 120.51 123.85 2wrl n ALA 143 Ca 0.07 -0.45 -0.23 0.00 0.00 0.00 0.00 53.44 52.83 2wrl n ALA 143 Cb 0.34 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.83 2wrl n ALA 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrl n GLY 144 N -0.05 -0.53 0.08 0.00 0.00 -1.05 -4.85 105.19 98.79 2wrl n GLY 144 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 46.02 46.19 2wrl n GLY 144 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wrl n THR 145 N -4.57 0.00 -4.03 2.61 -1.04 -1.01 -4.94 114.28 101.30 2wrl n THR 145 Ca -0.10 -0.42 -0.32 0.00 -2.04 0.00 0.00 64.05 61.18 2wrl n THR 145 Cb 0.62 1.04 -0.15 0.00 -1.82 0.00 0.00 70.33 70.02 2wrl n THR 145 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2wrl s VAL 146 N -1.16 2.04 -0.00 12.58 1.01 -1.24 -2.50 120.40 131.12 2wrl s VAL 146 Ca 0.04 -1.63 -0.29 0.00 0.00 0.00 0.00 61.98 60.09 2wrl s VAL 146 Cb 0.04 -2.22 0.11 0.00 0.00 0.00 0.00 36.38 34.31 2wrl s VAL 146 CO 0.17 -0.11 1.27 -0.83 0.00 0.00 0.00 175.10 175.60 2wrl s GLY 147 N 1.14 -0.30 -0.05 4.51 0.00 -1.21 -4.80 107.32 106.62 2wrl s GLY 147 Ca -0.06 0.43 0.19 0.00 0.00 0.00 0.00 44.72 45.28 2wrl s GLY 147 CO -0.06 1.98 0.48 0.69 0.00 0.00 0.00 173.10 176.18 2wrl n PHE 148 N -0.63 0.35 -0.67 1.90 3.72 -1.26 -4.02 117.46 116.85 2wrl n PHE 148 Ca -0.04 0.12 -0.05 0.00 -0.05 0.00 0.00 57.45 57.43 2wrl n PHE 148 Cb 0.61 -0.87 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 2wrl n PHE 148 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2wrl n ASN 149 N -2.64 5.42 0.11 4.37 2.04 -1.26 -4.53 115.26 118.78 2wrl n ASN 149 Ca -0.15 -2.48 0.18 0.00 -0.44 0.00 0.00 54.58 51.68 2wrl n ASN 149 Cb 0.85 -1.20 0.58 0.00 -2.53 0.00 0.00 39.78 37.48 2wrl n ASN 149 CO 0.00 0.00 0.00 -0.29 -0.44 0.00 0.00 177.26 176.53 2wrl h ILE 150 N 1.27 0.14 -0.10 1.53 6.09 -1.96 0.12 117.51 124.58 2wrl h ILE 150 Ca 0.07 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.52 2wrl h ILE 150 Cb 1.12 0.40 -0.00 0.00 0.47 0.00 0.00 36.82 38.81 2wrl h ILE 150 CO 0.12 0.00 -0.10 1.23 -3.07 0.00 0.00 178.15 176.33 2wrl h GLY 151 N 0.00 0.27 1.01 8.18 0.00 -1.79 0.29 103.07 111.02 2wrl h GLY 151 Ca 0.19 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 2wrl h GLY 151 CO -0.00 0.25 0.07 -2.09 0.00 0.00 0.00 176.54 174.76 2wrl h GLU 152 N -0.16 0.91 0.81 4.80 4.81 -1.16 -2.36 114.58 122.22 2wrl h GLU 152 Ca 0.02 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 58.95 2wrl h GLU 152 Cb 0.62 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.90 2wrl h GLU 152 CO 0.02 0.89 -0.39 0.82 -0.73 0.00 0.00 179.01 179.63 2wrl h ILE 153 N 0.79 0.07 -1.01 2.32 2.04 -1.32 0.39 117.51 120.80 2wrl h ILE 153 Ca 0.16 -0.17 0.23 0.00 1.00 0.00 0.00 64.86 66.08 2wrl h ILE 153 Cb 0.43 0.08 -0.10 0.00 -0.74 0.00 0.00 36.82 36.49 2wrl h ILE 153 CO 0.01 0.01 0.63 0.40 0.00 0.00 0.00 178.15 179.20 2wrl h ILE 154 N -1.24 0.60 -0.11 -0.67 2.04 -0.43 0.61 117.51 118.31 2wrl h ILE 154 Ca -0.11 -0.19 -0.19 0.00 1.00 0.00 0.00 64.86 65.37 2wrl h ILE 154 Cb 0.84 -0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2wrl h ILE 154 CO 0.18 0.10 -0.68 0.03 0.00 0.00 0.00 178.15 177.79 2wrl h ARG 155 N 0.56 0.65 0.00 2.37 3.08 -1.34 -3.01 114.38 116.70 2wrl h ARG 155 Ca 0.59 -0.55 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2wrl h ARG 155 Cb 1.21 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2wrl h ARG 155 CO -0.36 1.17 -0.02 1.49 -1.07 0.00 0.00 179.97 181.18 2wrl h GLU 156 N 0.30 0.00 0.06 0.04 4.81 0.12 -0.53 114.58 119.38 2wrl h GLU 156 Ca -0.05 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2wrl h GLU 156 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2wrl h GLU 156 CO 0.14 0.02 -0.03 0.82 -0.73 0.00 0.00 179.01 179.23 2wrl h ILE 157 N 0.00 0.00 -0.27 2.32 2.04 -0.99 -3.19 117.51 117.42 2wrl h ILE 157 Ca -0.00 -0.23 0.08 0.00 1.00 0.00 0.00 64.86 65.71 2wrl h ILE 157 Cb 0.05 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.12 2wrl h ILE 157 CO 0.00 0.00 0.35 0.11 0.00 0.00 0.00 178.15 178.62 2wrl h LYS 158 N -0.31 0.00 -0.39 2.37 1.57 -1.49 -0.63 116.57 117.68 2wrl h LYS 158 Ca -0.01 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.83 2wrl h LYS 158 Cb 0.06 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 2wrl h LYS 158 CO 0.01 0.00 0.09 0.00 -0.57 0.00 0.00 179.45 178.98 2wrl h ALA 159 N 1.55 0.43 0.00 3.86 0.00 -1.16 -3.46 119.26 120.47 2wrl h ALA 159 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2wrl h ALA 159 Cb 0.83 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2wrl h ALA 159 CO -0.00 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.35 2wrl n GLY 160 N -1.24 0.00 3.80 0.00 0.00 -0.26 -4.72 105.19 102.77 2wrl n GLY 160 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2wrl n GLY 160 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wrl s ARG 161 N 0.00 3.87 0.22 1.61 3.52 -1.13 -2.95 118.95 124.09 2wrl s ARG 161 Ca 0.00 -0.15 0.10 0.00 -0.13 0.00 0.00 55.73 55.55 2wrl s ARG 161 Cb 0.00 -3.32 -0.04 0.00 -1.56 0.00 0.00 34.95 30.03 2wrl s ARG 161 CO 0.00 0.51 -0.11 0.96 -0.81 0.00 0.00 175.30 175.85 2wrl s ILE 162 N -0.25 3.03 -0.21 4.11 -4.36 -0.52 -4.91 121.20 118.10 2wrl s ILE 162 Ca 0.12 -1.91 -0.01 0.00 -0.26 0.00 0.00 60.65 58.59 2wrl s ILE 162 Cb -0.12 -2.54 0.01 0.00 1.25 0.00 0.00 42.46 41.06 2wrl s ILE 162 CO 0.01 -0.24 -0.12 -0.70 0.24 0.00 0.00 174.94 174.14 2wrl s GLU 163 N -3.16 3.11 0.21 0.37 2.12 -1.26 -1.74 118.70 118.35 2wrl s GLU 163 Ca 0.27 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.86 2wrl s GLU 163 Cb -0.07 -2.80 -0.03 0.00 0.26 0.00 0.00 34.13 31.49 2wrl s GLU 163 CO 0.16 -0.23 0.34 -0.59 -0.54 0.00 0.00 175.26 174.40 2wrl s PHE 164 N 1.37 3.47 -0.30 5.30 -0.12 -0.45 -4.98 117.98 122.26 2wrl s PHE 164 Ca 0.05 0.06 -0.14 0.00 -0.05 0.00 0.00 56.93 56.84 2wrl s PHE 164 Cb -0.14 -1.63 0.18 0.00 -0.63 0.00 0.00 43.02 40.80 2wrl s PHE 164 CO -0.08 0.45 1.12 0.50 -0.05 0.00 0.00 175.22 177.16 2wrl s ARG 165 N -3.72 0.09 0.70 1.99 3.52 -1.26 -2.78 118.95 117.49 2wrl s ARG 165 Ca 0.35 0.13 -0.17 0.00 -0.13 0.00 0.00 55.73 55.91 2wrl s ARG 165 Cb -0.10 0.07 -0.09 0.00 -1.56 0.00 0.00 34.95 33.27 2wrl s ARG 165 CO 0.29 -0.14 0.14 0.27 -0.81 0.00 0.00 175.30 175.04 2wrl n ASN 166 N 5.26 -2.65 -4.89 -2.12 6.94 -1.14 -4.76 115.26 111.92 2wrl n ASN 166 Ca 0.01 0.55 -0.20 0.00 -0.02 0.00 0.00 54.58 54.92 2wrl n ASN 166 Cb 0.56 -1.04 -0.03 0.00 -2.36 0.00 0.00 39.78 36.92 2wrl n ASN 166 CO 0.00 0.00 0.00 1.51 -1.03 0.00 0.00 177.26 177.74 2wrl s ASP 167 N -1.25 5.23 0.00 0.53 1.47 -0.74 -4.95 116.67 116.95 2wrl s ASP 167 Ca 0.59 -0.61 0.00 0.00 1.18 0.00 0.00 52.55 53.72 2wrl s ASP 167 Cb -0.37 -0.74 0.00 0.00 -0.34 0.00 0.00 42.92 41.47 2wrl s ASP 167 CO 0.64 -0.56 0.56 2.29 0.68 0.00 0.00 175.17 178.78 2wrl n LYS 168 N -1.53 0.00 0.01 2.11 2.85 -1.26 0.43 118.16 120.78 2wrl n LYS 168 Ca 0.02 0.16 0.03 0.00 -1.05 0.00 0.00 58.31 57.47 2wrl n LYS 168 Cb 0.61 -1.61 -0.11 0.00 -0.65 0.00 0.00 35.03 33.27 2wrl n LYS 168 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2wrl n THR 169 N -1.06 0.82 -0.08 0.58 -2.24 -1.26 -4.75 114.28 106.29 2wrl n THR 169 Ca 0.00 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 2wrl n THR 169 Cb 0.11 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 2wrl n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wrl n GLY 170 N 1.39 1.89 3.21 3.38 0.00 0.17 -4.81 105.19 110.42 2wrl n GLY 170 Ca -0.11 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 2wrl n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrl s ALA 171 N -2.00 1.55 0.21 4.61 0.00 -1.25 -2.42 121.76 122.46 2wrl s ALA 171 Ca 0.00 -0.95 0.11 0.00 0.00 0.00 0.00 51.96 51.11 2wrl s ALA 171 Cb 0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 2wrl s ALA 171 CO 0.00 0.34 -0.22 -1.50 0.00 0.00 0.00 175.76 174.38 2wrl s ILE 172 N -0.77 2.27 0.05 0.00 2.07 -0.46 -1.79 121.20 122.57 2wrl s ILE 172 Ca 0.06 -2.11 -0.01 0.00 -1.41 0.00 0.00 60.65 57.18 2wrl s ILE 172 Cb -0.08 -2.12 -0.04 0.00 0.13 0.00 0.00 42.46 40.35 2wrl s ILE 172 CO 0.01 -0.24 -0.03 -1.00 -1.91 0.00 0.00 174.94 171.77 2wrl s HIS 173 N -1.99 0.56 -0.30 3.50 3.76 -1.26 -1.91 115.29 117.65 2wrl s HIS 173 Ca 0.22 -1.03 -0.17 0.00 -0.15 0.00 0.00 55.06 53.93 2wrl s HIS 173 Cb -0.07 -0.40 0.20 0.00 1.11 0.00 0.00 32.58 33.43 2wrl s HIS 173 CO 0.10 -0.35 1.24 0.00 -0.85 0.00 0.00 174.74 174.89 2wrl s ALA 174 N -3.80 -2.87 0.39 -1.40 0.00 -0.79 -4.62 121.76 108.67 2wrl s ALA 174 Ca 0.07 1.93 -0.26 0.00 0.00 0.00 0.00 51.96 53.69 2wrl s ALA 174 Cb 0.07 -2.09 -0.09 0.00 0.00 0.00 0.00 23.12 21.02 2wrl s ALA 174 CO -0.09 -0.58 1.24 -1.25 0.00 0.00 0.00 175.76 175.08 2wrl s PRO 175 N 1.47 4.07 -0.01 0.00 0.04 -1.26 -1.26 135.00 138.05 2wrl s PRO 175 Ca -0.05 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.02 2wrl s PRO 175 Cb -0.02 -2.78 0.03 0.00 0.04 0.00 0.00 34.50 31.77 2wrl s PRO 175 CO -0.13 -0.36 0.85 1.33 0.04 0.00 0.00 177.00 178.74 2wrl n VAL 176 N 0.23 0.24 -1.22 -0.36 0.24 0.14 -4.91 118.33 112.69 2wrl n VAL 176 Ca 0.03 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 2wrl n VAL 176 Cb 0.45 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.41 2wrl n VAL 176 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wrl n GLY 177 N -0.17 0.32 3.49 7.63 0.00 -1.23 -4.83 105.19 110.41 2wrl n GLY 177 Ca 0.02 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 44.10 2wrl n GLY 177 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wrl s LYS 178 N -2.00 1.84 0.09 1.61 -0.14 -1.26 -0.28 119.74 119.60 2wrl s LYS 178 Ca 0.00 -2.10 -0.24 0.00 -1.36 0.00 0.00 55.97 52.27 2wrl s LYS 178 Cb 0.00 -0.66 -0.15 0.00 -1.68 0.00 0.00 37.83 35.34 2wrl s LYS 178 CO 0.00 -0.40 1.72 0.00 -0.76 0.00 0.00 175.35 175.91 2wrl h ALA 179 N 1.89 -0.12 -0.99 5.17 0.00 -1.18 -2.90 119.26 121.13 2wrl h ALA 179 Ca -0.37 -0.02 0.24 0.00 0.00 0.00 0.00 54.91 54.75 2wrl h ALA 179 Cb 1.27 0.06 -0.19 0.00 0.00 0.00 0.00 17.79 18.93 2wrl h ALA 179 CO 0.60 -0.57 -0.11 0.66 0.00 0.00 0.00 179.25 179.83 2wrl h SER 180 N -0.13 -0.70 -0.88 0.00 4.64 -1.92 -3.42 113.55 111.14 2wrl h SER 180 Ca -0.01 0.29 -0.70 0.00 -0.47 0.00 0.00 61.79 60.91 2wrl h SER 180 Cb 0.11 0.55 0.04 0.00 -0.31 0.00 0.00 62.40 62.79 2wrl h SER 180 CO 0.01 -0.34 0.07 0.49 -0.87 0.00 0.00 176.83 176.19 2wrl n PHE 181 N -5.56 0.60 -0.84 4.77 3.01 -1.09 -4.92 117.46 113.43 2wrl n PHE 181 Ca 0.20 0.93 -0.29 0.00 1.01 0.00 0.00 57.45 59.30 2wrl n PHE 181 Cb 0.63 -1.84 0.21 0.00 -0.01 0.00 0.00 39.48 38.47 2wrl n PHE 181 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 2wrl s PRO 182 N 0.09 -0.10 0.17 -1.08 0.02 -1.26 -4.76 135.00 128.09 2wrl s PRO 182 Ca 0.80 0.78 -0.11 0.00 0.02 0.00 0.00 61.00 62.49 2wrl s PRO 182 Cb -1.12 -1.65 0.07 0.00 0.02 0.00 0.00 34.50 31.82 2wrl s PRO 182 CO 0.51 -3.16 1.71 -1.35 -0.33 0.00 0.00 177.00 174.38 2wrl h PRO 183 N -2.21 0.93 0.00 5.54 0.11 -1.91 -2.49 132.00 131.97 2wrl h PRO 183 Ca -0.57 -0.20 -0.06 0.00 0.11 0.00 0.00 66.00 65.29 2wrl h PRO 183 Cb 1.32 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2wrl h PRO 183 CO 0.53 0.83 -0.27 0.93 -0.21 0.00 0.00 178.00 179.81 2wrl h GLU 184 N 0.85 0.00 0.02 1.05 3.07 -1.96 -2.72 114.58 114.90 2wrl h GLU 184 Ca 0.19 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.05 2wrl h GLU 184 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 2wrl h GLU 184 CO -0.01 0.27 -0.01 0.87 -1.40 0.00 0.00 179.01 178.73 2wrl h LYS 185 N 0.00 -0.03 -0.96 2.33 6.56 -1.87 -3.02 116.57 119.57 2wrl h LYS 185 Ca -0.00 0.00 0.12 0.00 -1.06 0.00 0.00 60.65 59.71 2wrl h LYS 185 Cb 0.67 0.01 -0.14 0.00 -0.57 0.00 0.00 32.23 32.19 2wrl h LYS 185 CO 0.03 -0.02 -0.45 1.28 -2.06 0.00 0.00 179.45 178.23 2wrl n LEU 186 N -2.35 -0.78 -0.32 2.94 4.77 -0.96 -1.01 117.00 119.29 2wrl n LEU 186 Ca -0.00 1.69 -0.11 0.00 -0.03 0.00 0.00 56.01 57.56 2wrl n LEU 186 Cb 0.01 -0.32 -0.09 0.00 -2.33 0.00 0.00 43.42 40.69 2wrl n LEU 186 CO 0.01 -1.47 0.49 0.00 -1.33 0.00 0.00 177.39 175.09 2wrl h ALA 187 N 1.00 -0.56 -0.52 -1.18 0.00 -1.61 0.38 119.26 116.77 2wrl h ALA 187 Ca 0.27 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.33 2wrl h ALA 187 Cb 0.51 1.29 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 2wrl h ALA 187 CO -0.94 -0.91 0.35 -0.44 0.00 0.00 0.00 179.25 177.32 2wrl h ASP 188 N -0.08 0.36 -0.15 0.00 3.32 -0.94 0.16 116.42 119.08 2wrl h ASP 188 Ca 0.13 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2wrl h ASP 188 Cb 0.41 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2wrl h ASP 188 CO -0.78 0.23 0.01 0.78 -1.72 0.00 0.00 179.24 177.75 2wrl h ASN 189 N 0.40 0.25 -0.25 6.45 4.21 0.82 -1.98 115.58 125.49 2wrl h ASN 189 Ca 0.23 -0.29 -0.07 0.00 1.21 0.00 0.00 56.30 57.38 2wrl h ASN 189 Cb 0.40 -0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 2wrl h ASN 189 CO -0.06 0.49 -0.06 0.40 -1.29 0.00 0.00 177.43 176.91 2wrl h ILE 190 N 0.01 1.23 -0.28 2.81 1.08 0.37 -0.51 117.51 122.22 2wrl h ILE 190 Ca 0.04 -0.98 -0.05 0.00 -0.39 0.00 0.00 64.86 63.48 2wrl h ILE 190 Cb 0.35 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.10 2wrl h ILE 190 CO 0.01 0.33 -0.06 0.03 -0.69 0.00 0.00 178.15 177.77 2wrl h ARG 191 N 0.57 0.44 0.04 2.37 2.47 -0.59 -2.08 114.38 117.61 2wrl h ARG 191 Ca 0.11 -0.10 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2wrl h ARG 191 Cb 0.45 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2wrl h ARG 191 CO 0.02 0.52 -0.02 0.00 0.56 0.00 0.00 179.97 181.05 2wrl h ALA 192 N 1.52 -0.06 -0.17 0.04 0.00 -0.79 -2.29 119.26 117.52 2wrl h ALA 192 Ca 0.09 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.72 2wrl h ALA 192 Cb 0.37 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2wrl h ALA 192 CO 0.02 -0.11 0.19 0.35 0.00 0.00 0.00 179.25 179.70 2wrl h PHE 193 N -0.90 0.00 0.00 0.00 3.57 -1.09 0.43 116.94 118.95 2wrl h PHE 193 Ca -0.01 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2wrl h PHE 193 Cb 0.67 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2wrl h PHE 193 CO 0.17 0.00 -0.09 0.82 -2.23 0.00 0.00 178.31 176.97 2wrl h ILE 194 N 0.00 1.63 -0.41 1.41 1.08 -1.41 -3.01 117.51 116.79 2wrl h ILE 194 Ca 0.08 -1.97 0.09 0.00 -0.39 0.00 0.00 64.86 62.66 2wrl h ILE 194 Cb 0.46 2.94 -0.09 0.00 -3.07 0.00 0.00 36.82 37.06 2wrl h ILE 194 CO -0.00 0.52 -0.21 0.03 -0.69 0.00 0.00 178.15 177.80 2wrl h ARG 195 N -0.73 -0.13 -0.43 2.37 3.08 -0.35 -1.84 114.38 116.35 2wrl h ARG 195 Ca -0.01 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.09 2wrl h ARG 195 Cb 0.91 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.91 2wrl h ARG 195 CO 0.02 -0.08 -0.49 0.00 -1.07 0.00 0.00 179.97 178.34 2wrl h ALA 196 N 1.13 -0.69 0.13 0.04 0.00 -0.30 -0.85 119.26 118.74 2wrl h ALA 196 Ca 0.20 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2wrl h ALA 196 Cb 0.44 1.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 2wrl h ALA 196 CO -0.49 -0.94 -0.26 -0.07 0.00 0.00 0.00 179.25 177.49 2wrl h LEU 197 N -0.30 -0.76 -1.12 0.00 3.38 -1.28 -0.33 115.31 114.90 2wrl h LEU 197 Ca 0.07 0.07 0.23 0.00 0.09 0.00 0.00 57.88 58.35 2wrl h LEU 197 Cb 0.49 0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2wrl h LEU 197 CO -0.56 -0.30 1.05 -0.33 0.09 0.00 0.00 178.44 178.39 2wrl h GLU 198 N -0.43 0.00 0.00 1.13 5.08 -1.04 2.88 114.58 122.20 2wrl h GLU 198 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2wrl h GLU 198 Cb 0.40 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2wrl h GLU 198 CO -0.10 0.00 -0.30 0.00 -1.00 0.00 0.00 179.01 177.61 2wrl h ALA 199 N 0.65 0.91 -0.53 3.43 0.00 0.41 -3.19 119.26 120.94 2wrl h ALA 199 Ca 0.38 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2wrl h ALA 199 Cb 2.47 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 20.17 2wrl h ALA 199 CO -0.00 0.38 0.08 0.72 0.00 0.00 0.00 179.25 180.42 2wrl n HIS 200 N -3.32 1.83 -1.79 0.00 8.25 0.96 -4.97 115.22 116.19 2wrl n HIS 200 Ca 0.01 -0.96 -0.42 0.00 -0.26 0.00 0.00 57.72 56.09 2wrl n HIS 200 Cb 0.54 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 31.11 2wrl n HIS 200 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2wrl s LYS 201 N -2.88 4.01 0.55 -0.41 2.20 -1.19 -4.90 119.74 117.12 2wrl s LYS 201 Ca 0.51 2.36 -0.19 0.00 -0.36 0.00 0.00 55.97 58.28 2wrl s LYS 201 Cb 0.40 -4.13 -0.08 0.00 -1.51 0.00 0.00 37.83 32.52 2wrl s LYS 201 CO 0.12 -1.08 0.77 -2.30 -0.36 0.00 0.00 175.35 172.50 2wrl n PRO 202 N 7.58 0.79 0.13 4.03 -0.02 -1.26 -4.92 135.00 141.32 2wrl n PRO 202 Ca 0.20 0.30 -0.09 0.00 -2.02 0.00 0.00 63.50 61.90 2wrl n PRO 202 Cb 0.42 -1.92 -0.05 0.00 -0.02 0.00 0.00 33.50 31.94 2wrl n PRO 202 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2wrl h GLU 203 N 0.56 -0.44 -1.36 -0.52 4.39 -1.90 -2.17 114.58 113.13 2wrl h GLU 203 Ca -0.46 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2wrl h GLU 203 Cb 1.38 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 2wrl h GLU 203 CO 0.50 -0.30 0.00 0.41 -1.16 0.00 0.00 179.01 178.47 2wrl n GLY 204 N -1.26 1.82 3.50 -3.84 0.00 -1.26 -4.78 105.19 99.36 2wrl n GLY 204 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2wrl n GLY 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrl s ALA 205 N 0.19 3.12 0.11 4.61 0.00 -0.82 -5.03 121.76 123.95 2wrl s ALA 205 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.48 2wrl s ALA 205 Cb 0.00 -3.81 -0.04 0.00 0.00 0.00 0.00 23.12 19.27 2wrl s ALA 205 CO 0.00 -2.59 0.26 -1.59 0.00 0.00 0.00 175.76 171.85 2wrl s LYS 206 N 4.10 3.46 0.00 0.00 -2.85 -1.26 -4.95 119.74 118.24 2wrl s LYS 206 Ca 0.27 -0.46 0.00 0.00 -1.00 0.00 0.00 55.97 54.78 2wrl s LYS 206 Cb -0.14 -2.98 0.00 0.00 -2.06 0.00 0.00 37.83 32.65 2wrl s LYS 206 CO 0.15 0.55 0.00 0.41 0.10 0.00 0.00 175.35 176.56 2wrl n GLY 207 N -0.10 -0.43 3.63 0.59 0.00 -1.26 -4.64 105.19 102.98 2wrl n GLY 207 Ca -0.05 -1.77 -0.45 0.00 0.00 0.00 0.00 46.02 43.75 2wrl n GLY 207 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wrl n THR 208 N -0.44 0.56 0.17 2.61 -1.04 -1.26 -4.90 114.28 109.97 2wrl n THR 208 Ca 0.00 -0.24 -0.07 0.00 -2.04 0.00 0.00 64.05 61.71 2wrl n THR 208 Cb 0.00 -2.24 -0.03 0.00 -1.82 0.00 0.00 70.33 66.24 2wrl n THR 208 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2wrl h PHE 209 N 11.76 -0.40 -1.84 -1.42 3.57 -1.89 -3.03 116.94 123.70 2wrl h PHE 209 Ca -0.45 -0.01 -0.68 0.00 3.53 0.00 0.00 57.97 60.36 2wrl h PHE 209 Cb 1.25 0.13 -0.14 0.00 2.79 0.00 0.00 35.95 39.98 2wrl h PHE 209 CO 0.94 -0.25 1.28 -0.51 -2.23 0.00 0.00 178.31 177.53 2wrl s LEU 210 N -6.44 4.51 0.07 0.59 1.43 -1.26 0.16 118.68 117.73 2wrl s LEU 210 Ca -0.06 -2.14 -0.18 0.00 -1.03 0.00 0.00 54.13 50.72 2wrl s LEU 210 Cb 0.01 -2.47 -0.11 0.00 0.03 0.00 0.00 46.19 43.65 2wrl s LEU 210 CO 0.19 -1.13 1.40 -0.09 0.23 0.00 0.00 176.35 176.96 2wrl h ARG 211 N 8.59 0.49 -2.68 1.70 2.43 -1.47 -3.45 114.38 119.98 2wrl h ARG 211 Ca 0.24 -0.24 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 2wrl h ARG 211 Cb 0.97 -0.00 -0.29 0.00 -0.42 0.00 0.00 29.97 30.23 2wrl h ARG 211 CO 1.26 0.80 -0.42 -1.54 -1.51 0.00 0.00 179.97 178.56 2wrl s SER 212 N -6.23 -0.11 -0.09 -3.80 1.04 -0.95 -4.97 113.70 98.60 2wrl s SER 212 Ca -0.13 0.81 0.04 0.00 0.48 0.00 0.00 55.95 57.15 2wrl s SER 212 Cb 0.07 0.98 -0.00 0.00 0.10 0.00 0.00 66.02 67.16 2wrl s SER 212 CO 0.78 -0.22 -0.23 -0.69 0.98 0.00 0.00 173.24 173.86 2wrl s VAL 213 N 2.25 1.95 0.16 5.02 1.01 -1.26 -0.67 120.40 128.86 2wrl s VAL 213 Ca -0.03 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.07 2wrl s VAL 213 Cb -0.11 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 2wrl s VAL 213 CO -0.11 0.54 -0.17 -0.31 0.00 0.00 0.00 175.10 175.05 2wrl s TYR 214 N 0.28 1.71 -0.06 5.22 1.51 0.31 -1.24 117.35 125.08 2wrl s TYR 214 Ca -0.16 -0.51 0.04 0.00 -1.01 0.00 0.00 57.07 55.43 2wrl s TYR 214 Cb -0.17 -0.85 0.00 0.00 -0.11 0.00 0.00 41.96 40.83 2wrl s TYR 214 CO 0.07 0.29 -0.17 0.08 -1.11 0.00 0.00 175.55 174.72 2wrl s VAL 215 N -2.21 1.47 0.33 0.71 1.01 0.16 -1.52 120.40 120.34 2wrl s VAL 215 Ca 0.15 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 2wrl s VAL 215 Cb -0.05 -1.29 -0.00 0.00 0.00 0.00 0.00 36.38 35.04 2wrl s VAL 215 CO 0.06 0.43 0.44 0.28 0.00 0.00 0.00 175.10 176.30 2wrl s THR 216 N 0.33 0.00 0.52 3.92 -1.32 -0.86 0.12 115.64 118.36 2wrl s THR 216 Ca -0.11 -1.64 0.05 0.00 -1.21 0.00 0.00 61.69 58.78 2wrl s THR 216 Cb -0.15 -2.58 0.02 0.00 -1.51 0.00 0.00 72.50 68.28 2wrl s THR 216 CO 0.04 0.00 0.35 0.42 -2.21 0.00 0.00 174.62 173.22 2wrl s THR 217 N -3.23 1.73 0.03 5.08 -4.23 -1.26 -1.20 115.64 112.56 2wrl s THR 217 Ca 0.31 -1.54 -0.10 0.00 -1.18 0.00 0.00 61.69 59.18 2wrl s THR 217 Cb 0.00 -2.27 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 2wrl s THR 217 CO 0.20 0.00 1.17 0.74 -0.54 0.00 0.00 174.62 176.18 2wrl h THR 218 N 0.87 0.00 0.00 3.99 2.02 -1.10 -3.33 112.91 115.35 2wrl h THR 218 Ca -0.38 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.61 2wrl h THR 218 Cb 1.30 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2wrl h THR 218 CO 0.60 0.00 -1.47 0.23 0.37 0.00 0.00 175.52 175.25 2wrl n MET 219 N -3.42 0.62 -1.73 6.66 2.81 -1.26 -5.01 117.12 115.79 2wrl n MET 219 Ca -0.02 0.24 -0.29 0.00 -1.81 0.00 0.00 57.70 55.82 2wrl n MET 219 Cb 0.12 -1.81 0.16 0.00 -0.71 0.00 0.00 33.22 30.98 2wrl n MET 219 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2wrl s GLY 220 N -4.85 1.66 0.96 3.03 0.00 -1.25 -5.03 107.32 101.83 2wrl s GLY 220 Ca -0.03 -0.88 -0.12 0.00 0.00 0.00 0.00 44.72 43.68 2wrl s GLY 220 CO 0.81 -0.21 1.12 2.56 0.00 0.00 0.00 173.10 177.38 2wrl s PRO 221 N -5.62 0.78 0.35 2.90 0.04 -1.26 -4.31 135.00 127.87 2wrl s PRO 221 Ca 0.68 0.36 0.03 0.00 0.04 0.00 0.00 61.00 62.12 2wrl s PRO 221 Cb -0.09 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2wrl s PRO 221 CO 0.52 -2.46 0.52 -1.54 0.04 0.00 0.00 177.00 174.08 2wrl s SER 222 N -3.79 6.09 -0.21 6.66 1.04 -1.26 -4.34 113.70 117.89 2wrl s SER 222 Ca 0.65 0.15 -0.00 0.00 0.48 0.00 0.00 55.95 57.22 2wrl s SER 222 Cb -0.16 -1.64 0.05 0.00 0.10 0.00 0.00 66.02 64.37 2wrl s SER 222 CO 0.55 -0.39 -0.04 -0.69 0.98 0.00 0.00 173.24 173.65 2wrl s VAL 223 N -2.26 1.30 0.29 5.02 1.01 0.33 -4.94 120.40 121.15 2wrl s VAL 223 Ca 0.42 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 2wrl s VAL 223 Cb -0.10 -1.56 -0.10 0.00 0.00 0.00 0.00 36.38 34.62 2wrl s VAL 223 CO 0.34 -0.04 1.29 -0.60 0.00 0.00 0.00 175.10 176.08 2wrl s ARG 224 N 1.52 4.40 0.12 2.72 3.52 -1.26 0.39 118.95 130.35 2wrl s ARG 224 Ca -0.03 2.13 0.01 0.00 -0.13 0.00 0.00 55.73 57.71 2wrl s ARG 224 Cb -0.18 -3.12 -0.04 0.00 -1.56 0.00 0.00 34.95 30.06 2wrl s ARG 224 CO -0.07 -0.16 -0.03 0.96 -0.81 0.00 0.00 175.30 175.18 2wrl s ILE 225 N -0.80 0.61 -0.40 4.11 -5.25 -0.37 -2.87 121.20 116.23 2wrl s ILE 225 Ca 0.51 -1.94 -0.18 0.00 -0.99 0.00 0.00 60.65 58.05 2wrl s ILE 225 Cb -0.38 -1.83 0.01 0.00 2.95 0.00 0.00 42.46 43.21 2wrl s ILE 225 CO 0.47 -0.73 0.50 0.21 -1.79 0.00 0.00 174.94 173.60 2wrl s ASN 226 N -3.08 6.25 0.00 4.36 2.47 -0.66 -4.43 114.94 119.86 2wrl s ASN 226 Ca 0.16 -0.42 0.00 0.00 0.42 0.00 0.00 52.86 53.02 2wrl s ASN 226 Cb 0.06 -2.26 0.00 0.00 -1.45 0.00 0.00 41.25 37.60 2wrl s ASN 226 CO -0.02 -0.59 0.16 -0.81 -3.72 0.00 0.00 177.10 172.12 2wrl n PRO 227 N 5.78 0.00 -2.76 0.43 -0.04 -1.26 -2.62 135.00 134.53 2wrl n PRO 227 Ca -0.05 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.25 2wrl n PRO 227 Cb 0.48 -1.24 0.01 0.00 -0.04 0.00 0.00 33.50 32.71 2wrl n PRO 227 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2wrl n HIS 228 N -0.58 1.53 -1.85 0.54 8.25 -1.26 -5.03 115.22 116.81 2wrl n HIS 228 Ca 0.00 -3.14 0.00 0.00 -0.26 0.00 0.00 57.72 54.32 2wrl n HIS 228 Cb 0.00 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 30.77 2wrl n HIS 228 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85