#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wuy s THR 9 N 0.00 5.10 -0.11 0.52 -1.32 -1.26 -5.10 115.64 113.48 2wuy s THR 9 Ca 0.00 0.48 -0.01 0.00 -1.21 0.00 0.00 61.69 60.95 2wuy s THR 9 Cb 0.00 -3.65 -0.03 0.00 -1.51 0.00 0.00 72.50 67.32 2wuy s THR 9 CO 0.00 0.33 -0.05 0.27 -2.21 0.00 0.00 174.62 172.96 2wuy s ILE 10 N -1.35 3.80 0.23 5.08 -4.36 -1.26 -5.01 121.20 118.33 2wuy s ILE 10 Ca 0.31 -0.42 -0.30 0.00 -0.26 0.00 0.00 60.65 59.98 2wuy s ILE 10 Cb -0.14 -2.60 -0.09 0.00 1.25 0.00 0.00 42.46 40.88 2wuy s ILE 10 CO 0.17 0.56 0.94 -0.83 0.24 0.00 0.00 174.94 176.02 2wuy s GLY 11 N -0.32 3.11 0.01 6.27 0.00 -1.26 -4.77 107.32 110.35 2wuy s GLY 11 Ca 0.05 0.61 -0.01 0.00 0.00 0.00 0.00 44.72 45.38 2wuy s GLY 11 CO 0.02 1.21 -0.00 1.09 0.00 0.00 0.00 173.10 175.42 2wuy s ARG 12 N -1.07 0.18 0.11 2.90 1.70 -1.26 -5.04 118.95 116.47 2wuy s ARG 12 Ca 0.41 -0.30 0.08 0.00 -0.47 0.00 0.00 55.73 55.45 2wuy s ARG 12 Cb -0.26 0.07 -0.04 0.00 -0.57 0.00 0.00 34.95 34.15 2wuy s ARG 12 CO 0.32 -0.03 -0.19 0.95 -1.08 0.00 0.00 175.30 175.27 2wuy s THR 13 N -0.76 1.62 0.04 4.99 -4.23 -1.26 -2.47 115.64 113.57 2wuy s THR 13 Ca -0.08 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2wuy s THR 13 Cb -0.05 -1.52 -0.02 0.00 1.34 0.00 0.00 72.50 72.24 2wuy s THR 13 CO -0.00 -0.14 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.56 2wuy s TYR 14 N -1.35 0.60 -0.12 3.99 2.02 -0.81 -4.99 117.35 116.69 2wuy s TYR 14 Ca 0.07 -0.54 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 2wuy s TYR 14 Cb -0.09 -0.37 0.01 0.00 -0.40 0.00 0.00 41.96 41.12 2wuy s TYR 14 CO 0.04 -0.11 -0.17 0.08 -1.57 0.00 0.00 175.55 173.82 2wuy s VAL 15 N -1.55 1.63 -0.30 0.71 1.01 -1.26 -0.66 120.40 119.99 2wuy s VAL 15 Ca -0.10 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.20 2wuy s VAL 15 Cb -0.09 -1.48 0.08 0.00 0.00 0.00 0.00 36.38 34.89 2wuy s VAL 15 CO -0.00 0.47 -0.03 -0.31 0.00 0.00 0.00 175.10 175.22 2wuy s TYR 16 N 0.99 3.50 -1.27 5.22 2.02 0.61 -4.82 117.35 123.60 2wuy s TYR 16 Ca -0.06 -2.64 -0.20 0.00 -0.37 0.00 0.00 57.07 53.80 2wuy s TYR 16 Cb -0.15 -2.40 0.01 0.00 -0.40 0.00 0.00 41.96 39.02 2wuy s TYR 16 CO -0.02 -0.91 0.57 -3.47 -1.57 0.00 0.00 175.55 170.15 2wuy n ASP 17 N 4.35 -3.09 -0.62 2.29 4.64 -1.26 -0.58 116.55 122.27 2wuy n ASP 17 Ca -0.06 -1.16 -0.08 0.00 -1.38 0.00 0.00 54.79 52.11 2wuy n ASP 17 Cb 0.42 -2.43 -0.03 0.00 -1.04 0.00 0.00 41.12 38.04 2wuy n ASP 17 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 2wuy n ASN 18 N -2.56 -5.28 -4.61 1.67 3.02 -1.26 -4.98 115.26 101.25 2wuy n ASN 18 Ca -0.17 0.20 -0.37 0.00 -0.03 0.00 0.00 54.58 54.21 2wuy n ASN 18 Cb 0.61 -3.50 -0.10 0.00 -0.61 0.00 0.00 39.78 36.18 2wuy n ASN 18 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2wuy s LYS 19 N -2.50 3.98 -0.13 3.52 1.02 0.25 -5.04 119.74 120.85 2wuy s LYS 19 Ca 0.00 -0.31 -0.07 0.00 0.02 0.00 0.00 55.97 55.61 2wuy s LYS 19 Cb 0.00 -3.53 -0.04 0.00 -0.52 0.00 0.00 37.83 33.74 2wuy s LYS 19 CO 0.00 -0.03 0.13 0.71 -0.92 0.00 0.00 175.35 175.25 2wuy s TYR 20 N 1.29 3.56 0.09 3.18 2.02 -1.26 -0.29 117.35 125.95 2wuy s TYR 20 Ca 0.07 0.50 0.06 0.00 -0.37 0.00 0.00 57.07 57.33 2wuy s TYR 20 Cb -0.14 -1.96 -0.03 0.00 -0.40 0.00 0.00 41.96 39.43 2wuy s TYR 20 CO 0.06 0.68 -0.17 0.71 -1.57 0.00 0.00 175.55 175.27 2wuy s TYR 21 N -0.89 1.46 0.06 2.71 2.02 0.17 -0.00 117.35 122.88 2wuy s TYR 21 Ca 0.14 -0.46 0.03 0.00 -0.37 0.00 0.00 57.07 56.41 2wuy s TYR 21 Cb -0.12 -0.80 -0.03 0.00 -0.40 0.00 0.00 41.96 40.61 2wuy s TYR 21 CO 0.03 0.13 -0.10 0.21 -1.57 0.00 0.00 175.55 174.26 2wuy s LYS 22 N -1.96 0.66 0.15 -0.62 2.20 -0.02 -1.92 119.74 118.23 2wuy s LYS 22 Ca 0.03 -0.90 -0.31 0.00 -0.36 0.00 0.00 55.97 54.43 2wuy s LYS 22 Cb -0.09 -0.45 -0.09 0.00 -1.51 0.00 0.00 37.83 35.69 2wuy s LYS 22 CO 0.03 0.08 1.48 0.54 -0.36 0.00 0.00 175.35 177.12 2wuy s ASN 23 N -1.83 6.70 0.24 1.43 4.22 -1.03 -0.69 114.94 123.97 2wuy s ASN 23 Ca -0.05 2.49 -0.05 0.00 -2.14 0.00 0.00 52.86 53.12 2wuy s ASN 23 Cb -0.08 -2.59 0.41 0.00 1.28 0.00 0.00 41.25 40.27 2wuy s ASN 23 CO 0.00 -0.74 1.76 0.25 -2.04 0.00 0.00 177.10 176.34 2wuy h LEU 24 N 6.68 0.44 -1.33 3.54 5.85 -0.47 -2.60 115.31 127.42 2wuy h LEU 24 Ca -0.43 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.44 2wuy h LEU 24 Cb 1.21 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 2wuy h LEU 24 CO 0.88 0.22 0.50 1.23 -0.34 0.00 0.00 178.44 180.93 2wuy h GLY 25 N 0.58 1.03 2.00 3.75 0.00 -1.78 0.11 103.07 108.76 2wuy h GLY 25 Ca 0.39 -0.33 -0.13 0.00 0.00 0.00 0.00 47.33 47.27 2wuy h GLY 25 CO -0.32 0.24 -0.61 0.00 0.00 0.00 0.00 176.54 175.85 2wuy h ALA 26 N 1.59 0.63 -0.03 3.60 0.00 -1.78 -2.10 119.26 121.17 2wuy h ALA 26 Ca 0.33 -0.55 -0.20 0.00 0.00 0.00 0.00 54.91 54.48 2wuy h ALA 26 Cb 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2wuy h ALA 26 CO -0.11 0.76 -0.77 0.28 0.00 0.00 0.00 179.25 179.41 2wuy h VAL 27 N 0.00 1.35 0.16 0.00 2.07 -0.98 -3.33 116.25 115.52 2wuy h VAL 27 Ca -0.01 -2.10 -0.01 0.00 0.82 0.00 0.00 66.70 65.41 2wuy h VAL 27 Cb 1.42 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 33.60 2wuy h VAL 27 CO 0.08 0.63 -0.08 0.40 0.02 0.00 0.00 177.57 178.63 2wuy h ILE 28 N 0.17 0.94 -0.31 4.57 5.03 -0.85 -3.27 117.51 123.80 2wuy h ILE 28 Ca -0.09 -0.47 0.09 0.00 -0.12 0.00 0.00 64.86 64.27 2wuy h ILE 28 Cb 1.44 1.23 -0.01 0.00 -3.03 0.00 0.00 36.82 36.45 2wuy h ILE 28 CO 0.15 0.11 0.50 0.50 -0.68 0.00 0.00 178.15 178.73 2wuy h LYS 29 N -0.44 0.00 -0.15 2.37 3.64 -1.49 -3.36 116.57 117.14 2wuy h LYS 29 Ca -0.02 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2wuy h LYS 29 Cb 0.34 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2wuy h LYS 29 CO 0.04 0.00 0.34 0.27 -2.27 0.00 0.00 179.45 177.82 2wuy n ASN 30 N -3.34 0.00 -0.03 4.20 6.94 -1.24 -5.11 115.26 116.68 2wuy n ASN 30 Ca 0.05 0.19 -0.13 0.00 -0.02 0.00 0.00 54.58 54.67 2wuy n ASN 30 Cb 0.64 -0.04 -0.09 0.00 -2.36 0.00 0.00 39.78 37.93 2wuy n ASN 30 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wuy h ALA 31 N 0.07 0.09 -3.01 -2.53 0.00 -1.90 -3.53 119.26 108.45 2wuy h ALA 31 Ca 0.07 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 54.88 2wuy h ALA 31 Cb 0.75 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.43 2wuy h ALA 31 CO -0.00 -0.14 -0.95 -0.35 0.00 0.00 0.00 179.25 177.81 2wuy n PRO 49 N -4.76 -3.09 -0.07 0.00 -0.04 -1.26 -5.22 135.00 120.56 2wuy n PRO 49 Ca -0.07 2.46 0.11 0.00 -0.04 0.00 0.00 63.50 65.96 2wuy n PRO 49 Cb 0.27 -3.29 0.49 0.00 -0.04 0.00 0.00 33.50 30.93 2wuy n PRO 49 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2wuy h LEU 50 N -0.57 0.38 -1.50 1.53 4.07 -1.99 -2.53 115.31 114.70 2wuy h LEU 50 Ca -0.09 0.01 0.12 0.00 0.08 0.00 0.00 57.88 57.99 2wuy h LEU 50 Cb 0.99 -0.08 -0.05 0.00 1.08 0.00 0.00 40.66 42.61 2wuy h LEU 50 CO 0.03 0.24 0.48 -0.78 -1.08 0.00 0.00 178.44 177.33 2wuy h ASP 51 N 0.43 0.49 0.17 -0.43 3.58 -1.91 -2.29 116.42 116.45 2wuy h ASP 51 Ca 0.26 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2wuy h ASP 51 Cb 0.46 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2wuy h ASP 51 CO -0.07 0.28 0.00 0.59 -2.88 0.00 0.00 179.24 177.16 2wuy n ASN 52 N -4.49 0.00 -4.46 2.28 4.13 -0.95 -4.47 115.26 107.29 2wuy n ASN 52 Ca 0.13 0.01 -0.30 0.00 1.68 0.00 0.00 54.58 56.10 2wuy n ASN 52 Cb 0.41 -0.22 -0.12 0.00 -1.54 0.00 0.00 39.78 38.31 2wuy n ASN 52 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2wuy s TYR 53 N -2.44 2.52 0.09 3.10 2.02 -0.86 -5.04 117.35 116.73 2wuy s TYR 53 Ca 0.12 -0.28 0.06 0.00 -0.37 0.00 0.00 57.07 56.61 2wuy s TYR 53 Cb 0.08 -1.38 -0.04 0.00 -0.40 0.00 0.00 41.96 40.22 2wuy s TYR 53 CO 0.17 0.33 -0.09 -0.51 -1.57 0.00 0.00 175.55 173.88 2wuy s LEU 54 N -1.88 3.09 0.02 -1.29 1.43 -1.26 0.16 118.68 118.95 2wuy s LEU 54 Ca 0.16 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.00 2wuy s LEU 54 Cb -0.10 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 2wuy s LEU 54 CO 0.08 0.19 -0.24 0.54 0.23 0.00 0.00 176.35 177.15 2wuy s VAL 55 N -1.20 1.94 0.24 -1.59 0.11 0.13 -4.82 120.40 115.21 2wuy s VAL 55 Ca 0.21 -1.19 -0.20 0.00 -2.93 0.00 0.00 61.98 57.87 2wuy s VAL 55 Cb -0.11 -1.64 -0.08 0.00 -1.53 0.00 0.00 36.38 33.02 2wuy s VAL 55 CO 0.14 0.41 0.74 0.00 -3.33 0.00 0.00 175.10 173.05 2wuy s ALA 56 N -0.70 3.39 0.34 1.54 0.00 -1.26 -0.84 121.76 124.22 2wuy s ALA 56 Ca 0.10 0.18 -0.26 0.00 0.00 0.00 0.00 51.96 51.98 2wuy s ALA 56 Cb -0.09 -2.84 -0.09 0.00 0.00 0.00 0.00 23.12 20.09 2wuy s ALA 56 CO 0.01 0.32 1.02 -1.21 0.00 0.00 0.00 175.76 175.89 2wuy s GLU 57 N -2.08 4.44 0.11 0.00 2.02 0.99 -4.94 118.70 119.25 2wuy s GLU 57 Ca 0.45 1.52 -0.33 0.00 0.02 0.00 0.00 54.97 56.62 2wuy s GLU 57 Cb -0.16 -2.81 -0.12 0.00 0.10 0.00 0.00 34.13 31.14 2wuy s GLU 57 CO 0.21 0.10 1.71 -3.47 0.02 0.00 0.00 175.26 173.84 2wuy n ASP 58 N 0.49 3.50 -0.15 -0.19 4.64 -1.26 -4.76 116.55 118.83 2wuy n ASP 58 Ca 0.02 1.04 -0.00 0.00 -1.38 0.00 0.00 54.79 54.47 2wuy n ASP 58 Cb 0.49 -1.46 0.25 0.00 -1.04 0.00 0.00 41.12 39.36 2wuy n ASP 58 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2wuy h PRO 59 N 7.26 0.86 0.00 -0.67 0.11 -1.93 0.56 132.00 138.18 2wuy h PRO 59 Ca -0.46 -0.09 -0.07 0.00 0.11 0.00 0.00 66.00 65.49 2wuy h PRO 59 Cb 1.24 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2wuy h PRO 59 CO 0.92 0.64 -0.31 0.74 -0.21 0.00 0.00 178.00 179.78 2wuy h PHE 60 N 0.87 0.00 0.00 0.65 0.05 -1.94 -3.08 116.94 113.49 2wuy h PHE 60 Ca 0.22 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.01 2wuy h PHE 60 Cb 0.04 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.99 2wuy h PHE 60 CO 0.01 0.31 -1.33 1.28 -0.18 0.00 0.00 178.31 178.39 2wuy n LEU 61 N -3.30 0.49 0.00 1.54 4.77 -0.78 -4.91 117.00 114.81 2wuy n LEU 61 Ca 0.01 0.02 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 2wuy n LEU 61 Cb 0.56 -0.05 0.07 0.00 -2.33 0.00 0.00 43.42 41.67 2wuy n LEU 61 CO 0.36 -0.00 0.29 0.61 -1.33 0.00 0.00 177.39 177.32 2wuy n GLY 62 N 1.30 -1.11 3.56 -0.72 0.00 0.19 -4.96 105.19 103.45 2wuy n GLY 62 Ca -0.00 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 2wuy n GLY 62 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wuy n PRO 63 N -1.94 0.20 0.00 1.61 -0.02 -1.26 -4.86 135.00 128.73 2wuy n PRO 63 Ca 0.06 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2wuy n PRO 63 Cb 0.20 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2wuy n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wuy n GLY 64 N 1.16 -0.10 3.81 -1.23 0.00 -1.26 -4.94 105.19 102.64 2wuy n GLY 64 Ca 0.11 -1.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 2wuy n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wuy s LYS 65 N -3.70 3.71 -0.13 1.61 1.02 0.24 -4.78 119.74 117.70 2wuy s LYS 65 Ca 0.00 1.17 -0.05 0.00 0.02 0.00 0.00 55.97 57.11 2wuy s LYS 65 Cb 0.00 -2.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 2wuy s LYS 65 CO 0.00 -0.49 0.05 -0.80 -0.92 0.00 0.00 175.35 173.19 2wuy s ASN 66 N -2.58 5.59 -0.27 2.83 0.01 -1.26 -1.11 114.94 118.14 2wuy s ASN 66 Ca 0.63 0.17 -0.03 0.00 -0.71 0.00 0.00 52.86 52.91 2wuy s ASN 66 Cb -0.14 -1.80 0.09 0.00 0.41 0.00 0.00 41.25 39.81 2wuy s ASN 66 CO 0.28 0.29 0.11 -1.58 -1.51 0.00 0.00 177.10 174.69 2wuy s GLN 67 N -0.34 0.34 -0.32 -0.60 0.74 -0.47 -4.97 119.66 114.04 2wuy s GLN 67 Ca 0.08 -0.60 -0.18 0.00 0.05 0.00 0.00 55.36 54.72 2wuy s GLN 67 Cb -0.12 -1.52 -0.01 0.00 1.10 0.00 0.00 33.01 32.46 2wuy s GLN 67 CO 0.02 -0.94 0.52 0.21 -0.55 0.00 0.00 175.29 174.55 2wuy s LYS 68 N 1.97 3.78 -0.46 1.67 2.20 -1.26 -0.80 119.74 126.83 2wuy s LYS 68 Ca 0.07 0.02 -0.09 0.00 -0.36 0.00 0.00 55.97 55.62 2wuy s LYS 68 Cb -0.16 -3.76 0.12 0.00 -1.51 0.00 0.00 37.83 32.52 2wuy s LYS 68 CO -0.28 -0.55 0.33 -0.51 -0.36 0.00 0.00 175.35 173.97 2wuy s LEU 69 N 2.40 5.62 -0.15 5.43 1.43 0.12 -4.96 118.68 128.57 2wuy s LEU 69 Ca 0.20 -1.90 -0.29 0.00 -1.03 0.00 0.00 54.13 51.11 2wuy s LEU 69 Cb -0.15 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 2wuy s LEU 69 CO 0.12 -0.67 1.22 -0.89 0.23 0.00 0.00 176.35 176.36 2wuy s THR 70 N 1.35 4.34 -0.21 5.49 2.01 -1.26 -0.73 115.64 126.62 2wuy s THR 70 Ca 0.06 1.62 -0.21 0.00 0.31 0.00 0.00 61.69 63.47 2wuy s THR 70 Cb -0.26 -4.05 -0.19 0.00 0.01 0.00 0.00 72.50 68.02 2wuy s THR 70 CO -0.01 -0.11 0.20 -0.07 -0.69 0.00 0.00 174.62 173.94 2wuy h LEU 71 N 9.36 0.00 -7.77 4.42 3.38 -1.14 -3.49 115.31 120.07 2wuy h LEU 71 Ca -0.27 -0.50 0.15 0.00 0.09 0.00 0.00 57.88 57.35 2wuy h LEU 71 Cb 1.11 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 2wuy h LEU 71 CO 0.95 1.49 0.41 0.72 0.09 0.00 0.00 178.44 182.11 2wuy s PHE 72 N -2.36 -0.14 0.22 1.13 -0.71 -1.15 -5.02 117.98 109.94 2wuy s PHE 72 Ca -0.29 -0.21 0.10 0.00 -1.04 0.00 0.00 56.93 55.49 2wuy s PHE 72 Cb 0.06 0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 42.49 2wuy s PHE 72 CO 0.59 -0.95 -0.14 0.15 -1.34 0.00 0.00 175.22 173.53 2wuy s LYS 73 N -3.44 1.89 -0.26 1.99 -0.14 -1.26 -1.22 119.74 117.30 2wuy s LYS 73 Ca 0.12 -1.45 -0.23 0.00 -1.36 0.00 0.00 55.97 53.04 2wuy s LYS 73 Cb -0.03 -2.01 0.07 0.00 -1.68 0.00 0.00 37.83 34.19 2wuy s LYS 73 CO 0.04 0.39 0.70 -2.00 -0.76 0.00 0.00 175.35 173.72 2wuy s GLU 74 N -3.06 0.80 -0.18 1.68 2.12 -0.26 -4.98 118.70 114.82 2wuy s GLU 74 Ca 0.26 0.99 -0.07 0.00 0.36 0.00 0.00 54.97 56.51 2wuy s GLU 74 Cb -0.07 0.37 -0.04 0.00 0.26 0.00 0.00 34.13 34.65 2wuy s GLU 74 CO 0.15 -0.10 0.07 0.42 -0.54 0.00 0.00 175.26 175.25 2wuy s ILE 75 N 0.50 4.84 0.00 -3.70 1.01 -1.26 0.30 121.20 122.89 2wuy s ILE 75 Ca -0.01 -0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.66 2wuy s ILE 75 Cb -0.05 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.23 2wuy s ILE 75 CO -0.01 0.47 -0.12 -0.13 0.00 0.00 0.00 174.94 175.15 2wuy s ARG 76 N 0.26 0.96 -0.30 2.79 1.81 -0.17 -4.98 118.95 119.33 2wuy s ARG 76 Ca 0.04 -0.51 -0.06 0.00 -1.72 0.00 0.00 55.73 53.48 2wuy s ARG 76 Cb -0.12 -0.93 0.02 0.00 -0.45 0.00 0.00 34.95 33.46 2wuy s ARG 76 CO 0.00 0.25 0.07 1.21 -0.68 0.00 0.00 175.30 176.15 2wuy s ASN 77 N -0.50 5.07 -0.18 0.23 3.84 -1.26 -0.27 114.94 121.88 2wuy s ASN 77 Ca 0.04 -0.81 -0.04 0.00 0.21 0.00 0.00 52.86 52.25 2wuy s ASN 77 Cb -0.05 -1.85 -0.03 0.00 -0.55 0.00 0.00 41.25 38.77 2wuy s ASN 77 CO -0.00 -0.21 -0.02 0.68 -2.79 0.00 0.00 177.10 174.76 2wuy s VAL 78 N 1.46 3.91 0.46 -5.21 -7.23 -0.01 -4.92 120.40 108.86 2wuy s VAL 78 Ca 0.01 -0.34 -0.19 0.00 -1.81 0.00 0.00 61.98 59.66 2wuy s VAL 78 Cb -0.18 -2.74 -0.10 0.00 0.56 0.00 0.00 36.38 33.93 2wuy s VAL 78 CO 0.02 0.46 0.95 -0.54 -0.31 0.00 0.00 175.10 175.68 2wuy s LYS 79 N 0.69 4.09 0.50 4.82 -0.14 -1.26 -1.29 119.74 127.15 2wuy s LYS 79 Ca -0.01 1.02 -0.22 0.00 -1.36 0.00 0.00 55.97 55.40 2wuy s LYS 79 Cb -0.14 -2.17 -0.08 0.00 -1.68 0.00 0.00 37.83 33.76 2wuy s LYS 79 CO 0.02 -0.13 1.06 -2.30 -0.76 0.00 0.00 175.35 173.25 2wuy n PRO 80 N -1.05 1.30 -1.27 -1.68 -0.02 -1.26 -2.01 135.00 129.02 2wuy n PRO 80 Ca 0.07 0.48 -0.09 0.00 -2.02 0.00 0.00 63.50 61.93 2wuy n PRO 80 Cb 0.54 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2wuy n PRO 80 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2wuy n ASP 81 N -0.17 -5.15 -4.38 2.55 2.03 -1.26 -4.98 116.55 105.19 2wuy n ASP 81 Ca 0.11 0.23 -0.19 0.00 0.52 0.00 0.00 54.79 55.45 2wuy n ASP 81 Cb 0.43 -3.46 -0.10 0.00 -0.72 0.00 0.00 41.12 37.27 2wuy n ASP 81 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2wuy s THR 82 N -2.00 1.05 0.01 5.18 -4.23 -0.85 -1.29 115.64 113.51 2wuy s THR 82 Ca 0.00 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 2wuy s THR 82 Cb 0.00 -2.59 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 2wuy s THR 82 CO 0.00 -0.13 -0.01 -0.04 -0.54 0.00 0.00 174.62 173.89 2wuy s MET 83 N -3.90 0.13 0.05 3.99 -1.94 -0.17 -4.28 119.30 113.18 2wuy s MET 83 Ca 0.34 -0.17 0.02 0.00 -1.71 0.00 0.00 55.69 54.17 2wuy s MET 83 Cb 0.07 -0.03 -0.04 0.00 2.01 0.00 0.00 34.83 36.84 2wuy s MET 83 CO 0.13 0.00 0.04 0.15 -0.01 0.00 0.00 175.02 175.33 2wuy s LYS 84 N -0.38 2.80 0.13 2.03 1.02 -0.28 -1.24 119.74 123.83 2wuy s LYS 84 Ca -0.03 -0.67 -0.31 0.00 0.02 0.00 0.00 55.97 54.97 2wuy s LYS 84 Cb -0.03 -2.68 -0.09 0.00 -0.52 0.00 0.00 37.83 34.51 2wuy s LYS 84 CO -0.00 0.59 1.49 -1.17 -0.92 0.00 0.00 175.35 175.34 2wuy s LEU 85 N -2.03 4.37 -0.13 3.17 2.96 0.14 -1.88 118.68 125.28 2wuy s LEU 85 Ca 0.25 2.47 -0.16 0.00 -0.22 0.00 0.00 54.13 56.47 2wuy s LEU 85 Cb -0.12 -3.59 -0.25 0.00 0.50 0.00 0.00 46.19 42.73 2wuy s LEU 85 CO 0.16 -0.75 0.46 0.58 -1.32 0.00 0.00 176.35 175.48 2wuy h VAL 86 N 4.20 0.96 -3.37 1.68 2.07 -1.31 -3.48 116.25 116.99 2wuy h VAL 86 Ca -0.42 -2.34 -0.24 0.00 0.82 0.00 0.00 66.70 64.52 2wuy h VAL 86 Cb 1.21 2.59 -0.31 0.00 -1.52 0.00 0.00 31.29 33.26 2wuy h VAL 86 CO 0.89 0.65 -0.62 0.54 0.02 0.00 0.00 177.57 179.06 2wuy s VAL 87 N -2.46 -0.04 -0.17 2.57 0.11 -1.26 -5.04 120.40 114.11 2wuy s VAL 87 Ca -0.22 0.13 0.14 0.00 -2.93 0.00 0.00 61.98 59.10 2wuy s VAL 87 Cb 0.05 -0.19 0.43 0.00 -1.53 0.00 0.00 36.38 35.14 2wuy s VAL 87 CO 0.73 0.05 1.20 0.61 -3.33 0.00 0.00 175.10 174.36 2wuy n GLY 88 N 3.83 4.21 3.70 6.54 0.00 -1.26 -4.37 105.19 117.85 2wuy n GLY 88 Ca -0.22 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 2wuy n GLY 88 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2wuy n TRP 89 N -0.69 1.99 -1.52 1.61 2.14 -1.26 -5.00 117.44 114.71 2wuy n TRP 89 Ca 0.18 0.46 -0.31 0.00 2.07 0.00 0.00 57.50 59.90 2wuy n TRP 89 Cb 0.83 -2.33 0.06 0.00 -0.81 0.00 0.00 31.31 29.06 2wuy n TRP 89 CO 0.00 0.00 0.00 0.15 2.07 0.00 0.00 177.69 179.91 2wuy s LYS 90 N -2.54 2.72 0.17 -2.67 1.02 -1.26 -4.79 119.74 112.39 2wuy s LYS 90 Ca 0.67 1.09 -0.15 0.00 0.02 0.00 0.00 55.97 57.60 2wuy s LYS 90 Cb -0.46 -1.96 0.13 0.00 -0.52 0.00 0.00 37.83 35.03 2wuy s LYS 90 CO 0.53 -1.28 1.69 0.78 -0.92 0.00 0.00 175.35 176.15 2wuy h GLY 91 N -0.70 0.41 0.81 -3.33 0.00 -1.89 0.41 103.07 98.78 2wuy h GLY 91 Ca -0.44 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.00 2wuy h GLY 91 CO 0.55 -0.12 0.49 1.70 0.00 0.00 0.00 176.54 179.15 2wuy h LYS 92 N 0.09 0.90 -0.42 4.80 3.64 -1.97 -1.25 116.57 122.35 2wuy h LYS 92 Ca 0.21 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 2wuy h LYS 92 Cb 0.31 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2wuy h LYS 92 CO -0.37 0.60 -0.18 1.49 -2.27 0.00 0.00 179.45 178.71 2wuy h GLU 93 N 0.93 0.87 -0.11 1.90 4.57 -1.75 0.15 114.58 121.13 2wuy h GLU 93 Ca 0.33 -0.37 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2wuy h GLU 93 Cb 0.08 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2wuy h GLU 93 CO -0.14 1.01 0.03 0.35 -1.18 0.00 0.00 179.01 179.09 2wuy h PHE 94 N 0.69 0.06 -0.70 0.92 3.04 -0.49 0.35 116.94 120.81 2wuy h PHE 94 Ca 0.10 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.99 2wuy h PHE 94 Cb 0.74 -0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.21 2wuy h PHE 94 CO 0.06 0.03 0.17 1.88 -2.02 0.00 0.00 178.31 178.43 2wuy h TYR 95 N 0.09 1.16 0.21 0.41 -1.99 -1.15 -0.47 116.97 115.23 2wuy h TYR 95 Ca 0.05 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.64 2wuy h TYR 95 Cb 0.03 -0.33 -0.00 0.00 2.00 0.00 0.00 36.73 38.43 2wuy h TYR 95 CO -0.11 0.94 -0.13 -0.09 -0.00 0.00 0.00 178.16 178.77 2wuy h ARG 96 N 1.06 -0.32 -0.53 4.88 2.43 -0.37 -0.33 114.38 121.19 2wuy h ARG 96 Ca 0.22 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2wuy h ARG 96 Cb 0.36 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 2wuy h ARG 96 CO 0.00 -0.22 0.34 1.49 -1.51 0.00 0.00 179.97 180.08 2wuy h GLU 97 N -0.34 0.70 0.36 0.20 4.57 -0.81 0.02 114.58 119.29 2wuy h GLU 97 Ca -0.02 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2wuy h GLU 97 Cb 0.28 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2wuy h GLU 97 CO 0.01 0.47 -0.17 1.15 -1.18 0.00 0.00 179.01 179.29 2wuy h THR 98 N 0.71 0.65 -0.06 0.32 2.02 -0.94 -1.17 112.91 114.44 2wuy h THR 98 Ca 0.19 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.11 2wuy h THR 98 Cb -0.07 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 2wuy h THR 98 CO -0.04 0.05 0.01 -0.25 0.37 0.00 0.00 175.52 175.67 2wuy h TRP 99 N -0.64 0.03 0.07 3.16 7.01 -0.99 -1.08 115.95 123.50 2wuy h TRP 99 Ca -0.05 0.00 0.01 0.00 2.11 0.00 0.00 58.89 60.96 2wuy h TRP 99 Cb 0.46 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 2wuy h TRP 99 CO -0.01 0.01 -0.09 1.15 -2.79 0.00 0.00 178.44 176.71 2wuy h THR 100 N 0.04 0.80 -0.64 2.65 2.02 -0.97 0.66 112.91 117.47 2wuy h THR 100 Ca 0.02 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 2wuy h THR 100 Cb 0.02 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2wuy h THR 100 CO -0.03 0.00 0.19 0.03 0.37 0.00 0.00 175.52 176.08 2wuy h ARG 101 N -0.18 0.99 0.08 6.66 2.47 -1.19 0.86 114.38 124.07 2wuy h ARG 101 Ca 0.01 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.51 2wuy h ARG 101 Cb 0.19 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 2wuy h ARG 101 CO -0.04 0.88 -0.04 0.35 0.56 0.00 0.00 179.97 181.68 2wuy h PHE 102 N 0.92 -0.10 -0.54 3.04 3.04 -1.04 -1.54 116.94 120.72 2wuy h PHE 102 Ca 0.20 -0.00 -0.09 0.00 3.98 0.00 0.00 57.97 62.06 2wuy h PHE 102 Cb 0.30 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.83 2wuy h PHE 102 CO 0.02 0.16 -0.02 0.52 -2.02 0.00 0.00 178.31 176.97 2wuy h MET 103 N -0.36 0.96 -0.67 1.11 2.86 -0.83 0.04 114.93 118.05 2wuy h MET 103 Ca -0.01 -0.32 0.05 0.00 -2.06 0.00 0.00 59.70 57.37 2wuy h MET 103 Cb 0.31 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 2wuy h MET 103 CO 0.02 0.98 0.38 1.49 1.06 0.00 0.00 176.91 180.84 2wuy h GLU 104 N 0.84 0.69 -0.11 1.72 4.81 -0.82 -0.95 114.58 120.77 2wuy h GLU 104 Ca 0.15 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2wuy h GLU 104 Cb 0.56 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2wuy h GLU 104 CO 0.03 0.46 -0.13 0.22 -0.73 0.00 0.00 179.01 178.86 2wuy h ASP 105 N 0.71 0.30 -0.02 1.04 3.58 -1.06 -3.38 116.42 117.59 2wuy h ASP 105 Ca 0.29 -0.50 -0.08 0.00 0.42 0.00 0.00 57.03 57.16 2wuy h ASP 105 Cb 0.16 -0.08 0.01 0.00 1.72 0.00 0.00 39.33 41.13 2wuy h ASP 105 CO -0.17 0.74 -0.31 0.28 -2.88 0.00 0.00 179.24 176.90 2wuy h SER 106 N -0.14 0.30 -1.60 2.28 0.02 -0.73 -3.47 113.55 110.22 2wuy h SER 106 Ca 0.01 -0.74 -0.70 0.00 -0.84 0.00 0.00 61.79 59.53 2wuy h SER 106 Cb 0.66 -0.09 0.05 0.00 0.14 0.00 0.00 62.40 63.16 2wuy h SER 106 CO 0.03 1.00 0.50 0.49 -1.14 0.00 0.00 176.83 177.71 2wuy n PHE 107 N -4.45 1.54 -2.85 3.45 3.72 -0.38 -3.90 117.46 114.59 2wuy n PHE 107 Ca -0.09 0.66 -0.39 0.00 -0.05 0.00 0.00 57.45 57.57 2wuy n PHE 107 Cb 0.52 -2.33 -0.06 0.00 -0.94 0.00 0.00 39.48 36.67 2wuy n PHE 107 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2wuy s PRO 108 N 1.01 4.68 -0.69 -1.08 0.05 -1.26 -5.02 135.00 132.70 2wuy s PRO 108 Ca 0.88 1.32 -0.21 0.00 0.05 0.00 0.00 61.00 63.04 2wuy s PRO 108 Cb -1.00 -3.16 0.09 0.00 0.05 0.00 0.00 34.50 30.47 2wuy s PRO 108 CO 0.51 0.49 0.93 0.42 0.05 0.00 0.00 177.00 179.40 2wuy s ILE 109 N -1.27 4.51 -0.16 0.56 1.01 -1.25 -4.90 121.20 119.70 2wuy s ILE 109 Ca 0.41 -0.71 0.16 0.00 0.00 0.00 0.00 60.65 60.51 2wuy s ILE 109 Cb -0.23 -4.65 0.04 0.00 0.01 0.00 0.00 42.46 37.62 2wuy s ILE 109 CO 0.28 -1.39 1.35 -0.37 0.00 0.00 0.00 174.94 174.81 2wuy h VAL 110 N 5.93 0.77 -2.81 2.92 -1.51 -2.00 -3.47 116.25 116.09 2wuy h VAL 110 Ca -0.22 -2.13 -0.48 0.00 -1.23 0.00 0.00 66.70 62.65 2wuy h VAL 110 Cb 1.07 2.34 -0.15 0.00 -2.13 0.00 0.00 31.29 32.42 2wuy h VAL 110 CO 1.15 0.44 -0.74 0.20 -1.23 0.00 0.00 177.57 177.39 2wuy s ASN 111 N -6.33 2.72 0.26 4.19 0.01 -1.26 -5.08 114.94 109.46 2wuy s ASN 111 Ca 0.03 -1.01 -0.31 0.00 -0.71 0.00 0.00 52.86 50.86 2wuy s ASN 111 Cb 0.08 -0.16 -0.12 0.00 0.41 0.00 0.00 41.25 41.46 2wuy s ASN 111 CO 0.75 -0.13 1.65 -1.81 -1.51 0.00 0.00 177.10 176.05 2wuy s ASP 112 N -3.30 6.37 0.11 -1.22 1.01 -1.25 -4.85 116.67 113.54 2wuy s ASP 112 Ca 0.23 2.93 -0.10 0.00 0.71 0.00 0.00 52.55 56.32 2wuy s ASP 112 Cb -0.02 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2wuy s ASP 112 CO 0.08 -0.94 0.24 0.00 0.21 0.00 0.00 175.17 174.76 2wuy s GLN 113 N 0.12 0.93 -0.08 8.23 -2.07 -1.26 -0.64 119.66 124.89 2wuy s GLN 113 Ca 0.68 -0.96 0.02 0.00 -1.82 0.00 0.00 55.36 53.28 2wuy s GLN 113 Cb -0.49 0.37 0.01 0.00 -1.09 0.00 0.00 33.01 31.81 2wuy s GLN 113 CO 0.42 -0.32 -0.15 -2.00 -1.32 0.00 0.00 175.29 171.93 2wuy s GLU 114 N -3.87 2.02 -0.49 9.60 2.12 -0.10 -4.98 118.70 122.99 2wuy s GLU 114 Ca 0.07 -0.52 -0.28 0.00 0.36 0.00 0.00 54.97 54.61 2wuy s GLU 114 Cb 0.04 -1.63 0.03 0.00 0.26 0.00 0.00 34.13 32.83 2wuy s GLU 114 CO -0.09 0.04 1.07 0.08 -0.54 0.00 0.00 175.26 175.82 2wuy s VAL 115 N 0.66 4.27 0.12 3.70 1.01 -1.26 -1.03 120.40 127.87 2wuy s VAL 115 Ca -0.14 0.98 -0.12 0.00 0.00 0.00 0.00 61.98 62.69 2wuy s VAL 115 Cb -0.16 -4.57 -0.09 0.00 0.00 0.00 0.00 36.38 31.56 2wuy s VAL 115 CO 0.04 -1.01 1.40 0.24 0.00 0.00 0.00 175.10 175.77 2wuy h MET 116 N 9.23 0.85 -2.24 2.72 0.00 -1.00 -3.48 114.93 121.02 2wuy h MET 116 Ca -0.24 -0.53 0.17 0.00 0.00 0.00 0.00 59.70 59.10 2wuy h MET 116 Cb 1.07 0.06 -0.11 0.00 0.00 0.00 0.00 31.60 32.62 2wuy h MET 116 CO 1.10 1.17 0.52 0.34 0.00 0.00 0.00 176.91 180.04 2wuy s ASP 117 N -6.89 -0.23 -0.05 1.22 -1.08 -1.22 -4.94 116.67 103.49 2wuy s ASP 117 Ca -0.11 -0.25 0.01 0.00 -0.52 0.00 0.00 52.55 51.69 2wuy s ASP 117 Cb 0.10 0.43 0.02 0.00 -1.46 0.00 0.00 42.92 42.00 2wuy s ASP 117 CO 0.88 -0.76 -0.06 -0.69 0.52 0.00 0.00 175.17 175.07 2wuy s VAL 118 N -3.16 0.63 -0.13 1.11 1.01 -1.26 -1.30 120.40 117.30 2wuy s VAL 118 Ca 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 2wuy s VAL 118 Cb -0.01 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.72 2wuy s VAL 118 CO -0.02 0.24 -0.07 -0.36 0.00 0.00 0.00 175.10 174.89 2wuy s PHE 119 N 0.82 2.94 -0.27 5.22 0.08 0.28 -0.28 117.98 126.77 2wuy s PHE 119 Ca -0.12 -0.34 -0.24 0.00 0.12 0.00 0.00 56.93 56.35 2wuy s PHE 119 Cb -0.14 -1.88 -0.00 0.00 -0.57 0.00 0.00 43.02 40.42 2wuy s PHE 119 CO 0.01 -0.02 0.81 -1.17 -0.10 0.00 0.00 175.22 174.75 2wuy s LEU 120 N 0.15 4.07 -0.16 -0.37 1.98 0.39 -0.62 118.68 124.12 2wuy s LEU 120 Ca -0.03 0.89 -0.03 0.00 -2.89 0.00 0.00 54.13 52.06 2wuy s LEU 120 Cb -0.14 -3.14 -0.02 0.00 0.66 0.00 0.00 46.19 43.54 2wuy s LEU 120 CO 0.03 -0.55 -0.05 -0.69 -1.89 0.00 0.00 176.35 173.20 2wuy s VAL 121 N 2.89 3.74 -0.24 1.68 1.01 0.47 -0.69 120.40 129.26 2wuy s VAL 121 Ca 0.34 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.89 2wuy s VAL 121 Cb -0.15 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.61 2wuy s VAL 121 CO 0.09 0.49 -0.05 -0.69 0.00 0.00 0.00 175.10 174.94 2wuy s VAL 122 N 0.47 3.04 -0.18 2.92 1.01 0.59 -1.07 120.40 127.17 2wuy s VAL 122 Ca -0.04 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 60.99 2wuy s VAL 122 Cb -0.14 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 2wuy s VAL 122 CO 0.03 0.26 0.10 0.21 0.00 0.00 0.00 175.10 175.70 2wuy s ASN 123 N 1.37 5.95 0.03 3.32 3.84 -0.11 -0.79 114.94 128.55 2wuy s ASN 123 Ca 0.02 0.19 0.05 0.00 0.21 0.00 0.00 52.86 53.33 2wuy s ASN 123 Cb -0.16 -2.01 -0.02 0.00 -0.55 0.00 0.00 41.25 38.51 2wuy s ASN 123 CO -0.04 0.21 -0.14 0.00 -2.79 0.00 0.00 177.10 174.34 2wuy s MET 124 N 0.15 0.96 -0.00 0.43 0.23 -0.55 -0.47 119.30 120.04 2wuy s MET 124 Ca 0.07 -0.73 -0.15 0.00 -1.03 0.00 0.00 55.69 53.85 2wuy s MET 124 Cb -0.12 -0.97 0.02 0.00 -1.53 0.00 0.00 34.83 32.24 2wuy s MET 124 CO -0.00 0.24 0.32 -0.98 -2.03 0.00 0.00 175.02 172.57 2wuy s ARG 125 N -1.04 0.70 0.55 3.16 1.70 -0.73 -4.79 118.95 118.51 2wuy s ARG 125 Ca 0.02 -0.24 -0.18 0.00 -0.47 0.00 0.00 55.73 54.86 2wuy s ARG 125 Cb -0.08 0.31 -0.05 0.00 -0.57 0.00 0.00 34.95 34.56 2wuy s ARG 125 CO 0.01 -0.20 1.09 -2.14 -1.08 0.00 0.00 175.30 172.98 2wuy s PRO 126 N -1.55 3.37 0.11 3.89 0.02 -1.26 -0.51 135.00 139.07 2wuy s PRO 126 Ca -0.12 1.46 0.25 0.00 0.02 0.00 0.00 61.00 62.60 2wuy s PRO 126 Cb -0.04 -2.02 0.44 0.00 0.02 0.00 0.00 34.50 32.90 2wuy s PRO 126 CO 0.03 -0.80 1.40 0.25 -0.33 0.00 0.00 177.00 177.54 2wuy n THR 127 N -1.50 0.32 -4.68 0.99 -2.24 -1.03 -4.74 114.28 101.40 2wuy n THR 127 Ca 0.10 -0.23 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2wuy n THR 127 Cb 0.52 -0.14 -0.14 0.00 -2.10 0.00 0.00 70.33 68.47 2wuy n THR 127 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2wuy s ARG 128 N -3.13 1.63 0.87 -0.78 1.81 -1.26 -5.11 118.95 112.98 2wuy s ARG 128 Ca 0.07 -1.22 -0.12 0.00 -1.72 0.00 0.00 55.73 52.75 2wuy s ARG 128 Cb 0.14 -1.95 0.15 0.00 -0.45 0.00 0.00 34.95 32.84 2wuy s ARG 128 CO 0.70 0.49 1.22 -1.25 -0.68 0.00 0.00 175.30 175.78 2wuy s PRO 129 N -1.60 1.22 -1.77 3.54 0.04 -1.26 -4.40 135.00 130.76 2wuy s PRO 129 Ca 0.13 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.81 2wuy s PRO 129 Cb -0.10 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2wuy s PRO 129 CO 0.04 -2.00 0.00 0.09 0.04 0.00 0.00 177.00 175.17 2wuy n ASN 130 N -3.47 -5.72 -4.69 6.66 4.13 -1.26 -5.00 115.26 105.91 2wuy n ASN 130 Ca 0.13 0.04 -0.35 0.00 1.68 0.00 0.00 54.58 56.08 2wuy n ASN 130 Cb 0.60 -4.77 -0.09 0.00 -1.54 0.00 0.00 39.78 33.98 2wuy n ASN 130 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2wuy s ARG 131 N -4.86 3.18 -0.22 3.52 1.81 -1.26 -5.09 118.95 116.03 2wuy s ARG 131 Ca 0.00 -0.37 -0.02 0.00 -1.72 0.00 0.00 55.73 53.63 2wuy s ARG 131 Cb 0.00 -2.90 0.07 0.00 -0.45 0.00 0.00 34.95 31.67 2wuy s ARG 131 CO 0.00 0.65 0.02 0.00 -0.68 0.00 0.00 175.30 175.29 2wuy s TYR 133 N 1.70 -0.13 0.09 0.00 -0.85 -1.26 -4.99 117.35 111.92 2wuy s TYR 133 Ca -0.00 -0.29 0.04 0.00 -0.52 0.00 0.00 57.07 56.30 2wuy s TYR 133 Cb -0.18 0.59 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 2wuy s TYR 133 CO -0.10 -1.14 0.05 0.15 -1.52 0.00 0.00 175.55 172.99 2wuy s LYS 134 N -3.92 2.74 0.24 -3.49 1.02 -1.26 -4.98 119.74 110.09 2wuy s LYS 134 Ca 0.12 -0.77 -0.13 0.00 0.02 0.00 0.00 55.97 55.20 2wuy s LYS 134 Cb -0.04 -2.64 -0.08 0.00 -0.52 0.00 0.00 37.83 34.55 2wuy s LYS 134 CO 0.05 0.55 0.62 -0.06 -0.92 0.00 0.00 175.35 175.59 2wuy s PHE 135 N -1.40 3.46 0.07 3.18 0.08 -1.26 -1.67 117.98 120.44 2wuy s PHE 135 Ca 0.28 1.07 0.06 0.00 0.12 0.00 0.00 56.93 58.46 2wuy s PHE 135 Cb -0.12 -2.40 -0.03 0.00 -0.57 0.00 0.00 43.02 39.90 2wuy s PHE 135 CO 0.21 0.25 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.90 2wuy s LEU 136 N -2.62 2.24 0.07 -0.37 1.43 -0.19 -1.48 118.68 117.76 2wuy s LEU 136 Ca 0.47 -0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 52.89 2wuy s LEU 136 Cb -0.12 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.43 2wuy s LEU 136 CO 0.20 0.01 0.22 0.00 0.23 0.00 0.00 176.35 177.01 2wuy s ALA 137 N -1.08 -0.38 -0.14 4.21 0.00 -0.28 -0.92 121.76 123.17 2wuy s ALA 137 Ca 0.02 -0.39 -0.18 0.00 0.00 0.00 0.00 51.96 51.41 2wuy s ALA 137 Cb -0.09 0.41 0.05 0.00 0.00 0.00 0.00 23.12 23.49 2wuy s ALA 137 CO 0.02 -0.46 0.48 -1.14 0.00 0.00 0.00 175.76 174.67 2wuy s GLN 138 N -3.27 0.64 0.35 0.00 2.00 -0.82 -0.73 119.66 117.82 2wuy s GLN 138 Ca 0.00 0.50 0.03 0.00 -2.00 0.00 0.00 55.36 53.89 2wuy s GLN 138 Cb 0.02 0.31 -0.04 0.00 0.80 0.00 0.00 33.01 34.10 2wuy s GLN 138 CO -0.08 -0.11 0.11 -3.38 -0.50 0.00 0.00 175.29 171.33 2wuy s HIS 139 N -0.15 1.76 -0.12 1.67 -3.43 -1.26 0.14 115.29 113.90 2wuy s HIS 139 Ca -0.03 -1.21 -0.06 0.00 -0.80 0.00 0.00 55.06 52.95 2wuy s HIS 139 Cb -0.03 -1.09 0.05 0.00 -1.43 0.00 0.00 32.58 30.07 2wuy s HIS 139 CO 0.02 -0.28 0.28 0.00 -2.00 0.00 0.00 174.74 172.77 2wuy s ALA 140 N -3.39 -0.67 -0.17 -1.38 0.00 -0.25 -4.98 121.76 110.91 2wuy s ALA 140 Ca 0.31 1.11 -0.12 0.00 0.00 0.00 0.00 51.96 53.26 2wuy s ALA 140 Cb 0.05 -0.69 -0.22 0.00 0.00 0.00 0.00 23.12 22.26 2wuy s ALA 140 CO 0.15 -0.21 0.22 1.28 0.00 0.00 0.00 175.76 177.20 2wuy n LEU 141 N 4.17 2.34 -3.50 0.00 4.77 -1.26 -1.60 117.00 121.92 2wuy n LEU 141 Ca -0.24 0.27 -0.18 0.00 -0.03 0.00 0.00 56.01 55.82 2wuy n LEU 141 Cb 0.54 -1.03 -0.13 0.00 -2.33 0.00 0.00 43.42 40.47 2wuy n LEU 141 CO 0.13 0.64 -0.20 -0.13 -1.33 0.00 0.00 177.39 176.49 2wuy s ARG 142 N -2.48 0.18 0.26 3.23 0.52 -1.26 -3.55 118.95 115.84 2wuy s ARG 142 Ca -0.27 0.23 0.00 0.00 -0.52 0.00 0.00 55.73 55.17 2wuy s ARG 142 Cb 0.07 -1.15 0.00 0.00 0.52 0.00 0.00 34.95 34.39 2wuy s ARG 142 CO 0.67 -0.63 0.00 0.00 0.02 0.00 0.00 175.30 175.36 2wuy n ASP 144 N -3.37 0.00 0.28 0.00 5.75 -1.26 -5.04 116.55 112.91 2wuy n ASP 144 Ca -0.02 0.00 0.13 0.00 -0.01 0.00 0.00 54.79 54.90 2wuy n ASP 144 Cb 0.38 0.00 0.83 0.00 -1.03 0.00 0.00 41.12 41.30 2wuy n ASP 144 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 2wuy h PRO 145 N 0.00 0.00 -2.94 0.11 0.13 -1.95 -3.22 132.00 124.13 2wuy h PRO 145 Ca 0.00 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.40 2wuy h PRO 145 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 2wuy h PRO 145 CO 0.00 0.02 2.63 -3.47 -0.23 0.00 0.00 178.00 176.96 2wuy n ASP 146 N -3.96 7.36 -3.64 1.44 2.03 -1.26 -4.64 116.55 113.87 2wuy n ASP 146 Ca -0.03 -3.02 -0.05 0.00 0.52 0.00 0.00 54.79 52.21 2wuy n ASP 146 Cb 0.11 -1.44 -0.07 0.00 -0.72 0.00 0.00 41.12 39.01 2wuy n ASP 146 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2wuy s TYR 147 N -0.03 -0.79 -0.29 -0.67 5.04 -1.22 -5.15 117.35 114.24 2wuy s TYR 147 Ca 0.54 1.62 -0.06 0.00 -2.44 0.00 0.00 57.07 56.72 2wuy s TYR 147 Cb 0.16 0.47 0.01 0.00 0.35 0.00 0.00 41.96 42.96 2wuy s TYR 147 CO -0.07 -0.39 0.06 0.08 -1.34 0.00 0.00 175.55 173.89 2wuy s VAL 148 N 1.36 3.78 0.55 3.14 1.01 -1.26 -4.96 120.40 124.01 2wuy s VAL 148 Ca -0.08 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 60.96 2wuy s VAL 148 Cb -0.04 -2.96 -0.06 0.00 0.00 0.00 0.00 36.38 33.32 2wuy s VAL 148 CO -0.16 0.08 1.02 -2.16 0.00 0.00 0.00 175.10 173.89 2wuy s PRO 149 N 1.46 3.64 0.44 2.72 0.05 -1.26 -5.01 135.00 137.05 2wuy s PRO 149 Ca 0.02 1.09 -0.25 0.00 0.05 0.00 0.00 61.00 61.92 2wuy s PRO 149 Cb -0.17 -2.08 -0.08 0.00 0.05 0.00 0.00 34.50 32.22 2wuy s PRO 149 CO 0.01 -0.54 1.33 -1.01 0.05 0.00 0.00 177.00 176.84 2wuy s HIS 150 N -2.51 2.65 0.10 0.56 3.76 -1.26 -4.93 115.29 113.66 2wuy s HIS 150 Ca 0.62 1.38 0.10 0.00 -0.15 0.00 0.00 55.06 57.01 2wuy s HIS 150 Cb -0.13 -3.72 0.03 0.00 1.11 0.00 0.00 32.58 29.87 2wuy s HIS 150 CO 0.33 -2.36 1.41 -0.44 -0.85 0.00 0.00 174.74 172.84 2wuy h ASP 151 N 2.33 0.00 -3.45 1.40 5.19 -1.95 -3.42 116.42 116.52 2wuy h ASP 151 Ca -0.50 0.00 -0.44 0.00 -0.62 0.00 0.00 57.03 55.47 2wuy h ASP 151 Cb 1.26 0.00 -0.34 0.00 0.18 0.00 0.00 39.33 40.43 2wuy h ASP 151 CO 0.61 0.77 -0.79 -0.69 -3.12 0.00 0.00 179.24 176.03 2wuy s VAL 152 N -3.01 0.74 0.31 -1.35 1.01 -1.26 -0.68 120.40 116.16 2wuy s VAL 152 Ca 0.01 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.79 2wuy s VAL 152 Cb 0.10 -0.72 -0.06 0.00 0.00 0.00 0.00 36.38 35.70 2wuy s VAL 152 CO 0.78 0.27 0.02 0.27 0.00 0.00 0.00 175.10 176.44 2wuy s ILE 153 N 0.81 1.33 0.31 2.22 -4.36 -0.37 -4.98 121.20 116.16 2wuy s ILE 153 Ca -0.13 -2.03 -0.09 0.00 -0.26 0.00 0.00 60.65 58.14 2wuy s ILE 153 Cb -0.15 -2.69 -0.07 0.00 1.25 0.00 0.00 42.46 40.81 2wuy s ILE 153 CO 0.01 -0.10 0.64 -0.13 0.24 0.00 0.00 174.94 175.61 2wuy s ARG 154 N -3.84 3.78 -0.17 0.37 1.81 -1.26 -1.00 118.95 118.64 2wuy s ARG 154 Ca 0.34 0.32 -0.29 0.00 -1.72 0.00 0.00 55.73 54.38 2wuy s ARG 154 Cb 0.07 -2.54 -0.01 0.00 -0.45 0.00 0.00 34.95 32.03 2wuy s ARG 154 CO 0.14 0.16 1.21 0.42 -0.68 0.00 0.00 175.30 176.55 2wuy s ILE 155 N -2.08 4.37 -0.21 1.52 1.01 -0.41 -4.75 121.20 120.64 2wuy s ILE 155 Ca 0.49 1.66 -0.03 0.00 0.00 0.00 0.00 60.65 62.76 2wuy s ILE 155 Cb -0.11 -4.07 0.07 0.00 0.01 0.00 0.00 42.46 38.37 2wuy s ILE 155 CO 0.26 -0.14 0.07 -0.69 0.00 0.00 0.00 174.94 174.44 2wuy s VAL 156 N 3.36 0.30 -1.13 2.92 1.01 -1.26 -4.92 120.40 120.68 2wuy s VAL 156 Ca 0.52 -0.57 -0.25 0.00 0.00 0.00 0.00 61.98 61.69 2wuy s VAL 156 Cb -0.20 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.23 2wuy s VAL 156 CO 0.13 -0.36 0.72 -0.62 0.00 0.00 0.00 175.10 174.97 2wuy n GLU 157 N 5.12 -0.79 -1.84 2.72 -0.58 -1.26 -4.94 120.64 119.08 2wuy n GLU 157 Ca -0.07 0.34 -0.30 0.00 -0.42 0.00 0.00 57.16 56.71 2wuy n GLU 157 Cb 0.46 -3.20 0.16 0.00 -0.57 0.00 0.00 31.44 28.30 2wuy n GLU 157 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2wuy s PRO 158 N -6.46 0.88 -0.01 3.49 0.04 -1.26 -5.05 135.00 126.63 2wuy s PRO 158 Ca 0.42 -0.21 -0.21 0.00 0.04 0.00 0.00 61.00 61.03 2wuy s PRO 158 Cb -0.19 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 2wuy s PRO 158 CO 0.92 -2.28 0.63 0.45 0.04 0.00 0.00 177.00 176.75 2wuy s SER 159 N -4.69 6.99 -0.24 6.66 0.15 0.09 -4.92 113.70 117.74 2wuy s SER 159 Ca 0.70 1.19 -0.21 0.00 0.70 0.00 0.00 55.95 58.33 2wuy s SER 159 Cb -0.07 -2.38 -0.02 0.00 -1.71 0.00 0.00 66.02 61.84 2wuy s SER 159 CO 0.52 0.05 0.66 0.26 1.20 0.00 0.00 173.24 175.94 2wuy s TRP 160 N 0.01 3.31 0.13 3.44 0.52 -1.26 -1.13 118.94 123.97 2wuy s TRP 160 Ca 0.33 0.90 -0.30 0.00 0.02 0.00 0.00 56.10 57.05 2wuy s TRP 160 Cb -0.18 -2.86 -0.06 0.00 -1.15 0.00 0.00 33.47 29.21 2wuy s TRP 160 CO 0.18 -0.30 0.97 0.08 0.02 0.00 0.00 176.95 177.91 2wuy s VAL 161 N 2.39 4.40 1.15 4.03 1.01 -0.55 -4.99 120.40 127.85 2wuy s VAL 161 Ca 0.28 2.03 -0.17 0.00 0.00 0.00 0.00 61.98 64.12 2wuy s VAL 161 Cb -0.16 -4.29 0.26 0.00 0.00 0.00 0.00 36.38 32.19 2wuy s VAL 161 CO 0.09 0.33 1.10 -0.83 0.00 0.00 0.00 175.10 175.78 2wuy s GLY 162 N -0.11 1.57 0.08 4.51 0.00 -1.26 -4.44 107.32 107.66 2wuy s GLY 162 Ca 0.47 -0.75 0.12 0.00 0.00 0.00 0.00 44.72 44.56 2wuy s GLY 162 CO 0.31 0.05 1.38 -1.14 0.00 0.00 0.00 173.10 173.70 2wuy n SER 163 N -4.62 0.17 0.00 1.64 3.41 -1.26 -1.21 113.62 111.74 2wuy n SER 163 Ca 0.10 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 2wuy n SER 163 Cb 0.59 -0.59 0.61 0.00 -0.26 0.00 0.00 64.21 64.56 2wuy n SER 163 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2wuy n ASN 164 N -1.70 0.00 -3.86 4.04 6.94 -1.26 -4.90 115.26 114.52 2wuy n ASN 164 Ca 0.02 0.01 -0.29 0.00 -0.02 0.00 0.00 54.58 54.29 2wuy n ASN 164 Cb 0.11 -0.31 0.04 0.00 -2.36 0.00 0.00 39.78 37.25 2wuy n ASN 164 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2wuy n ASN 165 N -1.31 -5.07 -3.98 0.53 3.02 -0.35 -4.89 115.26 103.20 2wuy n ASN 165 Ca 0.11 -0.74 -0.20 0.00 -0.03 0.00 0.00 54.58 53.72 2wuy n ASN 165 Cb 0.21 -4.10 -0.16 0.00 -0.61 0.00 0.00 39.78 35.12 2wuy n ASN 165 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2wuy s GLU 166 N -6.56 0.95 -0.24 3.52 2.02 -1.26 -1.49 118.70 115.64 2wuy s GLU 166 Ca 0.64 -0.26 -0.05 0.00 0.02 0.00 0.00 54.97 55.32 2wuy s GLU 166 Cb -0.32 -0.89 -0.01 0.00 0.10 0.00 0.00 34.13 33.02 2wuy s GLU 166 CO 0.81 0.06 0.01 -0.47 0.02 0.00 0.00 175.26 175.69 2wuy s TYR 167 N 0.36 3.03 -0.23 1.61 6.04 0.03 -4.62 117.35 123.57 2wuy s TYR 167 Ca -0.06 -0.83 0.00 0.00 0.04 0.00 0.00 57.07 56.22 2wuy s TYR 167 Cb -0.10 -2.16 0.03 0.00 -1.04 0.00 0.00 41.96 38.69 2wuy s TYR 167 CO 0.01 -0.51 -0.12 1.03 -1.54 0.00 0.00 175.55 174.42 2wuy s ARG 168 N 1.51 2.76 -0.23 4.97 0.52 -1.26 -0.30 118.95 126.92 2wuy s ARG 168 Ca 0.05 -1.01 -0.05 0.00 -0.52 0.00 0.00 55.73 54.21 2wuy s ARG 168 Cb -0.15 -2.83 -0.01 0.00 0.52 0.00 0.00 34.95 32.48 2wuy s ARG 168 CO -0.01 -0.37 -0.01 0.42 0.02 0.00 0.00 175.30 175.35 2wuy s ILE 169 N 1.26 3.64 0.11 1.52 1.01 0.14 -4.95 121.20 123.93 2wuy s ILE 169 Ca -0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 60.65 59.94 2wuy s ILE 169 Cb -0.16 -2.67 -0.07 0.00 0.01 0.00 0.00 42.46 39.57 2wuy s ILE 169 CO -0.07 0.40 1.23 -0.55 0.00 0.00 0.00 174.94 175.95 2wuy s SER 170 N 1.52 7.03 -0.00 3.58 0.15 -1.26 -0.46 113.70 124.26 2wuy s SER 170 Ca 0.06 2.14 0.16 0.00 0.70 0.00 0.00 55.95 59.02 2wuy s SER 170 Cb -0.14 -2.59 -0.19 0.00 -1.71 0.00 0.00 66.02 61.39 2wuy s SER 170 CO -0.01 -0.47 0.65 0.18 1.20 0.00 0.00 173.24 174.78 2wuy n LEU 171 N 3.47 0.66 -4.66 3.45 4.77 0.61 -4.94 117.00 120.37 2wuy n LEU 171 Ca 0.08 -0.43 -0.39 0.00 -0.03 0.00 0.00 56.01 55.24 2wuy n LEU 171 Cb 0.45 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2wuy n LEU 171 CO 0.56 0.17 0.71 0.00 -1.33 0.00 0.00 177.39 177.50 2wuy n ALA 172 N -1.49 0.70 -2.56 -1.18 0.00 -1.26 -1.35 120.51 113.37 2wuy n ALA 172 Ca 0.02 0.13 -0.05 0.00 0.00 0.00 0.00 53.44 53.54 2wuy n ALA 172 Cb 0.28 -2.19 0.02 0.00 0.00 0.00 0.00 19.45 17.57 2wuy n ALA 172 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wuy n LYS 173 N -0.57 -1.16 -0.69 0.00 4.81 0.55 -4.81 118.16 116.29 2wuy n LYS 173 Ca 0.11 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 2wuy n LYS 173 Cb 0.43 -4.26 0.00 0.00 0.02 0.00 0.00 35.03 31.22 2wuy n LYS 173 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 2wuy n TYR 187 N -2.08 0.00 -3.81 5.64 9.36 -1.26 -3.96 117.16 121.05 2wuy n TYR 187 Ca -0.02 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.84 2wuy n TYR 187 Cb 0.54 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.16 2wuy n TYR 187 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2wuy s THR 188 N -3.58 5.14 0.05 2.97 -4.23 -1.26 -4.98 115.64 109.74 2wuy s THR 188 Ca 0.00 0.10 0.09 0.00 -1.18 0.00 0.00 61.69 60.70 2wuy s THR 188 Cb 0.00 -3.35 -0.13 0.00 1.34 0.00 0.00 72.50 70.36 2wuy s THR 188 CO 0.00 0.42 1.33 0.78 -0.54 0.00 0.00 174.62 176.61 2wuy h ASN 189 N 6.96 0.00 -5.30 3.99 2.35 -2.03 -3.48 115.58 118.08 2wuy h ASN 189 Ca -0.39 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.23 2wuy h ASN 189 Cb 1.16 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.39 2wuy h ASN 189 CO 0.71 0.86 -0.48 -0.94 -1.65 0.00 0.00 177.43 175.92 2wuy s SER 190 N -6.64 0.20 0.27 5.81 1.04 -1.26 -5.04 113.70 108.07 2wuy s SER 190 Ca 0.02 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.49 2wuy s SER 190 Cb 0.09 0.34 0.37 0.00 0.10 0.00 0.00 66.02 66.93 2wuy s SER 190 CO 0.80 -0.78 1.73 0.15 0.98 0.00 0.00 173.24 176.13 2wuy h PHE 191 N 2.76 0.68 -0.79 5.02 3.57 -1.98 -2.01 116.94 124.19 2wuy h PHE 191 Ca -0.33 -0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.08 2wuy h PHE 191 Cb 1.20 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 2wuy h PHE 191 CO 0.43 0.74 0.50 1.49 -2.23 0.00 0.00 178.31 179.24 2wuy h GLU 192 N 0.56 0.93 -0.45 1.11 4.81 -1.99 -0.95 114.58 118.60 2wuy h GLU 192 Ca 0.09 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.14 2wuy h GLU 192 Cb 0.58 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2wuy h GLU 192 CO 0.04 0.62 -0.24 1.96 -0.73 0.00 0.00 179.01 180.65 2wuy h GLN 193 N 0.96 0.94 -0.75 1.92 4.20 -1.90 -1.11 115.11 119.36 2wuy h GLN 193 Ca 0.32 -0.41 0.02 0.00 0.06 0.00 0.00 58.65 58.65 2wuy h GLN 193 Cb 0.04 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.75 2wuy h GLN 193 CO -0.12 1.07 0.48 0.35 -0.67 0.00 0.00 178.83 179.94 2wuy h PHE 194 N 0.80 0.91 -0.24 2.96 3.57 -0.69 -0.88 116.94 123.38 2wuy h PHE 194 Ca 0.10 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.43 2wuy h PHE 194 Cb 0.81 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.25 2wuy h PHE 194 CO 0.05 0.54 -0.61 0.82 -2.23 0.00 0.00 178.31 176.88 2wuy h ILE 195 N 0.96 1.28 -0.38 1.41 1.08 -1.06 -2.68 117.51 118.11 2wuy h ILE 195 Ca 0.29 -1.80 -0.03 0.00 -0.39 0.00 0.00 64.86 62.94 2wuy h ILE 195 Cb -0.02 1.76 -0.02 0.00 -3.07 0.00 0.00 36.82 35.47 2wuy h ILE 195 CO -0.10 0.58 0.11 0.44 -0.69 0.00 0.00 178.15 178.49 2wuy h ASP 196 N 0.60 0.49 -0.25 1.72 3.32 -0.77 -0.45 116.42 121.08 2wuy h ASP 196 Ca -0.01 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2wuy h ASP 196 Cb 1.22 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.65 2wuy h ASP 196 CO 0.13 0.48 0.00 0.54 -1.72 0.00 0.00 179.24 178.68 2wuy n ARG 197 N -4.35 1.62 -4.20 3.56 1.74 -0.37 -4.91 116.66 109.74 2wuy n ARG 197 Ca 0.02 -0.91 -0.36 0.00 -0.77 0.00 0.00 57.85 55.83 2wuy n ARG 197 Cb 0.17 -1.22 -0.06 0.00 -1.02 0.00 0.00 32.46 30.33 2wuy n ARG 197 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2wuy n VAL 198 N 0.23 -0.26 0.28 1.55 0.31 -0.18 -4.80 118.33 115.47 2wuy n VAL 198 Ca 0.08 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.59 2wuy n VAL 198 Cb 0.23 -0.76 0.72 0.00 -0.91 0.00 0.00 33.84 33.12 2wuy n VAL 198 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2wuy h ILE 199 N -0.91 0.00 0.00 2.52 2.04 -1.71 -2.52 117.51 116.93 2wuy h ILE 199 Ca -0.52 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.85 2wuy h ILE 199 Cb 1.34 1.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.90 2wuy h ILE 199 CO 0.76 0.00 -0.01 4.11 0.00 0.00 0.00 178.15 183.01 2wuy h TRP 200 N 0.00 0.00 0.00 1.37 5.08 -1.87 -1.64 115.95 118.88 2wuy h TRP 200 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wuy h TRP 200 Cb 0.48 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.64 2wuy h TRP 200 CO 0.00 0.01 0.00 0.39 -1.28 0.00 0.00 178.44 177.56 2wuy n GLU 201 N -3.26 0.06 0.15 0.12 1.02 -0.95 -3.08 120.64 114.70 2wuy n GLU 201 Ca -0.02 0.31 0.13 0.00 -0.02 0.00 0.00 57.16 57.55 2wuy n GLU 201 Cb 0.12 -1.61 0.42 0.00 -0.02 0.00 0.00 31.44 30.35 2wuy n GLU 201 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2wuy h ASN 202 N 0.00 0.00 -4.76 1.62 2.35 -1.52 -3.46 115.58 109.81 2wuy h ASN 202 Ca 0.00 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 2wuy h ASN 202 Cb 0.28 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 38.44 2wuy h ASN 202 CO 0.00 0.00 -0.16 0.72 -1.65 0.00 0.00 177.43 176.34 2wuy s PHE 203 N -3.24 -0.35 0.49 1.19 -0.71 -1.18 -0.33 117.98 113.86 2wuy s PHE 203 Ca 0.07 0.65 -0.19 0.00 -1.04 0.00 0.00 56.93 56.42 2wuy s PHE 203 Cb 0.10 0.18 -0.08 0.00 -1.21 0.00 0.00 43.02 42.01 2wuy s PHE 203 CO 0.55 -0.41 1.02 0.71 -1.34 0.00 0.00 175.22 175.75 2wuy s TYR 204 N -0.96 3.09 -0.38 3.49 2.02 -0.46 -4.96 117.35 119.20 2wuy s TYR 204 Ca -0.10 1.56 -0.22 0.00 -0.37 0.00 0.00 57.07 57.95 2wuy s TYR 204 Cb -0.04 -2.99 0.01 0.00 -0.40 0.00 0.00 41.96 38.54 2wuy s TYR 204 CO 0.05 -0.70 0.71 0.21 -1.57 0.00 0.00 175.55 174.25 2wuy s LYS 205 N -3.42 3.64 0.23 -0.62 2.20 -1.23 -4.94 119.74 115.59 2wuy s LYS 205 Ca 0.65 0.09 -0.09 0.00 -0.36 0.00 0.00 55.97 56.26 2wuy s LYS 205 Cb -0.14 -3.84 -0.07 0.00 -1.51 0.00 0.00 37.83 32.27 2wuy s LYS 205 CO 0.22 -0.85 0.54 -1.25 -0.36 0.00 0.00 175.35 173.65 2wuy s PRO 206 N 2.92 3.77 -0.02 4.03 0.04 -1.26 -4.55 135.00 139.93 2wuy s PRO 206 Ca 0.27 0.22 0.04 0.00 0.04 0.00 0.00 61.00 61.57 2wuy s PRO 206 Cb -0.14 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 2wuy s PRO 206 CO 0.17 0.32 -0.14 0.96 0.04 0.00 0.00 177.00 178.35 2wuy s ILE 207 N -1.83 1.13 0.01 0.56 -4.36 -0.63 -4.88 121.20 111.20 2wuy s ILE 207 Ca 0.47 -0.58 0.03 0.00 -0.26 0.00 0.00 60.65 60.30 2wuy s ILE 207 Cb -0.11 -0.96 -0.01 0.00 1.25 0.00 0.00 42.46 42.62 2wuy s ILE 207 CO 0.22 0.33 -0.08 -0.69 0.24 0.00 0.00 174.94 174.96 2wuy s VAL 208 N -0.09 0.63 0.00 8.37 1.01 -1.26 -1.09 120.40 127.97 2wuy s VAL 208 Ca 0.01 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.49 2wuy s VAL 208 Cb -0.08 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 2wuy s VAL 208 CO 0.00 0.01 -0.26 -0.31 0.00 0.00 0.00 175.10 174.55 2wuy s TYR 209 N -0.55 2.34 -0.02 5.22 2.02 0.12 -0.79 117.35 125.69 2wuy s TYR 209 Ca -0.00 -0.42 0.04 0.00 -0.37 0.00 0.00 57.07 56.32 2wuy s TYR 209 Cb -0.05 -1.46 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 2wuy s TYR 209 CO 0.00 0.03 -0.15 0.42 -1.57 0.00 0.00 175.55 174.29 2wuy s ILE 210 N -0.69 1.21 0.00 2.71 -1.09 -0.79 -1.94 121.20 120.60 2wuy s ILE 210 Ca 0.11 -0.62 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 2wuy s ILE 210 Cb -0.10 -1.03 0.00 0.00 -1.58 0.00 0.00 42.46 39.75 2wuy s ILE 210 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 174.94 174.67 2wuy n GLY 211 N 2.96 3.72 3.21 6.18 0.00 -0.10 -1.13 105.19 120.04 2wuy n GLY 211 Ca -0.16 -1.46 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 2wuy n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wuy s THR 212 N -2.11 0.15 -0.96 2.61 -4.23 -1.26 -1.03 115.64 108.81 2wuy s THR 212 Ca 0.00 -1.98 0.12 0.00 -1.18 0.00 0.00 61.69 58.65 2wuy s THR 212 Cb 0.00 -2.39 0.54 0.00 1.34 0.00 0.00 72.50 71.99 2wuy s THR 212 CO 0.00 -0.14 1.39 -0.90 -0.54 0.00 0.00 174.62 174.43 2wuy n ASP 213 N -0.26 3.87 -4.80 3.99 3.85 -0.67 -4.56 116.55 117.97 2wuy n ASP 213 Ca -0.01 -2.45 -0.33 0.00 -0.71 0.00 0.00 54.79 51.29 2wuy n ASP 213 Cb 0.65 -0.54 -0.00 0.00 -1.35 0.00 0.00 41.12 39.88 2wuy n ASP 213 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 2wuy s SER 214 N -0.69 5.92 0.00 -1.12 0.15 -1.26 -4.89 113.70 111.81 2wuy s SER 214 Ca 0.37 1.90 0.21 0.00 0.70 0.00 0.00 55.95 59.14 2wuy s SER 214 Cb 0.26 -2.55 0.56 0.00 -1.71 0.00 0.00 66.02 62.58 2wuy s SER 214 CO 0.15 -1.07 1.48 0.00 1.20 0.00 0.00 173.24 175.00 2wuy n ALA 215 N -1.62 2.40 -2.37 5.45 0.00 -1.26 -4.43 120.51 118.68 2wuy n ALA 215 Ca 0.09 -1.11 -0.18 0.00 0.00 0.00 0.00 53.44 52.24 2wuy n ALA 215 Cb 0.52 -0.94 -0.10 0.00 0.00 0.00 0.00 19.45 18.93 2wuy n ALA 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2wuy s GLU 216 N -1.21 1.45 0.44 0.00 -1.05 -1.26 -4.85 118.70 112.22 2wuy s GLU 216 Ca 0.43 -1.76 -0.24 0.00 -0.15 0.00 0.00 54.97 53.25 2wuy s GLU 216 Cb 0.23 -0.66 -0.08 0.00 -0.44 0.00 0.00 34.13 33.18 2wuy s GLU 216 CO 0.30 -0.15 1.22 -1.83 0.95 0.00 0.00 175.26 175.76 2wuy s GLU 217 N -3.89 3.82 -0.07 -4.83 -1.05 -1.26 -4.13 118.70 107.29 2wuy s GLU 217 Ca 0.32 1.93 0.02 0.00 -0.15 0.00 0.00 54.97 57.09 2wuy s GLU 217 Cb 0.07 -2.54 0.02 0.00 -0.44 0.00 0.00 34.13 31.23 2wuy s GLU 217 CO 0.12 -0.55 -0.11 -1.21 0.95 0.00 0.00 175.26 174.46 2wuy s GLU 218 N -2.50 1.63 -0.13 -4.83 0.41 -0.41 -4.95 118.70 107.91 2wuy s GLU 218 Ca 0.61 -0.37 -0.22 0.00 -0.41 0.00 0.00 54.97 54.58 2wuy s GLU 218 Cb -0.33 -1.42 -0.03 0.00 -1.78 0.00 0.00 34.13 30.58 2wuy s GLU 218 CO 0.40 -0.03 0.65 -2.00 -0.49 0.00 0.00 175.26 173.79 2wuy s GLU 219 N 0.86 4.33 -0.00 1.61 2.12 -1.26 -0.83 118.70 125.53 2wuy s GLU 219 Ca -0.11 0.72 0.04 0.00 0.36 0.00 0.00 54.97 55.98 2wuy s GLU 219 Cb -0.15 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 2wuy s GLU 219 CO 0.01 -0.06 -0.13 0.96 -0.54 0.00 0.00 175.26 175.50 2wuy s ILE 220 N 1.28 1.03 -0.26 -3.70 -4.36 0.63 -2.47 121.20 113.36 2wuy s ILE 220 Ca 0.32 -0.62 -0.10 0.00 -0.26 0.00 0.00 60.65 60.00 2wuy s ILE 220 Cb -0.16 -0.87 -0.05 0.00 1.25 0.00 0.00 42.46 42.63 2wuy s ILE 220 CO 0.13 0.25 0.16 -0.22 0.24 0.00 0.00 174.94 175.50 2wuy s LEU 221 N -0.42 3.95 0.01 0.37 1.98 0.33 -1.00 118.68 123.91 2wuy s LEU 221 Ca 0.04 0.00 0.03 0.00 -2.89 0.00 0.00 54.13 51.32 2wuy s LEU 221 Cb -0.05 -2.08 -0.04 0.00 0.66 0.00 0.00 46.19 44.68 2wuy s LEU 221 CO -0.00 0.00 -0.04 -0.76 -1.89 0.00 0.00 176.35 173.66 2wuy s LEU 222 N 1.44 3.32 -0.12 -0.68 1.43 0.15 -1.77 118.68 122.45 2wuy s LEU 222 Ca 0.07 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2wuy s LEU 222 Cb -0.15 -1.92 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2wuy s LEU 222 CO 0.07 0.27 -0.09 -0.70 0.23 0.00 0.00 176.35 176.13 2wuy s GLU 223 N -1.58 1.72 -0.19 1.70 2.12 0.38 -1.11 118.70 121.74 2wuy s GLU 223 Ca 0.19 -0.33 -0.06 0.00 0.36 0.00 0.00 54.97 55.13 2wuy s GLU 223 Cb -0.11 -1.71 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 2wuy s GLU 223 CO 0.10 -0.25 0.02 0.08 -0.54 0.00 0.00 175.26 174.67 2wuy s VAL 224 N 1.61 4.25 0.19 3.70 1.01 -0.36 -0.94 120.40 129.86 2wuy s VAL 224 Ca 0.04 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2wuy s VAL 224 Cb -0.13 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 2wuy s VAL 224 CO -0.08 0.44 0.02 -0.44 0.00 0.00 0.00 175.10 175.04 2wuy s SER 225 N 0.76 1.21 -0.14 3.32 0.01 -0.24 -0.49 113.70 118.14 2wuy s SER 225 Ca 0.01 -1.22 -0.00 0.00 1.31 0.00 0.00 55.95 56.05 2wuy s SER 225 Cb -0.14 0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 2wuy s SER 225 CO 0.02 -0.60 -0.14 -0.76 0.41 0.00 0.00 173.24 172.17 2wuy s LEU 226 N -3.21 2.59 -0.28 2.44 1.43 0.09 -0.40 118.68 121.35 2wuy s LEU 226 Ca 0.27 -0.40 -0.05 0.00 -1.03 0.00 0.00 54.13 52.92 2wuy s LEU 226 Cb 0.06 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.71 2wuy s LEU 226 CO 0.06 0.12 0.03 -0.69 0.23 0.00 0.00 176.35 176.10 2wuy s VAL 227 N 0.62 3.52 0.00 -1.59 1.01 0.20 0.15 120.40 124.32 2wuy s VAL 227 Ca -0.08 -0.88 -0.19 0.00 0.00 0.00 0.00 61.98 60.84 2wuy s VAL 227 Cb -0.16 -2.83 -0.06 0.00 0.00 0.00 0.00 36.38 33.33 2wuy s VAL 227 CO 0.03 0.09 0.53 -0.36 0.00 0.00 0.00 175.10 175.39 2wuy s PHE 228 N 1.42 3.71 -0.35 5.22 0.08 0.01 -0.56 117.98 127.52 2wuy s PHE 228 Ca 0.01 1.13 -0.13 0.00 0.12 0.00 0.00 56.93 58.06 2wuy s PHE 228 Cb -0.17 -2.50 -0.01 0.00 -0.57 0.00 0.00 43.02 39.77 2wuy s PHE 228 CO -0.00 0.46 0.24 0.15 -0.10 0.00 0.00 175.22 175.97 2wuy s LYS 229 N -0.55 3.37 -0.11 0.44 -0.14 -0.42 -1.36 119.74 120.97 2wuy s LYS 229 Ca 0.28 -0.72 0.02 0.00 -1.36 0.00 0.00 55.97 54.19 2wuy s LYS 229 Cb -0.18 -3.80 -0.01 0.00 -1.68 0.00 0.00 37.83 32.17 2wuy s LYS 229 CO 0.16 -0.49 -0.20 0.08 -0.76 0.00 0.00 175.35 174.14 2wuy s VAL 230 N 1.70 2.45 -0.37 3.17 1.01 -0.27 -0.25 120.40 127.83 2wuy s VAL 230 Ca 0.06 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2wuy s VAL 230 Cb -0.18 -1.98 0.03 0.00 0.00 0.00 0.00 36.38 34.25 2wuy s VAL 230 CO 0.10 0.55 0.20 -0.75 0.00 0.00 0.00 175.10 175.20 2wuy s LYS 231 N 0.37 2.83 -0.14 2.72 2.20 -0.20 0.80 119.74 128.31 2wuy s LYS 231 Ca -0.15 -1.08 -0.11 0.00 -0.36 0.00 0.00 55.97 54.27 2wuy s LYS 231 Cb -0.17 -3.73 -0.05 0.00 -1.51 0.00 0.00 37.83 32.38 2wuy s LYS 231 CO 0.07 -0.70 0.21 -2.00 -0.36 0.00 0.00 175.35 172.58 2wuy s GLU 232 N 1.55 3.98 -0.84 4.03 2.12 -1.26 -0.92 118.70 127.36 2wuy s GLU 232 Ca 0.02 -0.03 0.01 0.00 0.36 0.00 0.00 54.97 55.33 2wuy s GLU 232 Cb -0.19 -3.34 0.22 0.00 0.26 0.00 0.00 34.13 31.08 2wuy s GLU 232 CO 0.07 0.45 0.78 1.19 -0.54 0.00 0.00 175.26 177.21 2wuy n PHE 233 N 2.94 3.78 -3.10 5.30 3.72 0.18 -5.01 117.46 125.27 2wuy n PHE 233 Ca -0.16 -4.05 -0.41 0.00 -0.05 0.00 0.00 57.45 52.79 2wuy n PHE 233 Cb 0.53 -0.95 -0.06 0.00 -0.94 0.00 0.00 39.48 38.06 2wuy n PHE 233 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wuy s ALA 234 N -1.71 3.60 0.69 4.37 0.00 -1.26 -3.84 121.76 123.61 2wuy s ALA 234 Ca 0.29 -0.38 -0.15 0.00 0.00 0.00 0.00 51.96 51.73 2wuy s ALA 234 Cb -0.02 -3.03 0.02 0.00 0.00 0.00 0.00 23.12 20.09 2wuy s ALA 234 CO -0.10 -0.75 1.16 -1.25 0.00 0.00 0.00 175.76 174.82 2wuy s PRO 235 N 2.37 2.46 -1.30 0.00 0.04 -1.26 -4.88 135.00 132.42 2wuy s PRO 235 Ca 0.27 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 62.73 2wuy s PRO 235 Cb -0.16 -1.89 0.08 0.00 0.04 0.00 0.00 34.50 32.57 2wuy s PRO 235 CO 0.09 -1.55 1.74 -3.47 0.04 0.00 0.00 177.00 173.85 2wuy n ASP 236 N -2.56 4.91 -3.73 6.66 2.03 -1.26 -4.85 116.55 117.76 2wuy n ASP 236 Ca 0.12 -2.92 -0.12 0.00 0.52 0.00 0.00 54.79 52.39 2wuy n ASP 236 Cb 0.51 -1.73 -0.11 0.00 -0.72 0.00 0.00 41.12 39.07 2wuy n ASP 236 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wuy s ALA 237 N 3.98 -0.88 0.78 -1.67 0.00 -1.26 -5.17 121.76 117.55 2wuy s ALA 237 Ca 0.53 1.17 -0.12 0.00 0.00 0.00 0.00 51.96 53.54 2wuy s ALA 237 Cb 0.04 -0.70 0.06 0.00 0.00 0.00 0.00 23.12 22.53 2wuy s ALA 237 CO 0.07 -0.20 1.16 -1.25 0.00 0.00 0.00 175.76 175.53 2wuy s PRO 238 N 0.75 2.17 -0.26 0.00 0.04 -1.26 -5.05 135.00 131.39 2wuy s PRO 238 Ca -0.05 0.18 -0.11 0.00 0.04 0.00 0.00 61.00 61.06 2wuy s PRO 238 Cb -0.06 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 2wuy s PRO 238 CO -0.05 -1.46 0.19 -1.17 0.04 0.00 0.00 177.00 174.55 2wuy s LEU 239 N -5.52 4.07 0.13 -3.56 2.96 -1.26 -5.09 118.68 110.41 2wuy s LEU 239 Ca 0.61 0.08 0.05 0.00 -0.22 0.00 0.00 54.13 54.65 2wuy s LEU 239 Cb -0.11 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 2wuy s LEU 239 CO 0.49 -0.00 0.06 -0.36 -1.32 0.00 0.00 176.35 175.22 2wuy s PHE 240 N 1.44 3.05 0.18 5.38 2.99 -1.26 -5.10 117.98 124.66 2wuy s PHE 240 Ca 0.08 -0.02 -0.30 0.00 0.00 0.00 0.00 56.93 56.69 2wuy s PHE 240 Cb -0.15 -1.52 -0.08 0.00 0.00 0.00 0.00 43.02 41.28 2wuy s PHE 240 CO 0.08 0.51 1.10 0.99 -0.00 0.00 0.00 175.22 177.90 2wuy s THR 241 N -1.55 3.86 0.30 0.64 2.01 -1.26 -4.91 115.64 114.73 2wuy s THR 241 Ca 0.28 1.61 -0.29 0.00 0.31 0.00 0.00 61.69 63.61 2wuy s THR 241 Cb -0.11 -4.03 -0.09 0.00 0.01 0.00 0.00 72.50 68.28 2wuy s THR 241 CO 0.21 0.28 1.10 -0.83 -0.69 0.00 0.00 174.62 174.68 2wuy s GLY 242 N -0.11 3.02 0.34 4.40 0.00 -1.26 -3.76 107.32 109.95 2wuy s GLY 242 Ca 0.49 0.88 -0.25 0.00 0.00 0.00 0.00 44.72 45.84 2wuy s GLY 242 CO 0.35 1.45 0.95 2.56 0.00 0.00 0.00 173.10 178.41 2wuy s PRO 243 N -1.62 4.53 0.32 2.90 0.04 -1.26 -5.14 135.00 134.77 2wuy s PRO 243 Ca 0.47 1.30 -0.27 0.00 0.04 0.00 0.00 61.00 62.53 2wuy s PRO 243 Cb -0.31 -2.70 -0.09 0.00 0.04 0.00 0.00 34.50 31.44 2wuy s PRO 243 CO 0.39 0.23 1.00 0.00 0.04 0.00 0.00 177.00 178.66 2wuy s ALA 244 N -1.70 3.24 0.00 8.56 0.00 -1.25 -5.13 121.76 125.48 2wuy s ALA 244 Ca 0.52 0.66 0.00 0.00 0.00 0.00 0.00 51.96 53.14 2wuy s ALA 244 Cb -0.17 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2wuy s ALA 244 CO 0.22 0.03 0.00 0.66 0.00 0.00 0.00 175.76 176.67