#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wfc s ILE 30 N 0.00 3.20 0.09 0.52 2.07 -0.61 -4.96 121.20 121.51 2wfc s ILE 30 Ca 0.00 0.70 0.03 0.00 -1.41 0.00 0.00 60.65 59.97 2wfc s ILE 30 Cb 0.00 -3.25 -0.04 0.00 0.13 0.00 0.00 42.46 39.30 2wfc s ILE 30 CO 0.00 -0.21 -0.09 -0.54 -1.91 0.00 0.00 174.94 172.19 2wfc s LYS 31 N -3.48 0.81 0.20 3.50 1.02 -1.26 -5.02 119.74 115.51 2wfc s LYS 31 Ca 0.71 -1.14 -0.32 0.00 0.02 0.00 0.00 55.97 55.24 2wfc s LYS 31 Cb -0.23 -0.46 -0.15 0.00 -0.52 0.00 0.00 37.83 36.47 2wfc s LYS 31 CO 0.30 0.06 1.22 0.39 -0.92 0.00 0.00 175.35 176.40 2wfc n GLU 32 N 0.57 1.39 0.00 1.68 1.02 -1.26 -1.18 120.64 122.87 2wfc n GLU 32 Ca -0.16 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 2wfc n GLU 32 Cb 0.58 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 2wfc n GLU 32 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wfc n GLY 33 N 2.00 3.45 3.78 0.62 0.00 0.90 -5.01 105.19 110.93 2wfc n GLY 33 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2wfc n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wfc s ASP 34 N -0.79 6.80 0.11 1.61 1.01 -0.32 -4.72 116.67 120.38 2wfc s ASP 34 Ca 0.00 2.08 -0.24 0.00 0.71 0.00 0.00 52.55 55.10 2wfc s ASP 34 Cb 0.00 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 2wfc s ASP 34 CO 0.00 -0.46 0.73 -0.54 0.21 0.00 0.00 175.17 175.11 2wfc s LYS 35 N -2.36 4.48 0.26 8.23 3.01 -1.26 -0.82 119.74 131.28 2wfc s LYS 35 Ca 0.56 1.04 -0.30 0.00 -1.01 0.00 0.00 55.97 56.27 2wfc s LYS 35 Cb -0.24 -3.28 -0.10 0.00 -1.01 0.00 0.00 37.83 33.19 2wfc s LYS 35 CO 0.30 0.51 1.48 -0.51 0.51 0.00 0.00 175.35 177.64 2wfc s LEU 36 N -0.85 4.37 0.52 3.17 1.43 -0.02 -4.95 118.68 122.35 2wfc s LEU 36 Ca 0.35 2.74 -0.20 0.00 -1.03 0.00 0.00 54.13 56.00 2wfc s LEU 36 Cb -0.22 -3.63 -0.07 0.00 0.03 0.00 0.00 46.19 42.31 2wfc s LEU 36 CO 0.24 -0.76 1.08 -2.16 0.23 0.00 0.00 176.35 174.98 2wfc s PRO 37 N -0.39 3.57 -1.30 1.29 0.04 -1.26 -4.46 135.00 132.50 2wfc s PRO 37 Ca 0.61 1.48 -0.08 0.00 0.04 0.00 0.00 61.00 63.05 2wfc s PRO 37 Cb -0.43 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 31.99 2wfc s PRO 37 CO 0.44 -0.64 2.94 0.00 0.04 0.00 0.00 177.00 179.78 2wfc n ALA 38 N -1.14 7.23 -2.73 8.56 0.00 -1.26 -3.66 120.51 127.51 2wfc n ALA 38 Ca 0.10 -3.38 -0.37 0.00 0.00 0.00 0.00 53.44 49.79 2wfc n ALA 38 Cb 0.52 -3.07 -0.06 0.00 0.00 0.00 0.00 19.45 16.84 2wfc n ALA 38 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wfc s VAL 39 N 1.19 5.32 -0.11 0.00 1.01 -1.26 -4.80 120.40 121.76 2wfc s VAL 39 Ca 0.66 0.45 -0.23 0.00 0.00 0.00 0.00 61.98 62.86 2wfc s VAL 39 Cb 0.21 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 2wfc s VAL 39 CO -0.07 0.58 0.71 -0.89 0.00 0.00 0.00 175.10 175.43 2wfc s THR 40 N -0.89 5.02 0.47 3.92 2.01 -1.26 -1.12 115.64 123.79 2wfc s THR 40 Ca 0.18 1.43 0.02 0.00 0.31 0.00 0.00 61.69 63.63 2wfc s THR 40 Cb -0.14 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.31 2wfc s THR 40 CO 0.07 0.19 0.04 0.68 -0.69 0.00 0.00 174.62 174.91 2wfc s VAL 41 N 1.21 1.09 0.08 3.82 -7.23 -0.05 -4.83 120.40 114.49 2wfc s VAL 41 Ca 0.36 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.58 2wfc s VAL 41 Cb -0.17 -2.31 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 2wfc s VAL 41 CO 0.16 0.00 -0.14 -0.36 -0.31 0.00 0.00 175.10 174.45 2wfc s PHE 42 N -2.96 1.24 0.00 2.82 0.40 -0.14 0.17 117.98 119.51 2wfc s PHE 42 Ca 0.14 -0.49 0.00 0.00 -0.60 0.00 0.00 56.93 55.98 2wfc s PHE 42 Cb 0.03 -0.69 0.00 0.00 0.51 0.00 0.00 43.02 42.87 2wfc s PHE 42 CO 0.08 0.07 0.00 0.41 0.70 0.00 0.00 175.22 176.48 2wfc n GLY 43 N 1.09 0.67 0.20 4.36 0.00 0.31 -0.73 105.19 111.09 2wfc n GLY 43 Ca -0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.86 2wfc n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wfc h ALA 44 N -1.61 1.34 -2.64 4.61 0.00 -1.85 -3.43 119.26 115.68 2wfc h ALA 44 Ca 0.00 -0.30 -0.23 0.00 0.00 0.00 0.00 54.91 54.38 2wfc h ALA 44 Cb 0.00 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 17.60 2wfc h ALA 44 CO 0.00 0.41 -0.55 0.95 0.00 0.00 0.00 179.25 180.06 2wfc s THR 45 N -4.15 0.00 0.05 0.00 -4.23 -1.26 -4.13 115.64 101.92 2wfc s THR 45 Ca -0.03 -1.93 0.31 0.00 -1.18 0.00 0.00 61.69 58.86 2wfc s THR 45 Cb 0.14 -2.47 0.32 0.00 1.34 0.00 0.00 72.50 71.82 2wfc s THR 45 CO 0.70 0.00 1.93 -0.65 -0.54 0.00 0.00 174.62 176.06 2wfc h PRO 46 N 2.55 0.00 -0.01 3.99 0.11 -1.96 -2.23 132.00 134.46 2wfc h PRO 46 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2wfc h PRO 46 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2wfc h PRO 46 CO 0.50 0.00 -0.27 0.09 -0.21 0.00 0.00 178.00 178.11 2wfc n ASN 47 N -2.61 0.88 -4.35 -2.05 5.03 -1.26 -4.66 115.26 106.25 2wfc n ASN 47 Ca -0.01 -0.75 -0.46 0.00 0.87 0.00 0.00 54.58 54.22 2wfc n ASN 47 Cb 0.12 0.12 -0.02 0.00 -1.02 0.00 0.00 39.78 38.98 2wfc n ASN 47 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2wfc s ASP 48 N -2.57 6.85 0.13 6.41 1.01 -0.84 -5.03 116.67 122.63 2wfc s ASP 48 Ca 0.23 -2.78 -0.14 0.00 0.71 0.00 0.00 52.55 50.57 2wfc s ASP 48 Cb 0.19 -2.23 -0.07 0.00 1.01 0.00 0.00 42.92 41.82 2wfc s ASP 48 CO 0.54 -0.58 0.53 -0.54 0.21 0.00 0.00 175.17 175.33 2wfc s LYS 49 N 0.22 3.97 -0.09 8.23 1.02 -1.26 -0.53 119.74 131.30 2wfc s LYS 49 Ca 0.22 0.48 -0.00 0.00 0.02 0.00 0.00 55.97 56.69 2wfc s LYS 49 Cb -0.09 -2.97 0.02 0.00 -0.52 0.00 0.00 37.83 34.28 2wfc s LYS 49 CO -0.09 0.50 -0.06 0.08 -0.92 0.00 0.00 175.35 174.87 2wfc s VAL 50 N -1.42 0.80 -0.36 3.17 1.01 0.13 -4.89 120.40 118.83 2wfc s VAL 50 Ca 0.36 -0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 2wfc s VAL 50 Cb -0.15 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2wfc s VAL 50 CO 0.19 0.32 0.79 0.21 0.00 0.00 0.00 175.10 176.60 2wfc s ASN 51 N 1.54 6.57 0.29 3.32 3.84 -1.26 -0.87 114.94 128.36 2wfc s ASN 51 Ca 0.00 0.40 0.22 0.00 0.21 0.00 0.00 52.86 53.69 2wfc s ASN 51 Cb -0.13 -2.40 1.06 0.00 -0.55 0.00 0.00 41.25 39.23 2wfc s ASN 51 CO -0.05 -0.72 1.67 0.23 -2.79 0.00 0.00 177.10 175.44 2wfc n MET 52 N 6.40 0.16 0.09 0.43 2.81 -0.28 -1.00 117.12 125.74 2wfc n MET 52 Ca 0.03 0.54 0.12 0.00 -1.81 0.00 0.00 57.70 56.58 2wfc n MET 52 Cb 0.48 -1.91 0.15 0.00 -0.71 0.00 0.00 33.22 31.24 2wfc n MET 52 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wfc h ALA 53 N 2.12 0.65 0.06 3.04 0.00 -1.78 -3.35 119.26 119.99 2wfc h ALA 53 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 2wfc h ALA 53 Cb 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2wfc h ALA 53 CO 0.00 0.00 -1.97 0.39 0.00 0.00 0.00 179.25 177.67 2wfc n GLU 54 N -2.37 0.70 -0.25 0.00 1.02 -0.17 -4.18 120.64 115.38 2wfc n GLU 54 Ca 0.03 0.24 0.06 0.00 -0.02 0.00 0.00 57.16 57.47 2wfc n GLU 54 Cb 0.47 -1.71 0.19 0.00 -0.02 0.00 0.00 31.44 30.37 2wfc n GLU 54 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2wfc h LEU 55 N 0.03 -0.00 -3.16 -4.62 5.85 -1.41 -1.37 115.31 110.62 2wfc h LEU 55 Ca -0.40 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2wfc h LEU 55 Cb 2.03 0.21 0.00 0.00 0.37 0.00 0.00 40.66 43.27 2wfc h LEU 55 CO 0.06 -0.05 0.00 0.49 -0.34 0.00 0.00 178.44 178.60 2wfc n PHE 56 N -5.17 0.96 -1.88 1.25 3.72 -1.26 -4.93 117.46 110.15 2wfc n PHE 56 Ca 0.14 -0.73 -0.42 0.00 -0.05 0.00 0.00 57.45 56.40 2wfc n PHE 56 Cb 0.47 -0.24 -0.02 0.00 -0.94 0.00 0.00 39.48 38.75 2wfc n PHE 56 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wfc s ALA 57 N -2.20 3.75 -1.50 4.37 0.00 -0.52 -2.06 121.76 123.60 2wfc s ALA 57 Ca 0.39 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.80 2wfc s ALA 57 Cb 0.28 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.78 2wfc s ALA 57 CO 0.13 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.45 2wfc n GLY 58 N 2.84 0.64 3.22 0.00 0.00 -1.26 -4.91 105.19 105.72 2wfc n GLY 58 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 2wfc n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wfc s LYS 59 N -4.03 0.99 -0.08 1.61 1.02 -1.01 -4.91 119.74 113.34 2wfc s LYS 59 Ca 0.00 -1.43 -0.09 0.00 0.02 0.00 0.00 55.97 54.47 2wfc s LYS 59 Cb 0.00 -0.42 -0.05 0.00 -0.52 0.00 0.00 37.83 36.84 2wfc s LYS 59 CO 0.00 0.01 0.23 0.21 -0.92 0.00 0.00 175.35 174.88 2wfc s LYS 60 N -3.80 3.60 0.05 1.68 2.20 -1.26 -0.58 119.74 121.62 2wfc s LYS 60 Ca 0.16 0.05 -0.02 0.00 -0.36 0.00 0.00 55.97 55.80 2wfc s LYS 60 Cb 0.04 -3.19 -0.03 0.00 -1.51 0.00 0.00 37.83 33.14 2wfc s LYS 60 CO -0.01 0.75 0.01 0.20 -0.36 0.00 0.00 175.35 175.94 2wfc s GLY 61 N -1.08 0.37 -0.07 5.54 0.00 1.00 -0.68 107.32 112.40 2wfc s GLY 61 Ca 0.18 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.92 2wfc s GLY 61 CO 0.08 -1.14 -0.18 0.14 0.00 0.00 0.00 173.10 172.00 2wfc s VAL 62 N -3.57 1.54 -0.12 1.40 1.01 -0.31 -0.75 120.40 119.59 2wfc s VAL 62 Ca 0.04 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2wfc s VAL 62 Cb 0.05 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 35.09 2wfc s VAL 62 CO -0.09 0.44 -0.14 -0.22 0.00 0.00 0.00 175.10 175.10 2wfc s LEU 63 N 0.44 1.65 0.09 3.92 2.96 -0.50 -0.72 118.68 126.51 2wfc s LEU 63 Ca -0.14 -0.43 0.09 0.00 -0.22 0.00 0.00 54.13 53.43 2wfc s LEU 63 Cb -0.16 -1.08 -0.03 0.00 0.50 0.00 0.00 46.19 45.42 2wfc s LEU 63 CO 0.05 -0.02 -0.24 0.72 -1.32 0.00 0.00 176.35 175.54 2wfc s PHE 64 N 1.21 2.09 0.08 5.38 -0.71 0.04 0.21 117.98 126.29 2wfc s PHE 64 Ca -0.02 -0.40 0.10 0.00 -1.04 0.00 0.00 56.93 55.57 2wfc s PHE 64 Cb -0.14 -1.18 -0.03 0.00 -1.21 0.00 0.00 43.02 40.46 2wfc s PHE 64 CO -0.05 0.22 -0.26 0.00 -1.34 0.00 0.00 175.22 173.79 2wfc s ALA 65 N -1.00 2.25 0.21 1.99 0.00 0.14 -0.39 121.76 124.96 2wfc s ALA 65 Ca 0.10 -1.33 0.09 0.00 0.00 0.00 0.00 51.96 50.82 2wfc s ALA 65 Cb -0.10 -0.42 -0.05 0.00 0.00 0.00 0.00 23.12 22.56 2wfc s ALA 65 CO 0.04 0.52 -0.16 0.14 0.00 0.00 0.00 175.76 176.30 2wfc s VAL 66 N -0.92 1.90 0.27 0.00 -7.23 -0.63 -2.92 120.40 110.88 2wfc s VAL 66 Ca 0.12 -2.18 0.22 0.00 -1.81 0.00 0.00 61.98 58.34 2wfc s VAL 66 Cb -0.10 -2.04 0.21 0.00 0.56 0.00 0.00 36.38 35.01 2wfc s VAL 66 CO 0.04 -0.49 1.89 -0.65 -0.31 0.00 0.00 175.10 175.57 2wfc h PRO 67 N 2.67 0.00 -1.31 4.82 0.11 -1.83 -3.40 132.00 133.06 2wfc h PRO 67 Ca -0.39 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.87 2wfc h PRO 67 Cb 1.22 0.00 -0.27 0.00 0.11 0.00 0.00 31.00 32.07 2wfc h PRO 67 CO 0.59 0.25 0.73 0.20 -0.21 0.00 0.00 178.00 179.55 2wfc s GLY 68 N -4.27 -0.02 0.43 -0.55 0.00 -1.26 -4.41 107.32 97.23 2wfc s GLY 68 Ca -0.01 2.66 -0.25 0.00 0.00 0.00 0.00 44.72 47.11 2wfc s GLY 68 CO 0.64 1.34 1.32 0.00 0.00 0.00 0.00 173.10 176.40 2wfc n ALA 69 N 1.04 1.52 -0.77 3.20 0.00 -1.26 -2.39 120.51 121.85 2wfc n ALA 69 Ca -0.07 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2wfc n ALA 69 Cb 0.58 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2wfc n ALA 69 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2wfc n PHE 70 N -0.22 0.00 -1.20 0.00 3.72 -1.26 -5.01 117.46 113.49 2wfc n PHE 70 Ca 0.06 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.15 2wfc n PHE 70 Cb 0.40 -1.35 0.10 0.00 -0.94 0.00 0.00 39.48 37.69 2wfc n PHE 70 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2wfc s THR 71 N -1.45 3.13 0.01 4.37 -4.23 -1.01 -4.82 115.64 111.65 2wfc s THR 71 Ca 0.00 0.37 -0.20 0.00 -1.18 0.00 0.00 61.69 60.68 2wfc s THR 71 Cb 0.00 -2.81 -0.22 0.00 1.34 0.00 0.00 72.50 70.81 2wfc s THR 71 CO 0.00 -0.48 1.13 -0.65 -0.54 0.00 0.00 174.62 174.08 2wfc h PRO 72 N -1.25 0.43 -0.24 3.99 0.11 -1.95 -0.88 132.00 132.21 2wfc h PRO 72 Ca -0.44 -0.42 -0.19 0.00 0.11 0.00 0.00 66.00 65.06 2wfc h PRO 72 Cb 1.24 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2wfc h PRO 72 CO 0.51 1.08 -0.59 0.78 -0.21 0.00 0.00 178.00 179.56 2wfc h GLY 73 N -0.07 0.85 0.76 -0.55 0.00 -1.97 -1.61 103.07 100.48 2wfc h GLY 73 Ca -0.06 -1.03 0.06 0.00 0.00 0.00 0.00 47.33 46.30 2wfc h GLY 73 CO 0.11 0.92 0.58 1.76 0.00 0.00 0.00 176.54 179.91 2wfc h SER 74 N 0.58 0.93 0.60 0.19 0.02 -1.89 -1.00 113.55 112.97 2wfc h SER 74 Ca 0.00 0.01 -0.24 0.00 -0.84 0.00 0.00 61.79 60.72 2wfc h SER 74 Cb 1.19 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.54 2wfc h SER 74 CO 0.12 0.60 -1.09 0.28 -1.14 0.00 0.00 176.83 175.61 2wfc h SER 75 N 1.07 0.37 0.27 3.07 0.02 -1.03 -0.15 113.55 117.17 2wfc h SER 75 Ca 0.39 -0.36 -0.32 0.00 -0.84 0.00 0.00 61.79 60.66 2wfc h SER 75 Cb 0.14 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 2wfc h SER 75 CO -0.16 1.23 -2.01 0.29 -1.14 0.00 0.00 176.83 175.03 2wfc n LYS 76 N -3.58 0.66 0.04 3.45 4.76 -0.62 -4.50 118.16 118.36 2wfc n LYS 76 Ca -0.06 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 2wfc n LYS 76 Cb 0.93 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 2wfc n LYS 76 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2wfc n THR 77 N -2.90 0.80 0.31 -0.18 -1.04 -0.44 -4.78 114.28 106.04 2wfc n THR 77 Ca -0.24 0.26 -0.14 0.00 -2.04 0.00 0.00 64.05 61.89 2wfc n THR 77 Cb 1.09 -1.46 -0.07 0.00 -1.82 0.00 0.00 70.33 68.07 2wfc n THR 77 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2wfc h HIS 78 N 0.00 -0.75 -0.11 -1.42 6.17 -1.38 -1.82 115.15 115.84 2wfc h HIS 78 Ca 0.00 -0.02 -0.02 0.00 0.71 0.00 0.00 60.37 61.05 2wfc h HIS 78 Cb 0.26 0.25 -0.00 0.00 2.52 0.00 0.00 27.41 30.44 2wfc h HIS 78 CO 0.00 -0.42 0.00 1.25 0.71 0.00 0.00 177.93 179.47 2wfc h LEU 79 N -1.13 0.19 -1.63 0.26 5.85 -1.30 -2.93 115.31 114.63 2wfc h LEU 79 Ca -0.08 -0.31 0.07 0.00 0.84 0.00 0.00 57.88 58.40 2wfc h LEU 79 Cb 0.66 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2wfc h LEU 79 CO 0.14 0.45 0.35 -0.65 -0.34 0.00 0.00 178.44 178.39 2wfc h PRO 80 N -0.08 0.44 -0.63 5.25 0.11 -1.78 -1.12 132.00 134.20 2wfc h PRO 80 Ca 0.03 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 66.17 2wfc h PRO 80 Cb 0.35 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 31.31 2wfc h PRO 80 CO 0.01 0.29 0.34 0.78 -0.21 0.00 0.00 178.00 179.20 2wfc h GLY 81 N 0.45 0.91 1.01 -0.55 0.00 -1.14 0.30 103.07 104.05 2wfc h GLY 81 Ca 0.23 -0.23 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2wfc h GLY 81 CO -0.06 0.14 -0.28 -0.97 0.00 0.00 0.00 176.54 175.36 2wfc h TYR 82 N 0.63 0.91 -0.51 5.60 0.05 -1.24 -1.77 116.97 120.63 2wfc h TYR 82 Ca 0.28 -0.26 0.00 0.00 0.05 0.00 0.00 58.73 58.80 2wfc h TYR 82 Cb 0.18 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.70 2wfc h TYR 82 CO -0.09 1.02 0.33 0.28 -1.05 0.00 0.00 178.16 178.66 2wfc h VAL 83 N 0.53 1.14 -0.61 -2.88 2.07 -0.78 -1.17 116.25 114.55 2wfc h VAL 83 Ca 0.06 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 2wfc h VAL 83 Cb 0.85 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2wfc h VAL 83 CO 0.07 0.14 0.11 -0.33 0.02 0.00 0.00 177.57 177.58 2wfc h GLU 84 N 0.69 0.98 -0.41 1.57 5.08 -0.42 -3.11 114.58 118.97 2wfc h GLU 84 Ca 0.19 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2wfc h GLU 84 Cb -0.06 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2wfc h GLU 84 CO -0.04 0.90 0.00 1.04 -1.00 0.00 0.00 179.01 179.91 2wfc n GLN 85 N -4.23 2.25 -0.30 2.33 1.13 -0.67 -4.59 117.38 113.30 2wfc n GLN 85 Ca 0.04 -1.91 -0.02 0.00 -1.94 0.00 0.00 57.00 53.17 2wfc n GLN 85 Cb 0.27 -1.46 0.11 0.00 0.11 0.00 0.00 30.24 29.27 2wfc n GLN 85 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wfc h ALA 86 N 4.22 1.10 -0.56 -1.58 0.00 -1.14 -0.31 119.26 120.99 2wfc h ALA 86 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2wfc h ALA 86 Cb 0.78 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2wfc h ALA 86 CO 0.00 0.35 0.24 0.00 0.00 0.00 0.00 179.25 179.84 2wfc h ALA 87 N 1.35 0.72 -0.41 0.00 0.00 -1.83 0.22 119.26 119.31 2wfc h ALA 87 Ca 0.34 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2wfc h ALA 87 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2wfc h ALA 87 CO -0.12 0.32 -0.13 0.00 0.00 0.00 0.00 179.25 179.32 2wfc h ALA 88 N 1.08 0.57 -0.07 0.00 0.00 -1.65 -1.06 119.26 118.14 2wfc h ALA 88 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2wfc h ALA 88 Cb 0.17 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2wfc h ALA 88 CO -0.02 0.47 0.01 0.82 0.00 0.00 0.00 179.25 180.53 2wfc h ILE 89 N 0.63 1.22 -0.09 0.00 2.04 -0.78 -2.53 117.51 118.00 2wfc h ILE 89 Ca 0.10 -0.68 0.01 0.00 1.00 0.00 0.00 64.86 65.30 2wfc h ILE 89 Cb 0.67 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2wfc h ILE 89 CO 0.05 0.19 0.06 0.45 0.00 0.00 0.00 178.15 178.90 2wfc h HIS 90 N -0.13 0.06 0.00 1.37 3.86 -0.47 -1.42 115.15 118.42 2wfc h HIS 90 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2wfc h HIS 90 Cb 0.29 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.74 2wfc h HIS 90 CO 0.02 0.04 0.00 0.78 0.86 0.00 0.00 177.93 179.63 2wfc h GLY 91 N 0.06 0.00 -1.41 2.45 0.00 -0.75 -2.21 103.07 101.21 2wfc h GLY 91 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2wfc h GLY 91 CO -0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 2wfc n LYS 92 N -2.39 1.93 0.00 4.80 4.76 -0.53 -4.89 118.16 121.84 2wfc n LYS 92 Ca 0.01 -1.44 0.00 0.00 -2.87 0.00 0.00 58.31 54.01 2wfc n LYS 92 Cb 0.22 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 2wfc n LYS 92 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wfc n GLY 93 N 1.17 0.59 3.69 0.72 0.00 -0.83 -5.03 105.19 105.49 2wfc n GLY 93 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2wfc n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wfc s VAL 94 N -2.00 4.06 -0.00 1.61 1.01 -1.23 -4.49 120.40 119.36 2wfc s VAL 94 Ca 0.00 1.41 -0.06 0.00 0.00 0.00 0.00 61.98 63.33 2wfc s VAL 94 Cb 0.00 -3.91 -0.29 0.00 0.00 0.00 0.00 36.38 32.18 2wfc s VAL 94 CO 0.00 0.01 0.84 0.44 0.00 0.00 0.00 175.10 176.39 2wfc h ASP 95 N 7.52 0.49 -3.47 3.32 3.32 -1.22 -3.39 116.42 122.98 2wfc h ASP 95 Ca -0.36 -0.66 -0.26 0.00 0.02 0.00 0.00 57.03 55.77 2wfc h ASP 95 Cb 1.17 -0.16 -0.32 0.00 0.22 0.00 0.00 39.33 40.24 2wfc h ASP 95 CO 0.88 1.55 -0.65 -0.63 -1.72 0.00 0.00 179.24 178.67 2wfc s ILE 96 N -2.61 -0.05 -0.20 0.35 1.01 -1.21 -5.07 121.20 113.42 2wfc s ILE 96 Ca -0.10 0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.71 2wfc s ILE 96 Cb 0.06 -0.18 -0.01 0.00 0.01 0.00 0.00 42.46 42.34 2wfc s ILE 96 CO 0.86 0.08 -0.06 -0.63 0.00 0.00 0.00 174.94 175.20 2wfc s ILE 97 N 1.11 3.38 0.07 2.92 1.01 -1.26 -1.17 121.20 127.27 2wfc s ILE 97 Ca -0.09 -0.50 0.06 0.00 0.00 0.00 0.00 60.65 60.12 2wfc s ILE 97 Cb -0.12 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2wfc s ILE 97 CO -0.05 0.45 -0.17 0.00 0.00 0.00 0.00 174.94 175.18 2wfc s ALA 98 N 1.14 1.40 -0.11 9.38 0.00 0.10 -0.81 121.76 132.86 2wfc s ALA 98 Ca 0.02 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2wfc s ALA 98 Cb -0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 2wfc s ALA 98 CO -0.01 0.26 -0.14 0.00 0.00 0.00 0.00 175.76 175.87 2wfc s MET 100 N 0.15 2.83 -0.04 0.00 0.00 0.48 0.09 119.30 122.80 2wfc s MET 100 Ca -0.07 -0.68 -0.08 0.00 0.00 0.00 0.00 55.69 54.85 2wfc s MET 100 Cb -0.15 -2.48 0.01 0.00 0.00 0.00 0.00 34.83 32.21 2wfc s MET 100 CO 0.05 0.49 0.20 0.00 0.00 0.00 0.00 175.02 175.75 2wfc s ALA 101 N -0.37 -0.48 -1.00 4.11 0.00 -0.84 -1.60 121.76 121.58 2wfc s ALA 101 Ca 0.04 0.30 -0.23 0.00 0.00 0.00 0.00 51.96 52.07 2wfc s ALA 101 Cb -0.12 -0.13 0.05 0.00 0.00 0.00 0.00 23.12 22.91 2wfc s ALA 101 CO 0.02 -0.16 1.45 0.08 0.00 0.00 0.00 175.76 177.15 2wfc s VAL 102 N -0.61 3.91 0.16 0.00 1.01 -1.26 -0.69 120.40 122.92 2wfc s VAL 102 Ca -0.07 -0.70 -0.20 0.00 0.00 0.00 0.00 61.98 61.02 2wfc s VAL 102 Cb -0.04 -5.04 0.05 0.00 0.00 0.00 0.00 36.38 31.35 2wfc s VAL 102 CO 0.01 -1.93 0.53 0.20 0.00 0.00 0.00 175.10 173.92 2wfc s ASN 103 N 4.94 -0.40 0.69 3.32 0.01 -1.25 -4.86 114.94 117.40 2wfc s ASN 103 Ca 0.46 -0.20 -0.11 0.00 -0.71 0.00 0.00 52.86 52.29 2wfc s ASN 103 Cb -0.00 0.56 0.01 0.00 0.41 0.00 0.00 41.25 42.23 2wfc s ASN 103 CO -0.09 -0.96 1.06 1.51 -1.51 0.00 0.00 177.10 177.11 2wfc s ASP 104 N -2.79 5.35 0.30 -1.22 1.47 -1.26 -3.38 116.67 115.14 2wfc s ASP 104 Ca 0.03 1.65 0.02 0.00 1.18 0.00 0.00 52.55 55.43 2wfc s ASP 104 Cb -0.00 -2.50 0.57 0.00 -0.34 0.00 0.00 42.92 40.65 2wfc s ASP 104 CO -0.10 -1.46 1.87 0.77 0.68 0.00 0.00 175.17 176.93 2wfc h SER 105 N -0.66 0.89 -0.38 2.11 4.64 -1.88 -1.83 113.55 116.44 2wfc h SER 105 Ca -0.44 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2wfc h SER 105 Cb 1.21 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2wfc h SER 105 CO 0.56 0.52 0.22 -0.26 -0.87 0.00 0.00 176.83 177.01 2wfc h PHE 106 N 0.98 0.51 -0.30 4.77 0.04 -1.86 -0.62 116.94 120.45 2wfc h PHE 106 Ca 0.44 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.17 2wfc h PHE 106 Cb 0.38 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 2wfc h PHE 106 CO -0.00 0.37 0.04 0.28 -0.60 0.00 0.00 178.31 178.39 2wfc h VAL 107 N 0.49 1.24 -0.40 -0.55 2.07 -1.87 -2.43 116.25 114.81 2wfc h VAL 107 Ca 0.14 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.85 2wfc h VAL 107 Cb 0.02 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2wfc h VAL 107 CO -0.02 0.27 0.21 -0.03 0.02 0.00 0.00 177.57 178.02 2wfc h MET 108 N 0.31 0.42 -0.41 1.57 1.85 -1.16 -0.36 114.93 117.15 2wfc h MET 108 Ca 0.09 -0.03 -0.06 0.00 -0.61 0.00 0.00 59.70 59.10 2wfc h MET 108 Cb 0.36 -0.09 -0.02 0.00 0.43 0.00 0.00 31.60 32.28 2wfc h MET 108 CO 0.01 0.28 0.03 0.22 -0.40 0.00 0.00 176.91 177.05 2wfc h ASP 109 N 0.43 0.68 -1.00 1.39 3.58 -1.12 -1.15 116.42 119.24 2wfc h ASP 109 Ca 0.16 -0.29 0.02 0.00 0.42 0.00 0.00 57.03 57.35 2wfc h ASP 109 Cb 0.05 -0.18 -0.05 0.00 1.72 0.00 0.00 39.33 40.86 2wfc h ASP 109 CO -0.10 0.80 0.66 0.00 -2.88 0.00 0.00 179.24 177.72 2wfc h ALA 110 N 0.91 1.31 -0.22 -0.78 0.00 -1.16 -2.19 119.26 117.13 2wfc h ALA 110 Ca 0.12 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2wfc h ALA 110 Cb 0.43 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2wfc h ALA 110 CO 0.01 0.61 -0.12 2.35 0.00 0.00 0.00 179.25 182.11 2wfc h TRP 111 N 1.32 0.55 -0.68 0.00 7.01 -0.33 -1.66 115.95 122.15 2wfc h TRP 111 Ca 0.38 -0.14 0.13 0.00 2.11 0.00 0.00 58.89 61.37 2wfc h TRP 111 Cb -0.08 -0.12 -0.09 0.00 -2.10 0.00 0.00 29.16 26.76 2wfc h TRP 111 CO -0.00 0.76 0.22 0.78 -2.79 0.00 0.00 178.44 177.40 2wfc h GLY 112 N 0.18 0.97 1.56 2.65 0.00 -1.03 -2.18 103.07 105.22 2wfc h GLY 112 Ca 0.05 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 2wfc h GLY 112 CO 0.03 -0.11 -0.03 0.50 0.00 0.00 0.00 176.54 176.93 2wfc h LYS 113 N 0.35 0.54 0.00 4.80 1.57 -1.05 -1.43 116.57 121.35 2wfc h LYS 113 Ca 0.37 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 2wfc h LYS 113 Cb 0.56 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 2wfc h LYS 113 CO -0.41 0.59 -0.06 0.00 -0.57 0.00 0.00 179.45 179.00 2wfc h ALA 114 N 1.46 1.52 -0.16 3.86 0.00 -0.67 -2.83 119.26 122.43 2wfc h ALA 114 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wfc h ALA 114 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2wfc h ALA 114 CO 0.02 0.08 0.00 0.72 0.00 0.00 0.00 179.25 180.06 2wfc n HIS 115 N -3.92 0.52 -3.71 0.00 8.25 -0.81 -5.00 115.22 110.55 2wfc n HIS 115 Ca -0.03 -0.86 -0.25 0.00 -0.26 0.00 0.00 57.72 56.33 2wfc n HIS 115 Cb 0.15 -0.22 0.05 0.00 1.12 0.00 0.00 29.99 31.10 2wfc n HIS 115 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wfc n GLY 116 N -0.74 -0.45 0.25 -1.41 0.00 -0.77 -4.90 105.19 97.16 2wfc n GLY 116 Ca 0.17 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.51 2wfc n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wfc h ALA 117 N 0.95 1.01 -0.54 4.61 0.00 -1.57 -3.46 119.26 120.26 2wfc h ALA 117 Ca -0.59 -0.10 -0.62 0.00 0.00 0.00 0.00 54.91 53.60 2wfc h ALA 117 Cb 1.37 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2wfc h ALA 117 CO 0.59 0.14 0.63 -3.47 0.00 0.00 0.00 179.25 177.14 2wfc n ASP 118 N -3.23 0.80 0.00 0.00 2.03 -1.26 -0.63 116.55 114.25 2wfc n ASP 118 Ca 0.01 0.77 0.00 0.00 0.52 0.00 0.00 54.79 56.09 2wfc n ASP 118 Cb 0.39 -0.65 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 2wfc n ASP 118 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2wfc n ASP 119 N 3.61 0.00 -0.07 1.67 8.00 -1.26 -4.78 116.55 123.71 2wfc n ASP 119 Ca 0.27 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.64 2wfc n ASP 119 Cb -0.04 -0.65 -0.06 0.00 -0.02 0.00 0.00 41.12 40.35 2wfc n ASP 119 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wfc n LYS 120 N -2.00 0.32 -3.86 -1.24 5.02 0.20 -5.00 118.16 111.60 2wfc n LYS 120 Ca 0.00 0.12 -0.23 0.00 -2.02 0.00 0.00 58.31 56.18 2wfc n LYS 120 Cb 0.00 -1.11 -0.17 0.00 -0.02 0.00 0.00 35.03 33.72 2wfc n LYS 120 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wfc s VAL 121 N -2.27 0.52 -0.03 -0.18 1.01 -0.63 -4.45 120.40 114.36 2wfc s VAL 121 Ca -0.20 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2wfc s VAL 121 Cb 0.07 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 2wfc s VAL 121 CO 0.28 0.27 1.04 -1.10 0.00 0.00 0.00 175.10 175.59 2wfc s GLN 122 N 1.75 4.48 -0.25 2.72 -0.21 0.01 -4.59 119.66 123.57 2wfc s GLN 122 Ca 0.02 1.47 -0.12 0.00 0.02 0.00 0.00 55.36 56.76 2wfc s GLN 122 Cb -0.13 -3.48 -0.05 0.00 1.00 0.00 0.00 33.01 30.35 2wfc s GLN 122 CO -0.05 -0.20 0.21 -1.64 -2.12 0.00 0.00 175.29 171.49 2wfc s MET 123 N 1.47 4.05 -0.15 2.91 -1.94 -1.26 -0.72 119.30 123.66 2wfc s MET 123 Ca 0.52 -0.21 0.02 0.00 -1.71 0.00 0.00 55.69 54.31 2wfc s MET 123 Cb -0.21 -3.58 0.00 0.00 2.01 0.00 0.00 34.83 33.06 2wfc s MET 123 CO 0.24 -0.03 -0.19 -0.51 -0.01 0.00 0.00 175.02 174.52 2wfc s LEU 124 N 1.32 2.27 -0.16 -0.03 1.43 0.11 -4.55 118.68 119.08 2wfc s LEU 124 Ca 0.09 -0.55 -0.10 0.00 -1.03 0.00 0.00 54.13 52.55 2wfc s LEU 124 Cb -0.14 -1.50 -0.05 0.00 0.03 0.00 0.00 46.19 44.53 2wfc s LEU 124 CO 0.07 0.08 0.18 0.00 0.23 0.00 0.00 176.35 176.91 2wfc s ALA 125 N 0.82 3.74 -0.64 4.21 0.00 0.09 -1.99 121.76 127.98 2wfc s ALA 125 Ca -0.06 -0.61 0.06 0.00 0.00 0.00 0.00 51.96 51.35 2wfc s ALA 125 Cb -0.15 -2.15 0.21 0.00 0.00 0.00 0.00 23.12 21.03 2wfc s ALA 125 CO -0.01 0.32 0.61 -3.47 0.00 0.00 0.00 175.76 173.21 2wfc n ASP 126 N 2.92 3.02 -0.12 0.00 2.03 0.14 -0.97 116.55 123.56 2wfc n ASP 126 Ca -0.17 -3.25 -0.08 0.00 0.52 0.00 0.00 54.79 51.82 2wfc n ASP 126 Cb 0.53 -0.70 0.08 0.00 -0.72 0.00 0.00 41.12 40.31 2wfc n ASP 126 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wfc h PRO 127 N 4.71 0.86 -0.34 -0.67 0.11 -1.81 -1.81 132.00 133.06 2wfc h PRO 127 Ca 0.18 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2wfc h PRO 127 Cb 0.72 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.78 2wfc h PRO 127 CO 0.74 0.96 0.00 0.41 -0.21 0.00 0.00 178.00 179.90 2wfc n GLY 128 N -0.30 1.09 2.23 -0.55 0.00 -1.26 -4.58 105.19 101.81 2wfc n GLY 128 Ca 0.01 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 2wfc n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wfc n GLY 129 N 1.31 0.63 0.31 -0.02 0.00 -0.68 -4.94 105.19 101.80 2wfc n GLY 129 Ca 0.17 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 2wfc n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wfc h ALA 130 N 0.19 0.85 -0.27 4.61 0.00 -1.93 -0.15 119.26 122.56 2wfc h ALA 130 Ca -0.20 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 2wfc h ALA 130 Cb 0.84 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2wfc h ALA 130 CO 0.27 0.67 -0.11 0.35 0.00 0.00 0.00 179.25 180.43 2wfc h PHE 131 N 0.96 0.63 -0.58 0.00 3.57 -1.91 -1.51 116.94 118.10 2wfc h PHE 131 Ca 0.17 -0.15 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2wfc h PHE 131 Cb 0.56 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 2wfc h PHE 131 CO 0.04 0.79 0.22 1.15 -2.23 0.00 0.00 178.31 178.28 2wfc h THR 132 N 0.30 1.21 -0.31 4.41 2.02 -1.88 -0.04 112.91 118.62 2wfc h THR 132 Ca 0.06 -0.67 -0.11 0.00 0.77 0.00 0.00 66.41 66.46 2wfc h THR 132 Cb 0.61 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2wfc h THR 132 CO 0.04 0.27 -0.22 0.50 0.37 0.00 0.00 175.52 176.47 2wfc h LYS 133 N 0.84 0.69 -0.31 6.66 3.64 -1.00 -0.71 116.57 126.38 2wfc h LYS 133 Ca 0.20 -0.33 -0.10 0.00 -1.27 0.00 0.00 60.65 59.14 2wfc h LYS 133 Cb 0.18 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2wfc h LYS 133 CO -0.02 0.94 -0.23 0.00 -2.27 0.00 0.00 179.45 177.87 2wfc h ALA 134 N 0.74 1.02 -0.02 5.00 0.00 -0.29 -1.98 119.26 123.72 2wfc h ALA 134 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2wfc h ALA 134 Cb 0.77 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2wfc h ALA 134 CO 0.06 0.59 0.00 1.33 0.00 0.00 0.00 179.25 181.22 2wfc n VAL 135 N -4.12 0.02 -3.47 0.00 0.24 -0.12 -4.96 118.33 105.93 2wfc n VAL 135 Ca -0.00 -0.12 -0.18 0.00 -2.04 0.00 0.00 64.34 62.00 2wfc n VAL 135 Cb 0.41 -0.04 0.08 0.00 -1.47 0.00 0.00 33.84 32.82 2wfc n VAL 135 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2wfc n ASP 136 N -0.42 -2.41 -1.19 -1.34 2.03 -0.65 -1.58 116.55 110.99 2wfc n ASP 136 Ca 0.20 -0.68 -0.02 0.00 0.52 0.00 0.00 54.79 54.82 2wfc n ASP 136 Cb 0.21 -4.90 0.13 0.00 -0.72 0.00 0.00 41.12 35.84 2wfc n ASP 136 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2wfc n MET 137 N -4.06 1.85 -2.51 -0.67 2.81 -0.37 -3.73 117.12 110.44 2wfc n MET 137 Ca -0.27 -3.34 -0.39 0.00 -1.81 0.00 0.00 57.70 51.90 2wfc n MET 137 Cb 0.67 -1.55 -0.04 0.00 -0.71 0.00 0.00 33.22 31.59 2wfc n MET 137 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2wfc s GLU 138 N -2.90 4.45 0.12 0.03 2.02 -1.26 -0.57 118.70 120.59 2wfc s GLU 138 Ca 0.40 1.68 -0.05 0.00 0.02 0.00 0.00 54.97 57.01 2wfc s GLU 138 Cb 0.38 -2.93 -0.05 0.00 0.10 0.00 0.00 34.13 31.62 2wfc s GLU 138 CO -0.06 0.08 0.36 -1.17 0.02 0.00 0.00 175.26 174.49 2wfc s LEU 139 N -1.92 4.29 0.28 1.80 2.96 0.26 -4.63 118.68 121.72 2wfc s LEU 139 Ca 0.50 0.60 -0.27 0.00 -0.22 0.00 0.00 54.13 54.73 2wfc s LEU 139 Cb -0.28 -3.20 -0.15 0.00 0.50 0.00 0.00 46.19 43.07 2wfc s LEU 139 CO 0.35 0.09 0.81 0.47 -1.32 0.00 0.00 176.35 176.75 2wfc n ASP 140 N 0.29 0.28 -4.56 3.68 9.92 -1.26 -4.38 116.55 120.52 2wfc n ASP 140 Ca -0.04 1.13 -0.39 0.00 -0.53 0.00 0.00 54.79 54.96 2wfc n ASP 140 Cb 0.52 -1.17 0.04 0.00 -0.64 0.00 0.00 41.12 39.87 2wfc n ASP 140 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 2wfc n LEU 141 N 1.45 2.34 -4.34 0.64 7.94 -1.26 -4.81 117.00 118.97 2wfc n LEU 141 Ca 0.12 0.82 -0.35 0.00 -1.11 0.00 0.00 56.01 55.49 2wfc n LEU 141 Cb 0.31 -1.30 -0.14 0.00 0.53 0.00 0.00 43.42 42.83 2wfc n LEU 141 CO 0.58 -2.26 -0.37 -0.94 -1.11 0.00 0.00 177.39 173.29 2wfc s SER 142 N -1.13 4.43 0.07 1.96 1.04 -1.26 -4.97 113.70 113.84 2wfc s SER 142 Ca 0.71 -0.36 -0.17 0.00 0.48 0.00 0.00 55.95 56.61 2wfc s SER 142 Cb -0.46 -1.76 -0.12 0.00 0.10 0.00 0.00 66.02 63.78 2wfc s SER 142 CO 0.52 -0.01 1.36 0.00 0.98 0.00 0.00 173.24 176.08 2wfc h ALA 143 N 8.08 0.31 -0.04 5.32 0.00 -1.94 -1.98 119.26 129.01 2wfc h ALA 143 Ca -0.41 -0.40 -0.20 0.00 0.00 0.00 0.00 54.91 53.91 2wfc h ALA 143 Cb 1.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2wfc h ALA 143 CO 0.60 0.32 -0.81 -0.39 0.00 0.00 0.00 179.25 178.97 2wfc h VAL 144 N 0.23 1.40 0.00 0.00 -1.51 -1.99 -3.26 116.25 111.12 2wfc h VAL 144 Ca 0.02 -2.30 0.00 0.00 -1.23 0.00 0.00 66.70 63.19 2wfc h VAL 144 Cb 0.86 2.25 0.00 0.00 -2.13 0.00 0.00 31.29 32.27 2wfc h VAL 144 CO 0.07 0.69 -1.28 0.18 -1.23 0.00 0.00 177.57 176.00 2wfc n LEU 145 N -3.78 0.53 0.00 4.19 4.77 -1.25 -5.01 117.00 116.44 2wfc n LEU 145 Ca -0.05 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2wfc n LEU 145 Cb 0.76 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2wfc n LEU 145 CO 0.49 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2wfc n GLY 146 N 1.29 2.05 3.98 -0.72 0.00 -0.74 -4.92 105.19 106.13 2wfc n GLY 146 Ca -0.00 -0.40 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 2wfc n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wfc s ASN 147 N -1.87 5.88 0.26 1.61 4.22 -1.26 -4.56 114.94 119.22 2wfc s ASN 147 Ca 0.00 -0.10 -0.31 0.00 -2.14 0.00 0.00 52.86 50.31 2wfc s ASN 147 Cb 0.00 -1.23 -0.12 0.00 1.28 0.00 0.00 41.25 41.18 2wfc s ASN 147 CO 0.00 -0.55 1.62 0.52 -2.04 0.00 0.00 177.10 176.65 2wfc n VAL 148 N -1.79 0.72 -4.23 3.54 0.31 -1.26 -4.51 118.33 111.11 2wfc n VAL 148 Ca 0.01 -0.18 -0.10 0.00 -0.01 0.00 0.00 64.34 64.06 2wfc n VAL 148 Cb 0.58 -1.92 -0.02 0.00 -0.91 0.00 0.00 33.84 31.56 2wfc n VAL 148 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2wfc n ARG 149 N 2.65 1.36 -3.41 5.55 5.12 -1.26 -4.93 116.66 121.75 2wfc n ARG 149 Ca 0.11 -1.22 -0.35 0.00 -1.93 0.00 0.00 57.85 54.46 2wfc n ARG 149 Cb 0.36 0.42 -0.06 0.00 -1.16 0.00 0.00 32.46 32.02 2wfc n ARG 149 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2wfc s SER 150 N -1.91 6.79 0.80 0.55 0.15 -1.26 -0.57 113.70 118.25 2wfc s SER 150 Ca 0.02 1.01 -0.12 0.00 0.70 0.00 0.00 55.95 57.56 2wfc s SER 150 Cb 0.00 -2.26 0.08 0.00 -1.71 0.00 0.00 66.02 62.13 2wfc s SER 150 CO 0.01 0.13 1.15 -0.54 1.20 0.00 0.00 173.24 175.19 2wfc s LYS 151 N -1.91 1.80 -0.12 5.44 1.02 0.26 -3.62 119.74 122.61 2wfc s LYS 151 Ca 0.36 1.53 -0.28 0.00 0.02 0.00 0.00 55.97 57.60 2wfc s LYS 151 Cb -0.15 -1.82 -0.01 0.00 -0.52 0.00 0.00 37.83 35.33 2wfc s LYS 151 CO 0.19 -2.04 0.95 0.50 -0.92 0.00 0.00 175.35 174.02 2wfc s ARG 152 N -4.41 4.39 0.22 1.68 3.52 0.29 -4.37 118.95 120.28 2wfc s ARG 152 Ca 0.68 1.27 -0.16 0.00 -0.13 0.00 0.00 55.73 57.40 2wfc s ARG 152 Cb -0.24 -3.54 0.01 0.00 -1.56 0.00 0.00 34.95 29.62 2wfc s ARG 152 CO 0.52 -0.30 0.52 1.52 -0.81 0.00 0.00 175.30 176.75 2wfc s TYR 153 N 1.97 0.07 0.03 5.12 -0.85 -1.15 -2.16 117.35 120.39 2wfc s TYR 153 Ca 0.45 -0.44 0.02 0.00 -0.52 0.00 0.00 57.07 56.58 2wfc s TYR 153 Cb -0.18 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.48 2wfc s TYR 153 CO 0.17 -0.97 -0.06 -1.54 -1.52 0.00 0.00 175.55 171.62 2wfc s SER 154 N -2.94 0.70 0.06 -0.18 1.04 -0.11 -0.68 113.70 111.58 2wfc s SER 154 Ca 0.15 -0.45 0.05 0.00 0.48 0.00 0.00 55.95 56.17 2wfc s SER 154 Cb -0.01 0.03 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 2wfc s SER 154 CO 0.03 -0.17 -0.14 -0.76 0.98 0.00 0.00 173.24 173.18 2wfc s LEU 155 N -1.28 2.23 -0.13 2.42 1.43 0.13 -0.33 118.68 123.14 2wfc s LEU 155 Ca -0.09 -0.54 -0.06 0.00 -1.03 0.00 0.00 54.13 52.42 2wfc s LEU 155 Cb -0.08 -0.57 -0.04 0.00 0.03 0.00 0.00 46.19 45.53 2wfc s LEU 155 CO 0.00 -0.02 0.07 -0.69 0.23 0.00 0.00 176.35 175.94 2wfc s VAL 156 N -1.06 4.87 -0.02 -1.59 1.01 -0.70 -1.41 120.40 121.49 2wfc s VAL 156 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.00 2wfc s VAL 156 Cb -0.09 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 2wfc s VAL 156 CO 0.02 0.56 -0.15 -0.63 0.00 0.00 0.00 175.10 174.89 2wfc s ILE 157 N -0.46 1.24 -0.13 2.22 1.01 0.07 -0.20 121.20 124.95 2wfc s ILE 157 Ca 0.10 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.10 2wfc s ILE 157 Cb -0.12 -1.05 0.03 0.00 0.01 0.00 0.00 42.46 41.34 2wfc s ILE 157 CO 0.02 0.36 -0.06 -1.61 0.00 0.00 0.00 174.94 173.65 2wfc s GLU 158 N -0.20 1.39 -1.31 2.79 2.02 0.18 -0.00 118.70 123.57 2wfc s GLU 158 Ca 0.03 -0.30 -0.02 0.00 0.02 0.00 0.00 54.97 54.70 2wfc s GLU 158 Cb -0.08 -1.66 0.01 0.00 0.10 0.00 0.00 34.13 32.50 2wfc s GLU 158 CO 0.00 -0.33 0.81 -3.47 0.02 0.00 0.00 175.26 172.30 2wfc n ASP 159 N 4.95 -1.89 0.00 -0.19 2.03 0.25 -1.06 116.55 120.65 2wfc n ASP 159 Ca -0.12 -0.76 0.00 0.00 0.52 0.00 0.00 54.79 54.43 2wfc n ASP 159 Cb 0.49 -4.32 0.00 0.00 -0.72 0.00 0.00 41.12 36.57 2wfc n ASP 159 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wfc n GLY 160 N -1.50 0.18 3.64 0.27 0.00 -0.88 -4.73 105.19 102.17 2wfc n GLY 160 Ca -0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2wfc n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wfc s VAL 161 N -1.45 4.58 -0.10 1.61 1.01 -0.22 -0.84 120.40 124.99 2wfc s VAL 161 Ca 0.00 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 2wfc s VAL 161 Cb 0.00 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 2wfc s VAL 161 CO 0.00 0.51 1.25 -0.69 0.00 0.00 0.00 175.10 176.17 2wfc s VAL 162 N -0.04 4.22 -0.29 2.92 1.01 0.00 -0.65 120.40 127.57 2wfc s VAL 162 Ca 0.05 1.52 0.09 0.00 0.00 0.00 0.00 61.98 63.64 2wfc s VAL 162 Cb -0.12 -3.98 -0.12 0.00 0.00 0.00 0.00 36.38 32.16 2wfc s VAL 162 CO 0.01 -0.06 0.33 0.35 0.00 0.00 0.00 175.10 175.74 2wfc n THR 163 N 4.96 0.00 -3.76 3.92 -2.24 0.73 -0.07 114.28 117.81 2wfc n THR 163 Ca 0.12 -0.26 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 2wfc n THR 163 Cb 0.45 0.75 -0.12 0.00 -2.10 0.00 0.00 70.33 69.31 2wfc n THR 163 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wfc s LYS 164 N -2.16 0.28 -0.14 -0.78 -0.14 -1.12 -4.91 119.74 110.77 2wfc s LYS 164 Ca 0.01 0.46 0.02 0.00 -1.36 0.00 0.00 55.97 55.10 2wfc s LYS 164 Cb 0.07 0.04 0.01 0.00 -1.68 0.00 0.00 37.83 36.27 2wfc s LYS 164 CO 0.39 -0.09 -0.20 0.08 -0.76 0.00 0.00 175.35 174.76 2wfc s VAL 165 N 0.65 1.95 -0.35 3.17 1.01 -1.26 -1.72 120.40 123.85 2wfc s VAL 165 Ca -0.04 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.06 2wfc s VAL 165 Cb -0.05 -1.74 0.10 0.00 0.00 0.00 0.00 36.38 34.69 2wfc s VAL 165 CO -0.04 0.53 0.08 0.20 0.00 0.00 0.00 175.10 175.87 2wfc s ASN 166 N 0.95 4.49 -0.12 3.32 0.02 0.55 -5.01 114.94 119.14 2wfc s ASN 166 Ca -0.04 -2.09 -0.03 0.00 -1.02 0.00 0.00 52.86 49.68 2wfc s ASN 166 Cb -0.15 -1.39 -0.03 0.00 0.02 0.00 0.00 41.25 39.70 2wfc s ASN 166 CO -0.04 -0.38 0.00 0.54 0.02 0.00 0.00 177.10 177.25 2wfc s VAL 167 N 1.00 4.31 0.26 1.60 0.11 -1.26 -0.94 120.40 125.48 2wfc s VAL 167 Ca 0.11 -0.23 -0.31 0.00 -2.93 0.00 0.00 61.98 58.63 2wfc s VAL 167 Cb -0.19 -2.86 -0.11 0.00 -1.53 0.00 0.00 36.38 31.69 2wfc s VAL 167 CO -0.12 0.55 1.62 -1.61 -3.33 0.00 0.00 175.10 172.21 2wfc s GLU 168 N -0.35 4.14 0.45 1.54 0.41 -0.92 -4.89 118.70 119.08 2wfc s GLU 168 Ca 0.07 2.56 0.12 0.00 -0.41 0.00 0.00 54.97 57.31 2wfc s GLU 168 Cb -0.12 -3.05 1.02 0.00 -1.78 0.00 0.00 34.13 30.20 2wfc s GLU 168 CO 0.02 -0.65 2.05 -1.35 -0.49 0.00 0.00 175.26 174.84 2wfc h PRO 169 N 5.46 0.16 -0.61 0.39 0.11 -1.96 -1.18 132.00 134.37 2wfc h PRO 169 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wfc h PRO 169 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wfc h PRO 169 CO 0.84 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.43 2wfc n ASP 170 N -4.42 3.64 0.00 -2.05 5.75 -1.26 -4.98 116.55 113.23 2wfc n ASP 170 Ca -0.01 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 2wfc n ASP 170 Cb 0.16 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 2wfc n ASP 170 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wfc n GLY 171 N 1.29 2.90 0.00 6.12 0.00 -0.45 -4.68 105.19 110.37 2wfc n GLY 171 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2wfc n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wfc n LYS 172 N -2.00 0.89 -0.45 1.61 5.02 -1.26 -0.55 118.16 121.42 2wfc n LYS 172 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 2wfc n LYS 172 Cb 0.00 -0.55 0.09 0.00 -0.02 0.00 0.00 35.03 34.54 2wfc n LYS 172 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wfc n GLY 173 N 0.72 -2.28 2.68 0.72 0.00 -1.26 -4.94 105.19 100.84 2wfc n GLY 173 Ca 0.00 -1.51 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 2wfc n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wfc s LEU 174 N 0.00 3.31 0.00 0.99 1.43 -1.26 -4.95 118.68 118.21 2wfc s LEU 174 Ca 0.26 -3.47 0.00 0.00 -1.03 0.00 0.00 54.13 49.89 2wfc s LEU 174 Cb -0.02 -1.11 0.00 0.00 0.03 0.00 0.00 46.19 45.09 2wfc s LEU 174 CO 0.20 -0.13 0.00 0.35 0.23 0.00 0.00 176.35 177.00 2wfc n THR 175 N 2.41 0.00 0.37 5.49 -2.24 -1.26 -4.95 114.28 114.10 2wfc n THR 175 Ca 0.23 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.15 2wfc n THR 175 Cb 0.40 0.00 0.55 0.00 -2.10 0.00 0.00 70.33 69.18 2wfc n THR 175 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wfc n SER 177 N -2.48 1.21 -4.83 0.00 3.41 -1.26 -4.70 113.62 104.96 2wfc n SER 177 Ca 0.02 -1.28 -0.32 0.00 -0.26 0.00 0.00 58.87 57.02 2wfc n SER 177 Cb 0.25 0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.20 2wfc n SER 177 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2wfc s LEU 178 N -2.12 3.60 0.26 1.04 1.43 -0.95 -4.51 118.68 117.43 2wfc s LEU 178 Ca 0.36 1.66 -0.01 0.00 -1.03 0.00 0.00 54.13 55.10 2wfc s LEU 178 Cb 0.21 -4.52 0.55 0.00 0.03 0.00 0.00 46.19 42.46 2wfc s LEU 178 CO 0.38 -0.75 1.73 0.00 0.23 0.00 0.00 176.35 177.93 2wfc h ALA 179 N 0.83 1.22 -0.24 4.21 0.00 -1.86 -2.19 119.26 121.23 2wfc h ALA 179 Ca -0.47 0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.59 2wfc h ALA 179 Cb 1.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2wfc h ALA 179 CO 0.60 -0.22 0.16 -1.35 0.00 0.00 0.00 179.25 178.45 2wfc h PRO 180 N 0.47 0.20 -0.37 0.00 0.11 -1.94 -1.40 132.00 129.07 2wfc h PRO 180 Ca 0.47 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.43 2wfc h PRO 180 Cb 0.76 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 2wfc h PRO 180 CO -0.43 0.13 -0.30 -0.97 -0.21 0.00 0.00 178.00 176.22 2wfc h ASN 181 N 0.20 0.90 -0.50 -2.05 -1.24 -1.69 -1.79 115.58 109.41 2wfc h ASN 181 Ca 0.10 -0.45 -0.11 0.00 0.71 0.00 0.00 56.30 56.55 2wfc h ASN 181 Cb 0.15 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.93 2wfc h ASN 181 CO -0.02 1.16 -0.09 0.40 -1.29 0.00 0.00 177.43 177.59 2wfc h ILE 182 N 0.65 1.27 -0.30 2.57 1.08 -1.45 -1.44 117.51 119.89 2wfc h ILE 182 Ca 0.07 -1.23 -0.00 0.00 -0.39 0.00 0.00 64.86 63.30 2wfc h ILE 182 Cb 0.88 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 2wfc h ILE 182 CO 0.08 0.43 0.17 0.25 -0.69 0.00 0.00 178.15 178.39 2wfc h LEU 183 N 0.87 0.36 -0.67 1.44 6.46 -1.14 0.61 115.31 123.25 2wfc h LEU 183 Ca 0.14 -0.07 -0.05 0.00 -0.12 0.00 0.00 57.88 57.78 2wfc h LEU 183 Cb 0.64 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 2wfc h LEU 183 CO 0.04 0.33 0.23 0.77 -0.62 0.00 0.00 178.44 179.19 2wfc h SER 184 N 0.37 0.96 -0.48 1.25 4.64 -1.08 -1.24 113.55 117.98 2wfc h SER 184 Ca 0.10 -0.20 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 2wfc h SER 184 Cb 0.04 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 2wfc h SER 184 CO -0.02 0.90 0.19 1.56 -0.87 0.00 0.00 176.83 178.60 2wfc h GLN 185 N 0.97 0.77 0.00 4.77 4.20 -0.89 -2.13 115.11 122.80 2wfc h GLN 185 Ca 0.22 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 2wfc h GLN 185 Cb 0.27 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 2wfc h GLN 185 CO -0.01 0.65 -0.42 -0.07 -0.67 0.00 0.00 178.83 178.31 2wfc h LEU 186 N 0.76 0.00 -1.54 1.46 3.38 -0.57 -3.51 115.31 115.28 2wfc h LEU 186 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2wfc h LEU 186 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2wfc h LEU 186 CO -0.01 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.54