#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wv7 s VAL 17 N 0.00 3.00 -0.59 1.39 1.01 -0.23 -3.67 120.40 121.32 1wv7 s VAL 17 Ca 0.00 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 1wv7 s VAL 17 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1wv7 s VAL 17 CO 0.00 0.46 0.01 0.61 0.00 0.00 0.00 175.10 176.18 1wv7 n GLY 18 N 4.71 0.10 0.00 4.51 0.00 -1.24 -2.46 105.19 110.81 1wv7 n GLY 18 Ca -0.19 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1wv7 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wv7 n GLY 19 N -1.01 3.95 3.31 -0.02 0.00 -1.26 -4.85 105.19 105.31 1wv7 n GLY 19 Ca -0.08 -1.86 -0.09 0.00 0.00 0.00 0.00 46.02 43.99 1wv7 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wv7 s LYS 20 N 2.70 1.06 0.17 1.61 1.02 -0.88 -4.98 119.74 120.45 1wv7 s LYS 20 Ca 0.00 -0.97 -0.31 0.00 0.02 0.00 0.00 55.97 54.71 1wv7 s LYS 20 Cb 0.00 0.40 -0.09 0.00 -0.52 0.00 0.00 37.83 37.62 1wv7 s LYS 20 CO 0.00 -0.39 1.47 0.08 -0.92 0.00 0.00 175.35 175.59 1wv7 s VAL 21 N -3.89 2.87 -0.22 3.17 1.01 -1.26 0.08 120.40 122.16 1wv7 s VAL 21 Ca 0.09 0.65 -0.29 0.00 0.00 0.00 0.00 61.98 62.43 1wv7 s VAL 21 Cb 0.03 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 1wv7 s VAL 21 CO -0.06 0.06 1.19 0.00 0.00 0.00 0.00 175.10 176.29 1wv7 n PRO 23 N 6.65 1.48 -1.68 0.00 -0.02 -1.26 -4.73 135.00 135.44 1wv7 n PRO 23 Ca 0.13 0.53 -0.54 0.00 -2.02 0.00 0.00 63.50 61.59 1wv7 n PRO 23 Cb 0.46 -2.04 -0.07 0.00 -0.02 0.00 0.00 33.50 31.83 1wv7 n PRO 23 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1wv7 n LYS 24 N 0.35 1.43 0.00 -0.52 4.81 -1.26 -0.89 118.16 122.08 1wv7 n LYS 24 Ca 0.09 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 1wv7 n LYS 24 Cb 0.37 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.13 1wv7 n LYS 24 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wv7 n GLY 25 N 4.51 0.57 0.63 3.14 0.00 -1.26 -4.94 105.19 107.84 1wv7 n GLY 25 Ca 0.27 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.41 1wv7 n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wv7 n GLU 26 N -2.00 1.84 -2.65 1.61 1.02 -0.07 -3.85 120.64 116.54 1wv7 n GLU 26 Ca 0.00 -1.26 -0.10 0.00 -0.02 0.00 0.00 57.16 55.78 1wv7 n GLU 26 Cb 0.00 -1.43 0.03 0.00 -0.02 0.00 0.00 31.44 30.02 1wv7 n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wv7 n PRO 28 N -0.16 0.05 0.00 0.00 -0.04 -1.25 -1.63 135.00 131.97 1wv7 n PRO 28 Ca 0.12 0.47 0.09 0.00 -0.04 0.00 0.00 63.50 64.14 1wv7 n PRO 28 Cb 0.80 -1.79 0.03 0.00 -0.04 0.00 0.00 33.50 32.50 1wv7 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1wv7 n TRP 29 N -1.69 0.00 -2.02 0.54 2.14 -1.16 -1.94 117.44 113.31 1wv7 n TRP 29 Ca -0.00 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.15 1wv7 n TRP 29 Cb 0.15 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.63 1wv7 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1wv7 s GLN 30 N -1.83 4.27 -0.00 -2.67 2.00 -0.65 -1.68 119.66 119.09 1wv7 s GLN 30 Ca 0.17 2.29 0.06 0.00 -2.00 0.00 0.00 55.36 55.87 1wv7 s GLN 30 Cb 0.14 -3.13 -0.03 0.00 0.80 0.00 0.00 33.01 30.80 1wv7 s GLN 30 CO 0.36 -0.44 -0.17 0.08 -0.50 0.00 0.00 175.29 174.62 1wv7 s VAL 31 N 0.22 2.81 -0.20 1.34 1.01 -0.05 -4.44 120.40 121.09 1wv7 s VAL 31 Ca 0.61 -0.99 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 1wv7 s VAL 31 Cb -0.42 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 1wv7 s VAL 31 CO 0.41 0.47 0.04 -0.22 0.00 0.00 0.00 175.10 175.79 1wv7 s LEU 32 N -1.06 3.51 -0.17 3.92 2.96 -0.14 -1.53 118.68 126.17 1wv7 s LEU 32 Ca 0.13 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.89 1wv7 s LEU 32 Cb -0.10 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1wv7 s LEU 32 CO 0.03 0.10 0.03 -0.76 -1.32 0.00 0.00 176.35 174.42 1wv7 s LEU 33 N 0.83 3.61 0.14 -0.68 1.43 0.13 -0.21 118.68 123.93 1wv7 s LEU 33 Ca 0.02 0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 1wv7 s LEU 33 Cb -0.14 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1wv7 s LEU 33 CO 0.02 0.18 -0.22 -0.76 0.23 0.00 0.00 176.35 175.80 1wv7 s LEU 34 N 0.34 2.37 -0.10 1.79 1.43 0.31 -0.41 118.68 124.41 1wv7 s LEU 34 Ca 0.01 -0.78 -0.02 0.00 -1.03 0.00 0.00 54.13 52.31 1wv7 s LEU 34 Cb -0.13 -0.97 0.03 0.00 0.03 0.00 0.00 46.19 45.15 1wv7 s LEU 34 CO 0.01 0.06 -0.00 0.54 0.23 0.00 0.00 176.35 177.19 1wv7 s VAL 35 N -1.48 0.49 -1.32 -1.59 0.11 -0.50 -0.48 120.40 115.63 1wv7 s VAL 35 Ca 0.13 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 59.05 1wv7 s VAL 35 Cb -0.08 -0.71 0.02 0.00 -1.53 0.00 0.00 36.38 34.07 1wv7 s VAL 35 CO 0.06 0.17 0.96 0.59 -3.33 0.00 0.00 175.10 173.54 1wv7 n ASN 37 N 5.10 -3.24 0.00 3.54 3.02 -0.61 -1.73 115.26 121.34 1wv7 n ASN 37 Ca -0.08 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.79 1wv7 n ASN 37 Cb 0.49 -4.61 0.00 0.00 -0.61 0.00 0.00 39.78 35.06 1wv7 n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wv7 n GLY 38 N -1.55 0.56 3.89 7.41 0.00 -1.26 -4.98 105.19 109.27 1wv7 n GLY 38 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 1wv7 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wv7 s ALA 39 N -2.19 3.90 0.23 4.61 0.00 -0.71 -5.03 121.76 122.57 1wv7 s ALA 39 Ca 0.00 -0.67 -0.32 0.00 0.00 0.00 0.00 51.96 50.98 1wv7 s ALA 39 Cb 0.00 -1.97 -0.13 0.00 0.00 0.00 0.00 23.12 21.02 1wv7 s ALA 39 CO 0.00 0.68 1.60 0.94 0.00 0.00 0.00 175.76 178.98 1wv7 n GLN 40 N 1.29 2.47 0.03 0.00 7.27 -1.26 -1.41 117.38 125.76 1wv7 n GLN 40 Ca -0.13 0.88 0.00 0.00 0.07 0.00 0.00 57.00 57.82 1wv7 n GLN 40 Cb 0.53 -2.66 0.00 0.00 2.41 0.00 0.00 30.24 30.52 1wv7 n GLN 40 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1wv7 n LEU 41 N 3.02 0.44 -3.82 1.69 7.94 0.46 -4.83 117.00 121.89 1wv7 n LEU 41 Ca 0.13 0.10 -0.06 0.00 -1.11 0.00 0.00 56.01 55.08 1wv7 n LEU 41 Cb 0.33 -0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.19 1wv7 n LEU 41 CO 0.64 -0.43 0.61 0.00 -1.11 0.00 0.00 177.39 177.10 1wv7 s GLY 43 N -3.07 1.74 0.16 0.00 0.00 -0.03 0.20 107.32 106.32 1wv7 s GLY 43 Ca 0.15 -1.97 -0.24 0.00 0.00 0.00 0.00 44.72 42.66 1wv7 s GLY 43 CO 0.07 -1.42 1.02 -0.32 0.00 0.00 0.00 173.10 172.45 1wv7 s GLY 44 N -4.74 -0.07 -0.06 0.20 0.00 -0.58 -3.96 107.32 98.11 1wv7 s GLY 44 Ca 0.65 -0.07 -0.01 0.00 0.00 0.00 0.00 44.72 45.30 1wv7 s GLY 44 CO 0.42 1.14 -0.01 -1.59 0.00 0.00 0.00 173.10 173.07 1wv7 s THR 45 N -2.68 0.41 0.12 0.90 2.01 0.76 -0.87 115.64 116.29 1wv7 s THR 45 Ca 0.17 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.93 1wv7 s THR 45 Cb -0.02 -0.53 -0.06 0.00 0.01 0.00 0.00 72.50 71.90 1wv7 s THR 45 CO 0.03 0.25 0.96 -0.22 -0.69 0.00 0.00 174.62 174.95 1wv7 s LEU 46 N 1.68 4.51 0.00 4.42 2.96 -0.68 -0.47 118.68 131.10 1wv7 s LEU 46 Ca 0.01 1.81 0.00 0.00 -0.22 0.00 0.00 54.13 55.72 1wv7 s LEU 46 Cb -0.13 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.97 1wv7 s LEU 46 CO -0.04 -0.06 0.60 2.30 -1.32 0.00 0.00 176.35 177.83 1wv7 n ILE 47 N 2.71 0.34 0.00 6.68 -5.35 -0.97 -0.46 119.36 122.31 1wv7 n ILE 47 Ca 0.02 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 1wv7 n ILE 47 Cb 0.49 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 1wv7 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1wv7 n ASN 48 N -0.17 0.00 0.32 7.28 0.23 -1.25 -4.70 115.26 116.97 1wv7 n ASN 48 Ca 0.00 0.00 0.16 0.00 -0.53 0.00 0.00 54.58 54.21 1wv7 n ASN 48 Cb 0.18 0.00 0.87 0.00 -2.08 0.00 0.00 39.78 38.76 1wv7 n ASN 48 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1wv7 h THR 49 N 0.12 0.00 0.00 5.53 1.35 -1.98 -3.13 112.91 114.81 1wv7 h THR 49 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.85 1wv7 h THR 49 Cb 0.00 0.71 -0.00 0.00 -1.73 0.00 0.00 68.15 67.13 1wv7 h THR 49 CO 0.00 0.00 -1.25 -0.38 -0.25 0.00 0.00 175.52 173.64 1wv7 n ILE 50 N -2.85 0.04 -4.80 6.82 5.41 -1.26 -1.27 119.36 121.44 1wv7 n ILE 50 Ca -0.02 -0.13 -0.32 0.00 1.00 0.00 0.00 62.75 63.28 1wv7 n ILE 50 Cb 0.29 0.24 -0.13 0.00 -0.71 0.00 0.00 39.64 39.34 1wv7 n ILE 50 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1wv7 s TRP 51 N -2.33 2.62 -0.05 1.39 0.52 -1.18 -1.23 118.94 118.67 1wv7 s TRP 51 Ca -0.02 -0.22 0.04 0.00 0.02 0.00 0.00 56.10 55.92 1wv7 s TRP 51 Cb 0.03 -1.54 -0.00 0.00 -1.15 0.00 0.00 33.47 30.81 1wv7 s TRP 51 CO 0.21 0.21 -0.16 0.08 0.02 0.00 0.00 176.95 177.31 1wv7 s VAL 52 N -0.82 1.37 -0.16 4.03 1.01 -0.09 -2.29 120.40 123.44 1wv7 s VAL 52 Ca 0.13 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.37 1wv7 s VAL 52 Cb -0.11 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1wv7 s VAL 52 CO 0.03 0.40 0.09 -0.69 0.00 0.00 0.00 175.10 174.93 1wv7 s VAL 53 N 0.16 5.05 0.00 2.92 1.01 0.38 0.06 120.40 129.98 1wv7 s VAL 53 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1wv7 s VAL 53 Cb -0.12 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1wv7 s VAL 53 CO 0.03 0.51 0.00 -0.24 0.00 0.00 0.00 175.10 175.40 1wv7 n SER 54 N 3.01 0.00 -4.85 3.32 2.88 0.21 -0.17 113.62 118.03 1wv7 n SER 54 Ca -0.17 -0.62 -0.36 0.00 -1.33 0.00 0.00 58.87 56.39 1wv7 n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1wv7 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wv7 s ALA 55 N -1.75 3.78 0.14 -1.46 0.00 -1.26 -0.77 121.76 120.44 1wv7 s ALA 55 Ca 0.00 -0.71 -0.16 0.00 0.00 0.00 0.00 51.96 51.09 1wv7 s ALA 55 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1wv7 s ALA 55 CO 0.00 0.64 1.77 0.00 0.00 0.00 0.00 175.76 178.18 1wv7 h ALA 56 N 4.71 0.49 0.00 0.00 0.00 -1.69 -2.97 119.26 119.80 1wv7 h ALA 56 Ca -0.53 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1wv7 h ALA 56 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1wv7 h ALA 56 CO 0.60 -0.01 0.09 1.12 0.00 0.00 0.00 179.25 181.05 1wv7 h HIS 57 N 0.50 0.00 0.00 0.00 2.07 -1.90 -1.29 115.15 114.53 1wv7 h HIS 57 Ca 0.14 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.66 1wv7 h HIS 57 Cb 0.01 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.99 1wv7 h HIS 57 CO -0.03 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.83 1wv7 n PHE 59 N -1.48 0.15 -0.35 0.00 3.72 -0.49 -4.74 117.46 114.27 1wv7 n PHE 59 Ca 0.01 -0.43 0.09 0.00 -0.05 0.00 0.00 57.45 57.07 1wv7 n PHE 59 Cb 0.06 -0.04 0.27 0.00 -0.94 0.00 0.00 39.48 38.84 1wv7 n PHE 59 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1wv7 h ASP 60 N 0.74 0.87 -0.24 4.37 5.19 -1.55 -2.90 116.42 122.89 1wv7 h ASP 60 Ca 0.00 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.43 1wv7 h ASP 60 Cb 0.53 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.90 1wv7 h ASP 60 CO 0.00 0.43 -0.02 0.29 -3.12 0.00 0.00 179.24 176.83 1wv7 n LYS 60 N -4.63 2.44 -2.68 3.56 4.01 -1.26 -5.01 118.16 114.59 1wv7 n LYS 60 Ca 0.20 -2.87 -0.40 0.00 -0.51 0.00 0.00 58.31 54.72 1wv7 n LYS 60 Cb 0.41 -1.79 -0.05 0.00 -0.51 0.00 0.00 35.03 33.09 1wv7 n LYS 60 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1wv7 s ILE 60 N -2.93 4.03 0.00 -0.18 -1.09 -1.10 -4.93 121.20 115.00 1wv7 s ILE 60 Ca 0.41 1.95 0.00 0.00 -2.23 0.00 0.00 60.65 60.78 1wv7 s ILE 60 Cb 0.35 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 1wv7 s ILE 60 CO 0.06 0.42 0.00 1.17 -1.23 0.00 0.00 174.94 175.36 1wv7 n LYS 60 N 1.75 2.94 -3.12 2.79 4.81 -1.26 -4.89 118.16 121.18 1wv7 n LYS 60 Ca -0.01 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 1wv7 n LYS 60 Cb 0.47 -0.87 -0.00 0.00 0.02 0.00 0.00 35.03 34.65 1wv7 n LYS 60 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1wv7 n ASN 60 N -1.60 5.96 0.31 3.14 3.02 -1.26 -4.89 115.26 119.94 1wv7 n ASN 60 Ca 0.00 -3.34 0.16 0.00 -0.03 0.00 0.00 54.58 51.37 1wv7 n ASN 60 Cb 0.37 -1.23 0.85 0.00 -0.61 0.00 0.00 39.78 39.16 1wv7 n ASN 60 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1wv7 h TRP 61 N 5.56 0.00 -0.01 3.10 4.06 -2.01 0.14 115.95 126.79 1wv7 h TRP 61 Ca 0.19 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.14 1wv7 h TRP 61 Cb 0.67 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.83 1wv7 h TRP 61 CO 0.93 0.00 0.00 0.54 -3.56 0.00 0.00 178.44 176.35 1wv7 n ARG 62 N -2.80 1.45 -1.08 0.49 5.12 -1.26 -4.02 116.66 114.55 1wv7 n ARG 62 Ca -0.02 -0.65 -0.08 0.00 -1.93 0.00 0.00 57.85 55.17 1wv7 n ARG 62 Cb 0.28 -1.48 0.15 0.00 -1.16 0.00 0.00 32.46 30.25 1wv7 n ARG 62 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1wv7 n ASN 63 N -0.21 3.17 -4.66 0.55 3.02 0.51 -4.99 115.26 112.65 1wv7 n ASN 63 Ca 0.20 -3.82 -0.37 0.00 -0.03 0.00 0.00 54.58 50.56 1wv7 n ASN 63 Cb 0.27 -0.55 -0.09 0.00 -0.61 0.00 0.00 39.78 38.80 1wv7 n ASN 63 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wv7 s LEU 64 N -3.37 4.12 -0.07 3.41 1.43 -1.26 -1.58 118.68 121.36 1wv7 s LEU 64 Ca 0.46 0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.87 1wv7 s LEU 64 Cb 0.40 -2.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 1wv7 s LEU 64 CO -0.01 -0.01 -0.25 -0.63 0.23 0.00 0.00 176.35 175.68 1wv7 s ILE 65 N 1.24 2.06 -0.23 -0.59 -1.09 0.37 -0.53 121.20 122.44 1wv7 s ILE 65 Ca 0.12 -1.05 -0.05 0.00 -2.23 0.00 0.00 60.65 57.44 1wv7 s ILE 65 Cb -0.14 -1.75 -0.02 0.00 -1.58 0.00 0.00 42.46 38.97 1wv7 s ILE 65 CO 0.06 0.57 0.00 0.00 -1.23 0.00 0.00 174.94 174.34 1wv7 s ALA 66 N -0.03 2.96 -0.17 9.38 0.00 0.57 -0.53 121.76 133.93 1wv7 s ALA 66 Ca -0.08 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 50.71 1wv7 s ALA 66 Cb -0.15 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.10 1wv7 s ALA 66 CO 0.05 -0.43 -0.04 0.08 0.00 0.00 0.00 175.76 175.43 1wv7 s VAL 67 N 1.49 3.76 0.30 0.00 1.01 0.71 -1.70 120.40 125.97 1wv7 s VAL 67 Ca 0.06 -0.39 0.10 0.00 0.00 0.00 0.00 61.98 61.74 1wv7 s VAL 67 Cb -0.15 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.52 1wv7 s VAL 67 CO -0.00 0.47 -0.04 -0.76 0.00 0.00 0.00 175.10 174.77 1wv7 s LEU 68 N 0.64 2.98 -0.28 3.92 1.02 -0.28 -0.97 118.68 125.71 1wv7 s LEU 68 Ca -0.02 -0.88 0.00 0.00 0.02 0.00 0.00 54.13 53.25 1wv7 s LEU 68 Cb -0.14 -1.43 0.00 0.00 0.02 0.00 0.00 46.19 44.64 1wv7 s LEU 68 CO 0.02 -0.10 0.00 0.61 0.02 0.00 0.00 176.35 176.90 1wv7 n GLY 69 N -0.87 0.55 3.83 -3.19 0.00 -1.26 -1.59 105.19 102.67 1wv7 n GLY 69 Ca -0.05 -0.26 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 1wv7 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wv7 s GLU 70 N -1.39 3.08 0.31 1.61 0.41 -1.26 -4.11 118.70 117.35 1wv7 s GLU 70 Ca 0.00 0.87 0.00 0.00 -0.41 0.00 0.00 54.97 55.43 1wv7 s GLU 70 Cb 0.00 -2.01 0.00 0.00 -1.78 0.00 0.00 34.13 30.34 1wv7 s GLU 70 CO 0.00 -0.97 0.00 1.58 -0.49 0.00 0.00 175.26 175.38 1wv7 n HIS 71 N -3.04 -3.54 -3.88 1.61 -0.00 -1.26 -4.91 115.22 100.21 1wv7 n HIS 71 Ca 0.07 0.97 -0.35 0.00 -0.00 0.00 0.00 57.72 58.41 1wv7 n HIS 71 Cb 0.54 2.43 -0.13 0.00 -0.00 0.00 0.00 29.99 32.83 1wv7 n HIS 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1wv7 s ASP 72 N -2.56 5.00 0.29 0.26 -1.08 -1.26 -1.39 116.67 115.93 1wv7 s ASP 72 Ca 0.00 -1.67 0.15 0.00 -0.52 0.00 0.00 52.55 50.51 1wv7 s ASP 72 Cb 0.00 -1.74 0.84 0.00 -1.46 0.00 0.00 42.92 40.56 1wv7 s ASP 72 CO 0.00 -0.38 1.41 0.18 0.52 0.00 0.00 175.17 176.90 1wv7 n LEU 73 N 4.56 0.40 -0.45 -1.34 4.77 -0.05 -1.47 117.00 123.42 1wv7 n LEU 73 Ca -0.07 0.63 0.12 0.00 -0.03 0.00 0.00 56.01 56.65 1wv7 n LEU 73 Cb 0.42 -0.63 0.09 0.00 -2.33 0.00 0.00 43.42 40.97 1wv7 n LEU 73 CO 0.28 -0.76 0.39 -1.54 -1.33 0.00 0.00 177.39 174.43 1wv7 n SER 74 N -2.08 1.84 -4.53 -1.43 3.41 -1.26 -4.97 113.62 104.60 1wv7 n SER 74 Ca -0.01 -1.40 -0.26 0.00 -0.26 0.00 0.00 58.87 56.95 1wv7 n SER 74 Cb 0.18 0.39 -0.10 0.00 -0.26 0.00 0.00 64.21 64.42 1wv7 n SER 74 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1wv7 s GLU 75 N -2.47 1.85 -0.17 4.33 2.12 -0.54 -5.14 118.70 118.68 1wv7 s GLU 75 Ca 0.20 -2.06 -0.04 0.00 0.36 0.00 0.00 54.97 53.42 1wv7 s GLU 75 Cb 0.18 -1.24 0.06 0.00 0.26 0.00 0.00 34.13 33.39 1wv7 s GLU 75 CO 0.55 -0.17 0.07 -1.01 -0.54 0.00 0.00 175.26 174.17 1wv7 s HIS 76 N -3.00 0.40 0.48 5.30 3.76 -1.26 -4.86 115.29 116.11 1wv7 s HIS 76 Ca 0.32 -0.43 0.03 0.00 -0.15 0.00 0.00 55.06 54.83 1wv7 s HIS 76 Cb 0.08 -0.77 -0.03 0.00 1.11 0.00 0.00 32.58 32.97 1wv7 s HIS 76 CO 0.15 -0.52 0.01 0.16 -0.85 0.00 0.00 174.74 173.69 1wv7 s ASP 77 N 2.07 3.96 0.00 1.40 1.47 -1.26 -5.03 116.67 119.28 1wv7 s ASP 77 Ca 0.01 -1.58 0.03 0.00 1.18 0.00 0.00 52.55 52.19 1wv7 s ASP 77 Cb -0.16 0.28 0.17 0.00 -0.34 0.00 0.00 42.92 42.86 1wv7 s ASP 77 CO -0.09 -0.75 0.99 0.61 0.68 0.00 0.00 175.17 176.61 1wv7 n GLY 78 N -1.16 -0.87 0.02 2.12 0.00 -1.26 -3.12 105.19 100.92 1wv7 n GLY 78 Ca -0.15 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 45.98 1wv7 n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wv7 n ASP 79 N -0.55 0.54 -4.71 1.61 8.00 -1.26 -4.88 116.55 115.30 1wv7 n ASP 79 Ca 0.02 -0.13 -0.42 0.00 0.71 0.00 0.00 54.79 54.97 1wv7 n ASP 79 Cb 0.01 0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 1wv7 n ASP 79 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1wv7 s GLU 80 N -3.05 4.47 -0.04 -1.24 2.02 -1.18 -4.22 118.70 115.46 1wv7 s GLU 80 Ca 0.09 1.69 0.03 0.00 0.02 0.00 0.00 54.97 56.81 1wv7 s GLU 80 Cb 0.16 -3.36 0.00 0.00 0.10 0.00 0.00 34.13 31.03 1wv7 s GLU 80 CO 0.71 -0.18 -0.11 -0.65 0.02 0.00 0.00 175.26 175.04 1wv7 s GLN 81 N 0.91 1.25 0.10 1.61 -0.21 -0.62 -4.99 119.66 117.70 1wv7 s GLN 81 Ca 0.56 -0.38 0.10 0.00 0.02 0.00 0.00 55.36 55.66 1wv7 s GLN 81 Cb -0.28 -1.12 -0.04 0.00 1.00 0.00 0.00 33.01 32.58 1wv7 s GLN 81 CO 0.30 0.13 -0.24 -1.12 -2.12 0.00 0.00 175.29 172.23 1wv7 s SER 82 N 0.25 3.46 -0.07 5.90 0.01 -1.26 -1.13 113.70 120.86 1wv7 s SER 82 Ca -0.05 -0.64 -0.15 0.00 1.31 0.00 0.00 55.95 56.41 1wv7 s SER 82 Cb -0.10 -0.35 0.03 0.00 0.21 0.00 0.00 66.02 65.81 1wv7 s SER 82 CO 0.01 0.20 0.36 -0.13 0.41 0.00 0.00 173.24 174.10 1wv7 s ARG 83 N -1.84 0.61 0.29 12.44 1.81 -0.69 -5.00 118.95 126.56 1wv7 s ARG 83 Ca 0.14 0.13 -0.25 0.00 -1.72 0.00 0.00 55.73 54.04 1wv7 s ARG 83 Cb -0.10 0.28 -0.09 0.00 -0.45 0.00 0.00 34.95 34.58 1wv7 s ARG 83 CO 0.06 -0.14 0.89 1.03 -0.68 0.00 0.00 175.30 176.46 1wv7 s ARG 84 N -0.70 4.53 -0.28 3.54 0.52 -1.26 -0.32 118.95 124.99 1wv7 s ARG 84 Ca -0.08 1.23 -0.27 0.00 -0.52 0.00 0.00 55.73 56.10 1wv7 s ARG 84 Cb -0.04 -2.87 0.01 0.00 0.52 0.00 0.00 34.95 32.57 1wv7 s ARG 84 CO 0.03 0.33 0.95 0.08 0.02 0.00 0.00 175.30 176.71 1wv7 s VAL 85 N -1.55 4.69 -0.48 3.52 1.01 0.31 -1.18 120.40 126.71 1wv7 s VAL 85 Ca 0.47 1.64 0.24 0.00 0.00 0.00 0.00 61.98 64.33 1wv7 s VAL 85 Cb -0.19 -4.26 0.15 0.00 0.00 0.00 0.00 36.38 32.08 1wv7 s VAL 85 CO 0.24 -0.26 1.39 0.00 0.00 0.00 0.00 175.10 176.47 1wv7 h ALA 86 N 7.85 0.74 -1.66 5.51 0.00 -0.80 -3.45 119.26 127.45 1wv7 h ALA 86 Ca -0.22 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1wv7 h ALA 86 Cb 1.08 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.61 1wv7 h ALA 86 CO 0.95 0.00 0.36 -1.14 0.00 0.00 0.00 179.25 179.42 1wv7 s GLN 87 N -3.23 0.53 -0.27 0.00 0.74 -1.02 -4.53 119.66 111.87 1wv7 s GLN 87 Ca 0.05 0.72 -0.01 0.00 0.05 0.00 0.00 55.36 56.17 1wv7 s GLN 87 Cb 0.10 0.21 0.05 0.00 1.10 0.00 0.00 33.01 34.46 1wv7 s GLN 87 CO 0.71 -0.08 -0.05 0.08 -0.55 0.00 0.00 175.29 175.40 1wv7 s VAL 88 N 0.67 2.74 -0.29 1.34 1.01 -0.39 -0.40 120.40 125.07 1wv7 s VAL 88 Ca -0.02 -1.34 -0.08 0.00 0.00 0.00 0.00 61.98 60.54 1wv7 s VAL 88 Cb -0.05 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 1wv7 s VAL 88 CO -0.09 0.01 0.12 -0.63 0.00 0.00 0.00 175.10 174.51 1wv7 s ILE 89 N 1.24 4.39 0.00 2.22 1.01 0.26 -1.74 121.20 128.58 1wv7 s ILE 89 Ca -0.04 -0.42 0.07 0.00 0.00 0.00 0.00 60.65 60.25 1wv7 s ILE 89 Cb -0.19 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 39.05 1wv7 s ILE 89 CO -0.03 0.13 -0.21 -0.63 0.00 0.00 0.00 174.94 174.20 1wv7 s ILE 90 N 1.59 2.48 0.49 2.92 1.01 -0.79 0.07 121.20 128.98 1wv7 s ILE 90 Ca 0.05 -1.09 -0.24 0.00 0.00 0.00 0.00 60.65 59.37 1wv7 s ILE 90 Cb -0.17 -1.96 -0.07 0.00 0.01 0.00 0.00 42.46 40.28 1wv7 s ILE 90 CO 0.05 0.48 1.38 -2.84 0.00 0.00 0.00 174.94 174.01 1wv7 s PRO 91 N -0.96 3.46 0.34 2.79 0.02 -1.26 -2.26 135.00 137.13 1wv7 s PRO 91 Ca 0.12 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.46 1wv7 s PRO 91 Cb -0.10 -2.47 0.61 0.00 0.02 0.00 0.00 34.50 32.56 1wv7 s PRO 91 CO 0.01 -0.96 1.98 0.77 -0.33 0.00 0.00 177.00 178.48 1wv7 h SER 92 N 1.95 0.71 0.00 2.53 0.02 -1.13 -2.40 113.55 115.22 1wv7 h SER 92 Ca -0.51 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 1wv7 h SER 92 Cb 1.28 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1wv7 h SER 92 CO 0.59 0.55 0.00 0.35 -1.14 0.00 0.00 176.83 177.19 1wv7 n THR 93 N -4.41 0.00 -3.13 -2.27 -2.24 -1.26 -4.79 114.28 96.18 1wv7 n THR 93 Ca 0.06 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.45 1wv7 n THR 93 Cb 0.08 -0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 67.53 1wv7 n THR 93 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1wv7 s TYR 94 N -2.00 3.82 -0.19 4.78 5.04 -0.91 -4.89 117.35 123.00 1wv7 s TYR 94 Ca 0.24 1.41 -0.02 0.00 -2.44 0.00 0.00 57.07 56.27 1wv7 s TYR 94 Cb 0.11 -2.64 -0.00 0.00 0.35 0.00 0.00 41.96 39.77 1wv7 s TYR 94 CO 0.19 0.49 -0.11 0.08 -1.34 0.00 0.00 175.55 174.87 1wv7 s VAL 95 N -0.87 2.95 0.38 3.14 1.01 -1.26 -5.02 120.40 120.73 1wv7 s VAL 95 Ca 0.33 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.39 1wv7 s VAL 95 Cb -0.21 -2.30 -0.11 0.00 0.00 0.00 0.00 36.38 33.77 1wv7 s VAL 95 CO 0.22 0.48 1.25 -2.65 0.00 0.00 0.00 175.10 174.40 1wv7 n PRO 96 N 4.42 1.96 -0.17 2.72 -0.02 -1.26 -1.74 135.00 140.91 1wv7 n PRO 96 Ca -0.19 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1wv7 n PRO 96 Cb 0.51 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1wv7 n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wv7 n GLY 97 N 0.83 1.78 0.00 -1.23 0.00 -1.26 -5.01 105.19 100.30 1wv7 n GLY 97 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1wv7 n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wv7 n THR 98 N -2.00 0.00 0.00 2.61 -2.24 -0.71 -5.11 114.28 106.83 1wv7 n THR 98 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1wv7 n THR 98 Cb 0.00 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 1wv7 n THR 98 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wv7 n THR 99 N -0.07 0.00 -2.58 4.28 -2.24 -1.26 -4.95 114.28 107.45 1wv7 n THR 99 Ca 0.00 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 1wv7 n THR 99 Cb 0.00 0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 1wv7 n THR 99 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1wv7 s ASN 100 N -1.44 6.99 -1.27 3.42 3.04 -1.26 -3.59 114.94 120.83 1wv7 s ASN 100 Ca 0.00 2.04 -0.05 0.00 0.04 0.00 0.00 52.86 54.89 1wv7 s ASN 100 Cb 0.00 -2.59 0.01 0.00 -1.54 0.00 0.00 41.25 37.12 1wv7 s ASN 100 CO 0.00 -0.32 1.09 1.41 -3.04 0.00 0.00 177.10 176.24 1wv7 n HIS 101 N 0.34 -2.56 -2.55 0.43 8.25 -1.26 -4.52 115.22 113.35 1wv7 n HIS 101 Ca 0.03 0.97 -0.43 0.00 -0.26 0.00 0.00 57.72 58.03 1wv7 n HIS 101 Cb 0.49 -5.00 0.00 0.00 1.12 0.00 0.00 29.99 26.59 1wv7 n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1wv7 n ASP 102 N -3.00 4.89 -3.72 0.41 -0.08 -1.24 -4.73 116.55 109.08 1wv7 n ASP 102 Ca -0.11 -2.92 -0.14 0.00 -1.51 0.00 0.00 54.79 50.10 1wv7 n ASP 102 Cb 0.60 -1.71 -0.08 0.00 2.34 0.00 0.00 41.12 42.27 1wv7 n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1wv7 s ILE 103 N 3.71 0.04 -0.06 5.18 2.07 -1.26 -4.01 121.20 126.87 1wv7 s ILE 103 Ca 0.52 -0.35 -0.08 0.00 -1.41 0.00 0.00 60.65 59.33 1wv7 s ILE 103 Cb 0.04 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.97 1wv7 s ILE 103 CO 0.05 -0.19 0.20 0.00 -1.91 0.00 0.00 174.94 173.09 1wv7 s ALA 104 N -1.15 -0.49 -0.30 1.50 0.00 0.05 -3.46 121.76 117.90 1wv7 s ALA 104 Ca -0.12 0.45 -0.01 0.00 0.00 0.00 0.00 51.96 52.28 1wv7 s ALA 104 Cb -0.04 -0.24 0.05 0.00 0.00 0.00 0.00 23.12 22.89 1wv7 s ALA 104 CO 0.05 -0.12 -0.01 -1.17 0.00 0.00 0.00 175.76 174.51 1wv7 s LEU 105 N -0.21 3.89 -0.25 0.00 2.96 0.11 -0.62 118.68 124.56 1wv7 s LEU 105 Ca -0.03 -1.31 -0.12 0.00 -0.22 0.00 0.00 54.13 52.45 1wv7 s LEU 105 Cb -0.03 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1wv7 s LEU 105 CO 0.01 -0.26 0.22 -0.76 -1.32 0.00 0.00 176.35 174.24 1wv7 s LEU 106 N 1.23 4.08 -0.25 -0.68 1.02 0.11 -0.57 118.68 123.62 1wv7 s LEU 106 Ca -0.05 0.14 -0.18 0.00 0.02 0.00 0.00 54.13 54.06 1wv7 s LEU 106 Cb -0.20 -2.20 -0.03 0.00 0.02 0.00 0.00 46.19 43.79 1wv7 s LEU 106 CO -0.02 -0.02 0.53 -0.60 0.02 0.00 0.00 176.35 176.26 1wv7 s ARG 107 N 1.43 4.10 0.29 1.70 3.52 0.46 -0.91 118.95 129.54 1wv7 s ARG 107 Ca 0.10 0.37 -0.28 0.00 -0.13 0.00 0.00 55.73 55.78 1wv7 s ARG 107 Cb -0.15 -3.63 -0.09 0.00 -1.56 0.00 0.00 34.95 29.52 1wv7 s ARG 107 CO 0.08 -0.31 1.00 -0.51 -0.81 0.00 0.00 175.30 174.74 1wv7 s LEU 108 N 2.17 4.50 0.42 -0.88 1.43 -0.37 -0.12 118.68 125.83 1wv7 s LEU 108 Ca 0.22 2.02 0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1wv7 s LEU 108 Cb -0.16 -3.76 0.88 0.00 0.03 0.00 0.00 46.19 43.18 1wv7 s LEU 108 CO 0.09 -0.04 2.03 -0.74 0.23 0.00 0.00 176.35 177.92 1wv7 h HIS 109 N 3.67 0.39 -3.71 0.29 -0.00 -1.48 -3.43 115.15 110.89 1wv7 h HIS 109 Ca -0.46 -0.00 -0.26 0.00 -0.00 0.00 0.00 60.37 59.64 1wv7 h HIS 109 Cb 1.20 -0.13 -0.29 0.00 -0.00 0.00 0.00 27.41 28.19 1wv7 h HIS 109 CO 0.60 0.30 -0.73 -1.14 -0.00 0.00 0.00 177.93 176.97 1wv7 s GLN 110 N -5.23 0.08 0.91 5.26 2.00 -1.26 -5.02 119.66 116.39 1wv7 s GLN 110 Ca -0.07 0.01 -0.11 0.00 -2.00 0.00 0.00 55.36 53.18 1wv7 s GLN 110 Cb 0.17 -0.13 0.11 0.00 0.80 0.00 0.00 33.01 33.95 1wv7 s GLN 110 CO 0.73 -0.02 0.95 -0.35 -0.50 0.00 0.00 175.29 176.09 1wv7 n PRO 111 N 3.31 -0.34 -3.97 1.67 -0.04 -1.26 -4.95 135.00 129.42 1wv7 n PRO 111 Ca -0.16 -0.04 -0.22 0.00 -0.04 0.00 0.00 63.50 63.05 1wv7 n PRO 111 Cb 0.57 -2.24 -0.02 0.00 -0.04 0.00 0.00 33.50 31.78 1wv7 n PRO 111 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1wv7 s VAL 112 N -2.51 5.24 -0.13 0.52 -7.23 -0.40 -5.02 120.40 110.88 1wv7 s VAL 112 Ca 0.65 -0.97 -0.20 0.00 -1.81 0.00 0.00 61.98 59.65 1wv7 s VAL 112 Cb -0.23 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 32.84 1wv7 s VAL 112 CO 0.60 -0.30 0.55 -0.69 -0.31 0.00 0.00 175.10 174.94 1wv7 s VAL 113 N -1.96 5.13 -0.08 1.32 1.01 -1.26 -4.83 120.40 119.72 1wv7 s VAL 113 Ca 0.34 1.08 -0.28 0.00 0.00 0.00 0.00 61.98 63.12 1wv7 s VAL 113 Cb -0.09 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1wv7 s VAL 113 CO 0.29 0.26 0.93 -0.76 0.00 0.00 0.00 175.10 175.82 1wv7 s LEU 114 N 0.97 4.27 0.00 3.92 1.43 -1.26 -4.77 118.68 123.24 1wv7 s LEU 114 Ca 0.28 1.45 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 1wv7 s LEU 114 Cb -0.16 -3.44 -0.00 0.00 0.03 0.00 0.00 46.19 42.63 1wv7 s LEU 114 CO 0.12 -0.34 0.02 0.35 0.23 0.00 0.00 176.35 176.72 1wv7 n THR 115 N 4.31 0.00 0.24 5.49 -2.24 -0.72 -4.98 114.28 116.38 1wv7 n THR 115 Ca 0.06 -0.14 0.11 0.00 -2.27 0.00 0.00 64.05 61.80 1wv7 n THR 115 Cb 0.50 0.07 0.58 0.00 -2.10 0.00 0.00 70.33 69.38 1wv7 n THR 115 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1wv7 h ASP 116 N 0.12 0.00 -0.01 3.42 3.32 -2.00 -3.08 116.42 118.20 1wv7 h ASP 116 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1wv7 h ASP 116 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1wv7 h ASP 116 CO 0.02 0.19 -0.64 1.41 -1.72 0.00 0.00 179.24 178.50 1wv7 n HIS 117 N -3.54 0.00 -3.74 4.55 8.25 -1.26 -4.84 115.22 114.65 1wv7 n HIS 117 Ca -0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.17 1wv7 n HIS 117 Cb 0.34 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.29 1wv7 n HIS 117 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1wv7 s VAL 118 N -2.50 0.65 -0.01 1.59 1.01 -1.16 -4.16 120.40 115.82 1wv7 s VAL 118 Ca 0.12 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1wv7 s VAL 118 Cb 0.15 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 35.28 1wv7 s VAL 118 CO 0.63 -0.36 0.08 -0.69 0.00 0.00 0.00 175.10 174.77 1wv7 s VAL 119 N 1.78 0.06 0.44 2.92 1.01 -0.82 -1.75 120.40 124.03 1wv7 s VAL 119 Ca 0.02 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1wv7 s VAL 119 Cb -0.17 -0.28 -0.08 0.00 0.00 0.00 0.00 36.38 35.85 1wv7 s VAL 119 CO -0.14 -0.26 0.87 -2.16 0.00 0.00 0.00 175.10 173.41 1wv7 s PRO 120 N -0.83 3.94 0.11 2.72 0.04 -1.26 -2.98 135.00 136.73 1wv7 s PRO 120 Ca -0.09 0.77 -0.15 0.00 0.04 0.00 0.00 61.00 61.57 1wv7 s PRO 120 Cb -0.05 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 1wv7 s PRO 120 CO 0.00 -0.10 0.53 -1.17 0.04 0.00 0.00 177.00 176.31 1wv7 s LEU 121 N -3.72 4.40 0.15 -3.56 2.96 0.39 -4.91 118.68 114.39 1wv7 s LEU 121 Ca 0.56 1.10 -0.30 0.00 -0.22 0.00 0.00 54.13 55.27 1wv7 s LEU 121 Cb -0.10 -3.08 -0.07 0.00 0.50 0.00 0.00 46.19 43.44 1wv7 s LEU 121 CO 0.27 0.18 1.21 0.00 -1.32 0.00 0.00 176.35 176.69 1wv7 s LEU 123 N 0.21 4.14 0.86 0.00 2.96 -1.26 -0.53 118.68 125.06 1wv7 s LEU 123 Ca 0.55 0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 54.70 1wv7 s LEU 123 Cb -0.32 -2.63 0.17 0.00 0.50 0.00 0.00 46.19 43.90 1wv7 s LEU 123 CO 0.34 -0.35 1.18 -2.16 -1.32 0.00 0.00 176.35 174.04 1wv7 s PRO 124 N 2.35 1.08 0.21 0.98 0.04 -1.26 -4.98 135.00 133.42 1wv7 s PRO 124 Ca 0.20 -0.71 -0.23 0.00 0.04 0.00 0.00 61.00 60.30 1wv7 s PRO 124 Cb -0.15 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 1wv7 s PRO 124 CO 0.11 -2.00 0.77 -1.21 0.04 0.00 0.00 177.00 174.71 1wv7 s GLU 125 N -5.57 4.43 0.15 4.56 2.02 -1.26 -4.95 118.70 118.09 1wv7 s GLU 125 Ca 0.71 1.05 -0.30 0.00 0.02 0.00 0.00 54.97 56.45 1wv7 s GLU 125 Cb -0.04 -3.05 -0.07 0.00 0.10 0.00 0.00 34.13 31.07 1wv7 s GLU 125 CO 0.49 0.47 1.52 -0.09 0.02 0.00 0.00 175.26 177.67 1wv7 h ARG 126 N 3.82 -0.01 -0.45 1.61 2.43 -1.97 -2.04 114.38 117.77 1wv7 h ARG 126 Ca -0.47 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.63 1wv7 h ARG 126 Cb 1.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1wv7 h ARG 126 CO 0.65 -0.01 0.02 1.79 -1.51 0.00 0.00 179.97 180.91 1wv7 h THR 127 N -0.01 1.23 -0.75 0.20 1.35 -1.94 -1.84 112.91 111.14 1wv7 h THR 127 Ca 0.15 -0.92 0.02 0.00 -0.55 0.00 0.00 66.41 65.11 1wv7 h THR 127 Cb 0.40 0.87 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 1wv7 h THR 127 CO -0.89 0.32 0.49 0.15 -0.25 0.00 0.00 175.52 175.34 1wv7 h PHE 128 N 0.68 0.92 -0.02 4.73 3.57 -1.79 0.94 116.94 125.97 1wv7 h PHE 128 Ca 0.14 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 1wv7 h PHE 128 Cb 0.40 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1wv7 h PHE 128 CO 0.02 0.55 -0.61 1.03 -2.23 0.00 0.00 178.31 177.07 1wv7 h SER 129 N 0.97 0.09 0.33 0.41 0.87 -1.10 0.93 113.55 116.05 1wv7 h SER 129 Ca 0.29 -0.05 -0.33 0.00 -1.23 0.00 0.00 61.79 60.47 1wv7 h SER 129 Cb -0.04 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1wv7 h SER 129 CO -0.09 0.68 -1.60 -0.33 -0.53 0.00 0.00 176.83 174.95 1wv7 h GLU 129 N 0.06 0.34 0.00 2.24 5.08 -1.08 0.35 114.58 121.58 1wv7 h GLU 129 Ca -0.01 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 1wv7 h GLU 129 Cb 1.09 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1wv7 h GLU 129 CO 0.08 1.24 -0.84 -0.09 -1.00 0.00 0.00 179.01 178.41 1wv7 h ARG 129 N 0.09 0.00 0.00 2.33 2.43 -0.88 -3.40 114.38 114.95 1wv7 h ARG 129 Ca -0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1wv7 h ARG 129 Cb 2.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.62 1wv7 h ARG 129 CO 0.18 0.00 0.00 2.41 -1.51 0.00 0.00 179.97 181.05 1wv7 n THR 129 N -2.54 0.45 -0.30 0.20 -1.04 0.28 -4.82 114.28 106.51 1wv7 n THR 129 Ca 0.01 0.15 0.07 0.00 -2.04 0.00 0.00 64.05 62.24 1wv7 n THR 129 Cb 0.52 -0.96 0.28 0.00 -1.82 0.00 0.00 70.33 68.35 1wv7 n THR 129 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1wv7 h LEU 129 N 0.00 0.84 -2.58 -4.42 3.38 -1.50 -1.71 115.31 109.33 1wv7 h LEU 129 Ca 0.00 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1wv7 h LEU 129 Cb 0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1wv7 h LEU 129 CO 0.00 0.50 0.07 0.00 0.09 0.00 0.00 178.44 179.10 1wv7 h ALA 129 N 1.54 1.37 -0.66 1.53 0.00 -1.14 -0.59 119.26 121.31 1wv7 h ALA 129 Ca 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1wv7 h ALA 129 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1wv7 h ALA 129 CO -0.19 -0.09 0.00 1.19 0.00 0.00 0.00 179.25 180.17 1wv7 n PHE 129 N -3.47 1.01 -2.87 0.00 3.72 -0.65 -4.82 117.46 110.38 1wv7 n PHE 129 Ca -0.02 -0.53 -0.42 0.00 -0.05 0.00 0.00 57.45 56.43 1wv7 n PHE 129 Cb 0.15 -0.06 -0.04 0.00 -0.94 0.00 0.00 39.48 38.59 1wv7 n PHE 129 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1wv7 s VAL 129 N -1.19 4.64 0.09 -4.37 1.01 -0.23 -4.95 120.40 115.39 1wv7 s VAL 129 Ca 0.46 1.02 -0.27 0.00 0.00 0.00 0.00 61.98 63.20 1wv7 s VAL 129 Cb 0.25 -4.29 -0.10 0.00 0.00 0.00 0.00 36.38 32.24 1wv7 s VAL 129 CO 0.29 -0.52 1.43 -0.09 0.00 0.00 0.00 175.10 176.21 1wv7 h ARG 134 N 8.53 -0.45 -5.91 2.72 9.65 -1.88 -3.44 114.38 123.61 1wv7 h ARG 134 Ca -0.24 0.03 -0.63 0.00 -1.10 0.00 0.00 59.98 58.05 1wv7 h ARG 134 Cb 1.08 0.10 -0.06 0.00 -1.39 0.00 0.00 29.97 29.71 1wv7 h ARG 134 CO 0.96 -0.30 -0.34 -0.06 2.80 0.00 0.00 179.97 183.03 1wv7 s PHE 135 N -5.12 3.62 0.03 2.20 0.08 -1.26 -1.51 117.98 116.02 1wv7 s PHE 135 Ca -0.12 0.71 -0.07 0.00 0.12 0.00 0.00 56.93 57.57 1wv7 s PHE 135 Cb 0.05 -2.08 -0.00 0.00 -0.57 0.00 0.00 43.02 40.42 1wv7 s PHE 135 CO 0.48 0.63 0.13 -1.12 -0.10 0.00 0.00 175.22 175.24 1wv7 s SER 136 N -1.40 0.10 -0.17 1.36 0.01 -1.01 -4.54 113.70 108.05 1wv7 s SER 136 Ca 0.25 -0.39 -0.15 0.00 1.31 0.00 0.00 55.95 56.97 1wv7 s SER 136 Cb -0.14 0.23 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 1wv7 s SER 136 CO 0.13 -0.47 0.35 -0.76 0.41 0.00 0.00 173.24 172.90 1wv7 s LEU 137 N -1.86 4.21 0.08 2.44 1.43 0.38 -1.24 118.68 124.12 1wv7 s LEU 137 Ca -0.08 0.53 0.06 0.00 -1.03 0.00 0.00 54.13 53.60 1wv7 s LEU 137 Cb -0.03 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 1wv7 s LEU 137 CO -0.02 0.02 -0.05 0.68 0.23 0.00 0.00 176.35 177.20 1wv7 s VAL 138 N 0.84 3.69 0.16 -1.59 -7.23 0.01 -0.47 120.40 115.82 1wv7 s VAL 138 Ca 0.18 -1.07 -0.14 0.00 -1.81 0.00 0.00 61.98 59.14 1wv7 s VAL 138 Cb -0.14 -2.73 0.02 0.00 0.56 0.00 0.00 36.38 34.09 1wv7 s VAL 138 CO 0.06 0.16 0.40 -0.94 -0.31 0.00 0.00 175.10 174.46 1wv7 s SER 139 N -2.14 -0.13 0.00 4.85 1.04 -1.17 -0.72 113.70 115.44 1wv7 s SER 139 Ca 0.23 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1wv7 s SER 139 Cb -0.11 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1wv7 s SER 139 CO 0.15 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 174.04 1wv7 n GLY 140 N -0.26 0.29 1.92 7.32 0.00 -0.45 -4.41 105.19 109.60 1wv7 n GLY 140 Ca -0.11 -1.20 -0.06 0.00 0.00 0.00 0.00 46.02 44.65 1wv7 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1wv7 n TRP 141 N -0.90 2.36 -0.33 1.61 8.01 -1.26 -1.86 117.44 125.07 1wv7 n TRP 141 Ca 0.00 -1.25 0.00 0.00 -1.31 0.00 0.00 57.50 54.94 1wv7 n TRP 141 Cb 0.00 -0.68 0.00 0.00 -2.01 0.00 0.00 31.31 28.62 1wv7 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1wv7 n GLY 142 N -0.29 -1.97 3.76 6.99 0.00 -1.25 -2.28 105.19 110.14 1wv7 n GLY 142 Ca 0.41 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1wv7 n GLY 142 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wv7 s GLN 143 N -1.60 4.44 0.27 1.61 1.11 -1.26 -0.80 119.66 123.43 1wv7 s GLN 143 Ca 0.00 2.08 0.24 0.00 0.01 0.00 0.00 55.36 57.69 1wv7 s GLN 143 Cb 0.00 -3.12 0.38 0.00 -1.01 0.00 0.00 33.01 29.26 1wv7 s GLN 143 CO 0.00 -0.08 1.47 -0.07 0.01 0.00 0.00 175.29 176.62 1wv7 h LEU 144 N 3.74 0.00 -8.01 2.90 3.38 -1.59 0.52 115.31 116.25 1wv7 h LEU 144 Ca -0.48 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.35 1wv7 h LEU 144 Cb 1.22 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.83 1wv7 h LEU 144 CO 0.67 0.02 -0.51 -0.76 0.09 0.00 0.00 178.44 177.95 1wv7 s LEU 145 N -5.22 1.91 -0.25 1.67 1.43 -1.26 -4.27 118.68 112.69 1wv7 s LEU 145 Ca 0.06 -0.81 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 1wv7 s LEU 145 Cb 0.09 0.65 -0.03 0.00 0.03 0.00 0.00 46.19 46.94 1wv7 s LEU 145 CO 0.69 -0.67 1.76 -0.62 0.23 0.00 0.00 176.35 177.74 1wv7 s ASP 146 N -2.88 6.11 0.00 2.29 2.15 -1.26 -1.63 116.67 121.45 1wv7 s ASP 146 Ca 0.06 1.58 0.00 0.00 0.43 0.00 0.00 52.55 54.62 1wv7 s ASP 146 Cb 0.06 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 1wv7 s ASP 146 CO -0.10 -1.49 0.00 0.54 -0.17 0.00 0.00 175.17 173.95 1wv7 n ARG 147 N 8.06 0.00 -1.35 4.34 1.74 -1.26 -5.04 116.66 123.15 1wv7 n ARG 147 Ca 0.21 0.04 -0.08 0.00 -0.77 0.00 0.00 57.85 57.25 1wv7 n ARG 147 Cb 0.46 -2.39 0.04 0.00 -1.02 0.00 0.00 32.46 29.55 1wv7 n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wv7 n GLY 149 N -2.77 0.80 3.84 -0.13 0.00 -0.64 -5.09 105.19 101.21 1wv7 n GLY 149 Ca 0.00 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 1wv7 n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wv7 s ALA 150 N -2.87 2.79 0.61 4.61 0.00 -1.26 -4.76 121.76 120.87 1wv7 s ALA 150 Ca 0.24 -0.09 -0.08 0.00 0.00 0.00 0.00 51.96 52.03 1wv7 s ALA 150 Cb -0.01 -3.11 -0.00 0.00 0.00 0.00 0.00 23.12 19.99 1wv7 s ALA 150 CO 0.16 -1.11 0.95 0.95 0.00 0.00 0.00 175.76 176.71 1wv7 s THR 151 N -3.16 3.95 0.39 0.00 -4.23 -1.26 -2.78 115.64 108.55 1wv7 s THR 151 Ca 0.57 0.27 -0.23 0.00 -1.18 0.00 0.00 61.69 61.12 1wv7 s THR 151 Cb -0.13 -3.58 -0.10 0.00 1.34 0.00 0.00 72.50 70.03 1wv7 s THR 151 CO 0.54 -0.66 0.96 0.00 -0.54 0.00 0.00 174.62 174.93 1wv7 s ALA 152 N -3.07 3.09 -0.08 3.99 0.00 0.02 -4.87 121.76 120.85 1wv7 s ALA 152 Ca 0.54 0.49 0.04 0.00 0.00 0.00 0.00 51.96 53.03 1wv7 s ALA 152 Cb -0.11 -3.18 -0.24 0.00 0.00 0.00 0.00 23.12 19.59 1wv7 s ALA 152 CO 0.48 0.08 0.54 1.28 0.00 0.00 0.00 175.76 178.14 1wv7 n LEU 153 N -0.17 1.63 -4.58 0.00 4.77 -1.26 -4.77 117.00 112.61 1wv7 n LEU 153 Ca 0.05 0.33 -0.33 0.00 -0.03 0.00 0.00 56.01 56.03 1wv7 n LEU 153 Cb 0.52 -0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 41.12 1wv7 n LEU 153 CO 0.41 0.59 -0.38 -1.61 -1.33 0.00 0.00 177.39 175.06 1wv7 s GLU 154 N -2.58 2.66 0.17 3.23 2.02 -1.26 -0.87 118.70 122.07 1wv7 s GLU 154 Ca -0.12 -0.62 -0.34 0.00 0.02 0.00 0.00 54.97 53.91 1wv7 s GLU 154 Cb 0.07 -2.55 -0.14 0.00 0.10 0.00 0.00 34.13 31.62 1wv7 s GLU 154 CO 0.80 0.64 1.56 -0.11 0.02 0.00 0.00 175.26 178.17 1wv7 n LEU 155 N 1.98 3.11 -4.61 1.80 7.94 -0.49 -4.83 117.00 121.90 1wv7 n LEU 155 Ca -0.17 1.09 -0.28 0.00 -1.11 0.00 0.00 56.01 55.54 1wv7 n LEU 155 Cb 0.53 -1.43 -0.09 0.00 0.53 0.00 0.00 43.42 42.96 1wv7 n LEU 155 CO 0.28 -0.30 -0.38 -0.04 -1.11 0.00 0.00 177.39 175.83 1wv7 s MET 156 N 0.76 2.24 0.04 1.96 -1.94 -0.78 -1.21 119.30 120.37 1wv7 s MET 156 Ca 0.77 -1.06 0.03 0.00 -1.71 0.00 0.00 55.69 53.73 1wv7 s MET 156 Cb -0.67 -2.33 -0.02 0.00 2.01 0.00 0.00 34.83 33.82 1wv7 s MET 156 CO 0.39 0.49 -0.10 0.54 -0.01 0.00 0.00 175.02 176.33 1wv7 s VAL 157 N -1.44 0.73 -0.03 -6.03 0.11 0.11 -1.35 120.40 112.51 1wv7 s VAL 157 Ca 0.24 -0.96 -0.01 0.00 -2.93 0.00 0.00 61.98 58.33 1wv7 s VAL 157 Cb -0.10 -0.72 0.02 0.00 -1.53 0.00 0.00 36.38 34.05 1wv7 s VAL 157 CO 0.16 -0.19 0.05 -0.22 -3.33 0.00 0.00 175.10 171.57 1wv7 s LEU 158 N -1.27 1.22 -0.21 2.54 2.96 0.11 -2.08 118.68 121.95 1wv7 s LEU 158 Ca -0.04 0.09 -0.21 0.00 -0.22 0.00 0.00 54.13 53.75 1wv7 s LEU 158 Cb -0.08 0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.64 1wv7 s LEU 158 CO 0.01 -0.10 0.67 0.21 -1.32 0.00 0.00 176.35 175.81 1wv7 s ASN 159 N 0.82 6.70 -0.03 3.68 3.04 -1.26 -0.81 114.94 127.09 1wv7 s ASN 159 Ca -0.07 0.86 0.04 0.00 0.04 0.00 0.00 52.86 53.74 1wv7 s ASN 159 Cb -0.09 -2.36 -0.01 0.00 -1.54 0.00 0.00 41.25 37.24 1wv7 s ASN 159 CO -0.03 -0.33 -0.15 0.68 -3.04 0.00 0.00 177.10 174.23 1wv7 s VAL 160 N 2.14 1.26 0.19 -5.21 -7.23 -0.37 -4.95 120.40 106.23 1wv7 s VAL 160 Ca 0.30 -0.65 -0.28 0.00 -1.81 0.00 0.00 61.98 59.53 1wv7 s VAL 160 Cb -0.16 -1.07 -0.08 0.00 0.56 0.00 0.00 36.38 35.64 1wv7 s VAL 160 CO 0.10 0.36 0.88 -2.16 -0.31 0.00 0.00 175.10 173.97 1wv7 s PRO 161 N -0.15 4.72 0.16 4.82 0.04 -1.26 -2.39 135.00 140.94 1wv7 s PRO 161 Ca 0.01 1.36 -0.11 0.00 0.04 0.00 0.00 61.00 62.29 1wv7 s PRO 161 Cb -0.08 -3.29 -0.07 0.00 0.04 0.00 0.00 34.50 31.10 1wv7 s PRO 161 CO 0.01 0.48 0.51 0.50 0.04 0.00 0.00 177.00 178.54 1wv7 s ARG 162 N -0.93 3.86 0.03 4.56 3.52 -0.57 -0.96 118.95 128.48 1wv7 s ARG 162 Ca 0.40 0.34 0.04 0.00 -0.13 0.00 0.00 55.73 56.38 1wv7 s ARG 162 Cb -0.24 -2.85 -0.02 0.00 -1.56 0.00 0.00 34.95 30.28 1wv7 s ARG 162 CO 0.29 0.44 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.58 1wv7 s LEU 163 N -2.26 2.15 0.42 -0.88 1.02 -0.67 -4.97 118.68 113.49 1wv7 s LEU 163 Ca 0.40 -0.42 -0.23 0.00 0.02 0.00 0.00 54.13 53.91 1wv7 s LEU 163 Cb -0.13 -0.58 -0.09 0.00 0.02 0.00 0.00 46.19 45.41 1wv7 s LEU 163 CO 0.20 0.04 1.04 -0.04 0.02 0.00 0.00 176.35 177.61 1wv7 s MET 164 N -1.00 4.08 0.33 1.70 -1.94 -1.26 -3.78 119.30 117.43 1wv7 s MET 164 Ca 0.01 1.45 0.11 0.00 -1.71 0.00 0.00 55.69 55.56 1wv7 s MET 164 Cb -0.07 -2.42 0.92 0.00 2.01 0.00 0.00 34.83 35.27 1wv7 s MET 164 CO 0.01 -0.20 1.74 1.15 -0.01 0.00 0.00 175.02 177.71 1wv7 h THR 165 N 2.02 0.55 -0.31 2.05 2.02 -1.94 -0.75 112.91 116.55 1wv7 h THR 165 Ca -0.49 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 66.54 1wv7 h THR 165 Cb 1.21 -0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1wv7 h THR 165 CO 0.61 0.10 0.11 -0.61 0.37 0.00 0.00 175.52 176.10 1wv7 h GLN 166 N 0.56 0.23 -0.45 6.66 4.15 -2.00 -0.22 115.11 124.05 1wv7 h GLN 166 Ca 0.63 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.95 1wv7 h GLN 166 Cb 1.25 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.87 1wv7 h GLN 166 CO -0.43 0.15 -0.06 -0.44 -1.93 0.00 0.00 178.83 176.12 1wv7 h ASP 167 N 0.24 0.76 0.45 -0.69 3.32 -1.56 -3.14 116.42 115.80 1wv7 h ASP 167 Ca 0.14 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1wv7 h ASP 167 Cb 0.11 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1wv7 h ASP 167 CO -0.15 0.86 -0.24 0.00 -1.72 0.00 0.00 179.24 177.99 1wv7 n LEU 169 N -5.38 0.00 0.00 0.00 4.77 -0.17 -1.04 117.00 115.18 1wv7 n LEU 169 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1wv7 n LEU 169 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1wv7 n LEU 169 CO 0.35 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.41 1wv7 n GLN 170 N 0.49 0.00 -3.95 3.23 6.02 -0.09 -4.72 117.38 118.36 1wv7 n GLN 170 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 1wv7 n GLN 170 Cb 0.00 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 1wv7 n GLN 170 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1wv7 s SER 170 N 0.00 6.19 0.08 1.08 0.01 -0.20 -4.74 113.70 116.12 1wv7 s SER 170 Ca 0.00 0.23 -0.27 0.00 1.31 0.00 0.00 55.95 57.22 1wv7 s SER 170 Cb 0.00 -1.87 -0.06 0.00 0.21 0.00 0.00 66.02 64.30 1wv7 s SER 170 CO 0.00 0.19 0.85 -0.13 0.41 0.00 0.00 173.24 174.57 1wv7 s ARG 170 N -2.34 4.59 0.18 12.44 0.52 -0.62 -5.01 118.95 128.71 1wv7 s ARG 170 Ca 0.32 1.24 -0.30 0.00 -0.52 0.00 0.00 55.73 56.47 1wv7 s ARG 170 Cb -0.13 -3.37 -0.08 0.00 0.52 0.00 0.00 34.95 31.90 1wv7 s ARG 170 CO 0.25 0.26 1.24 0.15 0.02 0.00 0.00 175.30 177.22 1wv7 s LYS 170 N -0.07 4.44 -0.45 3.54 -0.14 -1.26 -4.98 119.74 120.82 1wv7 s LYS 170 Ca 0.42 1.94 0.02 0.00 -1.36 0.00 0.00 55.97 57.00 1wv7 s LYS 170 Cb -0.22 -3.23 0.13 0.00 -1.68 0.00 0.00 37.83 32.83 1wv7 s LYS 170 CO 0.26 -0.17 0.22 0.08 -0.76 0.00 0.00 175.35 174.98 1wv7 s VAL 170 N 0.11 1.72 0.06 3.17 1.01 -1.26 -5.09 120.40 120.11 1wv7 s VAL 170 Ca 0.55 -2.66 -0.26 0.00 0.00 0.00 0.00 61.98 59.61 1wv7 s VAL 170 Cb -0.34 -2.21 -0.14 0.00 0.00 0.00 0.00 36.38 33.69 1wv7 s VAL 170 CO 0.37 -0.84 0.64 0.61 0.00 0.00 0.00 175.10 175.87 1wv7 n GLY 170 N 3.57 -0.65 3.28 4.51 0.00 -1.26 -1.84 105.19 112.80 1wv7 n GLY 170 Ca 0.07 0.44 -0.20 0.00 0.00 0.00 0.00 46.02 46.33 1wv7 n GLY 170 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wv7 n ASP 170 N 1.27 -5.50 -4.75 1.61 8.00 -1.26 -5.03 116.55 110.90 1wv7 n ASP 170 Ca 0.14 -0.47 -0.26 0.00 0.71 0.00 0.00 54.79 54.91 1wv7 n ASP 170 Cb 0.11 -4.39 -0.06 0.00 -0.02 0.00 0.00 41.12 36.75 1wv7 n ASP 170 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1wv7 s SER 170 N -3.34 5.26 0.42 -2.24 1.04 -0.77 -5.08 113.70 108.99 1wv7 s SER 170 Ca 0.47 -0.22 -0.24 0.00 0.48 0.00 0.00 55.95 56.44 1wv7 s SER 170 Cb -0.21 -1.30 -0.11 0.00 0.10 0.00 0.00 66.02 64.51 1wv7 s SER 170 CO 0.63 0.08 0.87 -2.65 0.98 0.00 0.00 173.24 173.14 1wv7 n PRO 170 N -0.25 1.08 -3.02 4.02 -0.02 -1.26 -4.97 135.00 130.58 1wv7 n PRO 170 Ca -0.09 0.39 -0.34 0.00 -2.02 0.00 0.00 63.50 61.44 1wv7 n PRO 170 Cb 0.55 -1.86 -0.06 0.00 -0.02 0.00 0.00 33.50 32.10 1wv7 n PRO 170 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1wv7 s ASN 175 N -0.82 6.95 -0.46 2.55 0.01 -1.26 -5.00 114.94 116.90 1wv7 s ASN 175 Ca 0.63 1.47 -0.22 0.00 -0.71 0.00 0.00 52.86 54.03 1wv7 s ASN 175 Cb -0.58 -2.44 0.03 0.00 0.41 0.00 0.00 41.25 38.67 1wv7 s ASN 175 CO 0.57 -0.16 0.75 -0.63 -1.51 0.00 0.00 177.10 176.12 1wv7 s ILE 176 N -1.87 4.68 0.75 0.60 1.01 -1.26 -4.96 121.20 120.16 1wv7 s ILE 176 Ca 0.53 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.41 1wv7 s ILE 176 Cb -0.13 -4.32 0.15 0.00 0.01 0.00 0.00 42.46 38.17 1wv7 s ILE 176 CO 0.18 -0.74 1.04 0.42 0.00 0.00 0.00 174.94 175.83 1wv7 s THR 177 N 3.19 2.04 -1.50 2.92 -4.23 -1.26 -4.97 115.64 111.83 1wv7 s THR 177 Ca 0.27 -0.59 0.18 0.00 -1.18 0.00 0.00 61.69 60.37 1wv7 s THR 177 Cb -0.13 -2.45 0.33 0.00 1.34 0.00 0.00 72.50 71.59 1wv7 s THR 177 CO 0.20 0.00 1.52 -1.84 -0.54 0.00 0.00 174.62 173.96 1wv7 n GLU 178 N -2.93 0.29 -0.66 3.99 0.00 -1.26 -2.25 120.64 117.82 1wv7 n GLU 178 Ca 0.16 0.11 0.08 0.00 0.00 0.00 0.00 57.16 57.51 1wv7 n GLU 178 Cb 0.61 -1.50 0.34 0.00 0.00 0.00 0.00 31.44 30.89 1wv7 n GLU 178 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1wv7 n TYR 179 N -1.25 1.54 -4.19 -1.84 4.01 -1.26 -4.89 117.16 109.28 1wv7 n TYR 179 Ca 0.09 -0.71 -0.14 0.00 -0.16 0.00 0.00 57.90 56.98 1wv7 n TYR 179 Cb 0.13 -0.35 -0.06 0.00 -0.31 0.00 0.00 39.34 38.75 1wv7 n TYR 179 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1wv7 n MET 180 N 0.54 0.33 -3.65 -0.72 2.81 -0.95 -1.10 117.12 114.39 1wv7 n MET 180 Ca 0.25 -2.50 -0.02 0.00 -1.81 0.00 0.00 57.70 53.62 1wv7 n MET 180 Cb 0.98 2.08 -0.04 0.00 -0.71 0.00 0.00 33.22 35.53 1wv7 n MET 180 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 1wv7 s PHE 181 N -3.06 -0.02 0.25 2.03 -0.12 -0.93 -4.54 117.98 111.59 1wv7 s PHE 181 Ca 0.30 0.04 -0.01 0.00 -0.05 0.00 0.00 56.93 57.20 1wv7 s PHE 181 Cb 0.01 0.50 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 1wv7 s PHE 181 CO 0.21 -0.02 0.45 0.00 -0.05 0.00 0.00 175.22 175.82 1wv7 s ALA 183 N -2.00 -1.82 0.00 0.00 0.00 -0.91 -1.66 121.76 115.36 1wv7 s ALA 183 Ca 0.40 1.83 0.00 0.00 0.00 0.00 0.00 51.96 54.19 1wv7 s ALA 183 Cb -0.11 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.06 1wv7 s ALA 183 CO 0.30 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.15 1wv7 n GLY 184 N 2.12 0.65 3.16 0.00 0.00 -0.13 -1.95 105.19 109.04 1wv7 n GLY 184 Ca -0.15 -1.93 -0.14 0.00 0.00 0.00 0.00 46.02 43.80 1wv7 n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wv7 s TYR 184 N -1.94 1.02 -1.49 1.61 1.51 -1.22 -4.34 117.35 112.50 1wv7 s TYR 184 Ca 0.00 -0.63 0.17 0.00 -1.01 0.00 0.00 57.07 55.60 1wv7 s TYR 184 Cb 0.00 -0.57 0.47 0.00 -0.11 0.00 0.00 41.96 41.75 1wv7 s TYR 184 CO 0.00 -0.01 1.39 -1.13 -1.11 0.00 0.00 175.55 174.68 1wv7 n SER 185 N 0.71 3.41 -0.82 2.29 3.41 -1.25 -4.46 113.62 116.91 1wv7 n SER 185 Ca -0.17 -1.99 0.09 0.00 -0.26 0.00 0.00 58.87 56.54 1wv7 n SER 185 Cb 0.57 -0.35 0.26 0.00 -0.26 0.00 0.00 64.21 64.43 1wv7 n SER 185 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1wv7 n ASP 186 N 1.09 2.42 -0.02 4.04 5.68 -1.26 -0.80 116.55 127.70 1wv7 n ASP 186 Ca 0.18 -1.92 -0.00 0.00 -0.50 0.00 0.00 54.79 52.55 1wv7 n ASP 186 Cb 0.52 -0.25 -0.00 0.00 -1.14 0.00 0.00 41.12 40.25 1wv7 n ASP 186 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1wv7 n GLY 187 N 1.26 0.47 0.09 6.12 0.00 -1.26 -4.84 105.19 107.03 1wv7 n GLY 187 Ca 0.16 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 1wv7 n GLY 187 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wv7 n SER 188 N 0.29 1.19 -3.73 1.61 3.41 -1.26 -4.83 113.62 110.31 1wv7 n SER 188 Ca -0.00 -0.02 -0.14 0.00 -0.26 0.00 0.00 58.87 58.45 1wv7 n SER 188 Cb 0.03 0.69 -0.15 0.00 -0.26 0.00 0.00 64.21 64.53 1wv7 n SER 188 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1wv7 s LYS 188 N -2.40 0.08 -0.04 4.33 1.02 -1.26 -3.63 119.74 117.84 1wv7 s LYS 188 Ca -0.12 0.41 -0.31 0.00 0.02 0.00 0.00 55.97 55.97 1wv7 s LYS 188 Cb 0.05 -0.20 0.11 0.00 -0.52 0.00 0.00 37.83 37.27 1wv7 s LYS 188 CO 0.64 -0.19 1.13 0.34 -0.92 0.00 0.00 175.35 176.35 1wv7 s ASP 189 N 1.40 -0.16 0.65 2.83 2.15 -1.03 -3.40 116.67 119.12 1wv7 s ASP 189 Ca -0.07 -0.12 -0.04 0.00 0.43 0.00 0.00 52.55 52.75 1wv7 s ASP 189 Cb -0.12 0.26 0.05 0.00 -0.30 0.00 0.00 42.92 42.81 1wv7 s ASP 189 CO -0.06 -0.45 0.94 -0.94 -0.17 0.00 0.00 175.17 174.49 1wv7 s SER 190 N -2.64 5.00 0.30 -0.34 1.04 -1.26 -1.07 113.70 114.73 1wv7 s SER 190 Ca 0.11 0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.91 1wv7 s SER 190 Cb 0.01 -1.09 -0.04 0.00 0.10 0.00 0.00 66.02 64.99 1wv7 s SER 190 CO -0.04 -1.43 0.12 0.00 0.98 0.00 0.00 173.24 172.87 1wv7 h LYS 192 N 2.22 0.03 0.00 0.00 1.57 -1.92 0.13 116.57 118.60 1wv7 h LYS 192 Ca -0.36 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1wv7 h LYS 192 Cb 1.25 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1wv7 h LYS 192 CO 0.57 0.02 0.00 0.41 -0.57 0.00 0.00 179.45 179.88 1wv7 n GLY 193 N -1.51 -0.94 0.23 3.86 0.00 -1.26 -1.66 105.19 103.91 1wv7 n GLY 193 Ca 0.19 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.40 1wv7 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wv7 n ASP 194 N -1.95 1.10 -4.45 1.61 8.00 0.46 -3.90 116.55 117.42 1wv7 n ASP 194 Ca 0.01 -0.88 -0.55 0.00 0.71 0.00 0.00 54.79 54.08 1wv7 n ASP 194 Cb 0.11 0.27 -0.06 0.00 -0.02 0.00 0.00 41.12 41.43 1wv7 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1wv7 n SER 195 N -0.76 -0.46 0.00 -2.24 7.64 -0.66 -0.27 113.62 116.87 1wv7 n SER 195 Ca 0.10 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.12 1wv7 n SER 195 Cb 0.36 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 1wv7 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wv7 n GLY 196 N 1.67 2.31 3.68 0.23 0.00 -0.14 -0.85 105.19 112.09 1wv7 n GLY 196 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1wv7 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wv7 s GLY 197 N -1.92 1.60 0.53 -0.02 0.00 0.63 -3.00 107.32 105.14 1wv7 s GLY 197 Ca 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 44.72 44.53 1wv7 s GLY 197 CO 0.00 0.44 0.91 2.56 0.00 0.00 0.00 173.10 177.01 1wv7 s PRO 198 N -4.88 3.66 -0.41 2.90 0.04 -1.26 -2.23 135.00 132.83 1wv7 s PRO 198 Ca 0.64 0.58 0.02 0.00 0.04 0.00 0.00 61.00 62.28 1wv7 s PRO 198 Cb -0.19 -2.22 0.12 0.00 0.04 0.00 0.00 34.50 32.25 1wv7 s PRO 198 CO 0.58 -0.33 0.19 -1.58 0.04 0.00 0.00 177.00 175.89 1wv7 s HIS 199 N -2.84 2.22 -0.15 0.56 2.46 -0.80 -3.04 115.29 113.69 1wv7 s HIS 199 Ca 0.53 -2.41 -0.13 0.00 0.47 0.00 0.00 55.06 53.52 1wv7 s HIS 199 Cb -0.11 -2.05 -0.05 0.00 -0.13 0.00 0.00 32.58 30.25 1wv7 s HIS 199 CO 0.44 -0.82 0.28 0.00 -2.47 0.00 0.00 174.74 172.18 1wv7 s ALA 200 N 0.62 3.62 -0.17 1.58 0.00 0.38 -2.19 121.76 125.60 1wv7 s ALA 200 Ca 0.15 -0.47 -0.05 0.00 0.00 0.00 0.00 51.96 51.59 1wv7 s ALA 200 Cb -0.23 -2.35 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 1wv7 s ALA 200 CO -0.06 0.14 0.01 0.99 0.00 0.00 0.00 175.76 176.84 1wv7 s THR 201 N 0.32 4.31 -0.15 0.00 2.01 -0.54 -0.47 115.64 121.11 1wv7 s THR 201 Ca 0.16 -0.21 -0.19 0.00 0.31 0.00 0.00 61.69 61.76 1wv7 s THR 201 Cb -0.13 -2.92 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1wv7 s THR 201 CO 0.04 0.47 0.55 -2.28 -0.69 0.00 0.00 174.62 172.71 1wv7 s HIS 202 N 0.41 3.45 -0.09 4.92 2.46 -1.26 -0.94 115.29 124.24 1wv7 s HIS 202 Ca -0.01 0.91 -0.04 0.00 0.47 0.00 0.00 55.06 56.40 1wv7 s HIS 202 Cb -0.13 -2.67 0.05 0.00 -0.13 0.00 0.00 32.58 29.70 1wv7 s HIS 202 CO 0.02 0.01 0.18 -0.47 -2.47 0.00 0.00 174.74 172.00 1wv7 s TYR 203 N 1.21 -0.22 -1.16 3.88 5.04 0.31 -4.95 117.35 121.44 1wv7 s TYR 203 Ca 0.27 0.67 -0.13 0.00 -2.44 0.00 0.00 57.07 55.45 1wv7 s TYR 203 Cb -0.16 -0.22 0.02 0.00 0.35 0.00 0.00 41.96 41.95 1wv7 s TYR 203 CO 0.11 -0.28 0.25 0.54 -1.34 0.00 0.00 175.55 174.82 1wv7 n ARG 204 N 5.32 -0.68 0.00 4.97 1.74 -1.26 -1.35 116.66 125.40 1wv7 n ARG 204 Ca -0.05 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1wv7 n ARG 204 Cb 0.50 -2.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 1wv7 n ARG 204 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wv7 n GLY 205 N -2.14 2.18 3.25 -0.13 0.00 -1.26 -5.04 105.19 102.05 1wv7 n GLY 205 Ca -0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 1wv7 n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wv7 s THR 206 N -2.34 1.64 -0.12 2.61 2.01 -0.46 -5.13 115.64 113.85 1wv7 s THR 206 Ca 0.00 -1.24 -0.06 0.00 0.31 0.00 0.00 61.69 60.70 1wv7 s THR 206 Cb 0.00 -1.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 1wv7 s THR 206 CO 0.00 0.15 0.08 0.26 -0.69 0.00 0.00 174.62 174.42 1wv7 s TRP 207 N -0.86 3.38 0.11 4.92 0.52 -1.26 -0.53 118.94 125.22 1wv7 s TRP 207 Ca 0.07 0.32 0.07 0.00 0.02 0.00 0.00 56.10 56.59 1wv7 s TRP 207 Cb -0.09 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.27 1wv7 s TRP 207 CO 0.02 0.52 -0.18 0.71 0.02 0.00 0.00 176.95 178.04 1wv7 s TYR 208 N -0.65 1.61 -0.29 -1.98 1.51 -0.12 -2.94 117.35 114.49 1wv7 s TYR 208 Ca 0.12 -0.46 -0.29 0.00 -1.01 0.00 0.00 57.07 55.43 1wv7 s TYR 208 Cb -0.12 -0.86 0.01 0.00 -0.11 0.00 0.00 41.96 40.88 1wv7 s TYR 208 CO 0.02 0.19 1.05 -1.17 -1.11 0.00 0.00 175.55 174.54 1wv7 s LEU 209 N -2.13 3.98 -0.00 -1.29 2.96 0.31 -1.47 118.68 121.05 1wv7 s LEU 209 Ca 0.07 1.12 0.01 0.00 -0.22 0.00 0.00 54.13 55.11 1wv7 s LEU 209 Cb -0.08 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.07 1wv7 s LEU 209 CO 0.04 -0.81 0.02 0.35 -1.32 0.00 0.00 176.35 174.62 1wv7 n THR 210 N 5.71 0.00 -3.95 3.68 -2.24 -0.93 -4.54 114.28 112.02 1wv7 n THR 210 Ca 0.12 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.79 1wv7 n THR 210 Cb 0.47 0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 69.05 1wv7 n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1wv7 s GLY 211 N -2.14 0.37 -0.04 3.38 0.00 -1.03 -2.65 107.32 105.20 1wv7 s GLY 211 Ca -0.00 -0.72 0.02 0.00 0.00 0.00 0.00 44.72 44.02 1wv7 s GLY 211 CO 0.03 -0.52 -0.09 -0.42 0.00 0.00 0.00 173.10 172.10 1wv7 s ILE 212 N -3.98 0.86 -0.04 0.90 1.01 -1.08 -1.91 121.20 116.96 1wv7 s ILE 212 Ca 0.19 -0.36 -0.29 0.00 0.00 0.00 0.00 60.65 60.19 1wv7 s ILE 212 Cb -0.01 -0.79 -0.08 0.00 0.01 0.00 0.00 42.46 41.59 1wv7 s ILE 212 CO 0.07 0.28 2.05 -0.69 0.00 0.00 0.00 174.94 176.65 1wv7 s VAL 213 N 0.50 3.02 0.03 2.92 1.01 -0.95 -1.06 120.40 125.87 1wv7 s VAL 213 Ca -0.09 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1wv7 s VAL 213 Cb -0.12 -3.01 -0.00 0.00 0.00 0.00 0.00 36.38 33.24 1wv7 s VAL 213 CO 0.01 -0.00 -0.03 -0.24 0.00 0.00 0.00 175.10 174.84 1wv7 n SER 214 N 8.82 0.67 -1.79 3.32 2.88 -1.07 -0.97 113.62 125.48 1wv7 n SER 214 Ca 0.23 0.09 -0.04 0.00 -1.33 0.00 0.00 58.87 57.82 1wv7 n SER 214 Cb 0.42 -0.25 0.01 0.00 -0.75 0.00 0.00 64.21 63.64 1wv7 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1wv7 n TRP 215 N -3.11 -1.44 0.00 0.66 4.27 -0.83 -4.95 117.44 112.02 1wv7 n TRP 215 Ca -0.01 -0.85 0.00 0.00 -3.89 0.00 0.00 57.50 52.75 1wv7 n TRP 215 Cb 0.04 0.37 0.00 0.00 -1.36 0.00 0.00 31.31 30.36 1wv7 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1wv7 n GLY 216 N -0.24 2.08 3.56 -1.67 0.00 -1.26 -0.51 105.19 107.14 1wv7 n GLY 216 Ca -0.03 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 1wv7 n GLY 216 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wv7 s GLN 217 N -2.00 2.91 4.58 1.61 2.00 -1.26 -4.79 119.66 122.71 1wv7 s GLN 217 Ca 0.00 -0.33 0.00 0.00 -2.00 0.00 0.00 55.36 53.03 1wv7 s GLN 217 Cb 0.00 -4.91 0.00 0.00 0.80 0.00 0.00 33.01 28.90 1wv7 s GLN 217 CO 0.00 -2.81 0.00 0.41 -0.50 0.00 0.00 175.29 172.39 1wv7 n GLY 219 N 6.47 1.51 2.84 2.59 0.00 -1.26 -4.23 105.19 113.10 1wv7 n GLY 219 Ca 0.30 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 1wv7 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wv7 n ALA 221 N 5.01 -2.14 -2.10 0.00 0.00 -1.26 -4.51 120.51 115.51 1wv7 n ALA 221 Ca -0.10 -0.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.81 1wv7 n ALA 221 Cb 0.49 -2.67 -0.06 0.00 0.00 0.00 0.00 19.45 17.21 1wv7 n ALA 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1wv7 s THR 221 N -3.59 4.52 0.17 0.00 2.01 -1.26 -4.14 115.64 113.35 1wv7 s THR 221 Ca 0.11 1.48 -0.31 0.00 0.31 0.00 0.00 61.69 63.28 1wv7 s THR 221 Cb -0.03 -4.02 -0.10 0.00 0.01 0.00 0.00 72.50 68.36 1wv7 s THR 221 CO 0.81 0.50 1.56 -0.69 -0.69 0.00 0.00 174.62 176.11 1wv7 s VAL 222 N -1.17 2.60 0.00 3.82 1.01 -1.26 -2.03 120.40 123.36 1wv7 s VAL 222 Ca 0.34 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1wv7 s VAL 222 Cb -0.21 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1wv7 s VAL 222 CO 0.23 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1wv7 n GLY 223 N 3.63 0.56 3.23 4.51 0.00 0.02 -4.91 105.19 112.24 1wv7 n GLY 223 Ca 0.13 -0.83 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 1wv7 n GLY 223 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wv7 s HIS 224 N -2.00 0.01 0.19 1.61 4.02 -0.86 -1.59 115.29 116.67 1wv7 s HIS 224 Ca 0.00 -0.28 0.06 0.00 1.02 0.00 0.00 55.06 55.86 1wv7 s HIS 224 Cb 0.00 0.03 -0.05 0.00 -1.02 0.00 0.00 32.58 31.54 1wv7 s HIS 224 CO 0.00 -0.52 -0.11 -0.06 1.02 0.00 0.00 174.74 175.07 1wv7 s PHE 225 N -3.12 1.55 0.61 1.40 0.08 -1.26 -3.85 117.98 113.40 1wv7 s PHE 225 Ca -0.01 -0.69 -0.14 0.00 0.12 0.00 0.00 56.93 56.21 1wv7 s PHE 225 Cb 0.01 -0.78 -0.03 0.00 -0.57 0.00 0.00 43.02 41.66 1wv7 s PHE 225 CO -0.07 0.21 1.04 0.20 -0.10 0.00 0.00 175.22 176.50 1wv7 s GLY 226 N -3.27 1.93 -0.10 4.36 0.00 -0.82 -4.55 107.32 104.87 1wv7 s GLY 226 Ca 0.22 0.22 0.03 0.00 0.00 0.00 0.00 44.72 45.18 1wv7 s GLY 226 CO 0.05 0.52 -0.19 0.14 0.00 0.00 0.00 173.10 173.62 1wv7 s VAL 227 N -2.73 1.72 0.14 1.40 1.01 0.33 -2.14 120.40 120.13 1wv7 s VAL 227 Ca 0.60 -0.81 0.11 0.00 0.00 0.00 0.00 61.98 61.88 1wv7 s VAL 227 Cb -0.14 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1wv7 s VAL 227 CO 0.43 0.48 -0.26 -0.31 0.00 0.00 0.00 175.10 175.44 1wv7 s TYR 228 N 0.57 2.31 0.11 5.22 1.51 -0.39 -1.97 117.35 124.70 1wv7 s TYR 228 Ca -0.15 -0.38 -0.31 0.00 -1.01 0.00 0.00 57.07 55.23 1wv7 s TYR 228 Cb -0.17 -1.23 -0.08 0.00 -0.11 0.00 0.00 41.96 40.37 1wv7 s TYR 228 CO 0.05 0.37 1.49 0.99 -1.11 0.00 0.00 175.55 177.35 1wv7 s THR 229 N -1.19 3.10 -1.05 -0.71 2.01 -0.22 -2.18 115.64 115.39 1wv7 s THR 229 Ca 0.15 0.72 -0.22 0.00 0.31 0.00 0.00 61.69 62.65 1wv7 s THR 229 Cb -0.10 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 69.00 1wv7 s THR 229 CO 0.07 0.04 1.49 -0.60 -0.69 0.00 0.00 174.62 174.93 1wv7 s ARG 230 N 1.56 3.63 0.53 4.92 3.52 -0.25 -2.62 118.95 130.24 1wv7 s ARG 230 Ca 0.68 -1.22 0.29 0.00 -0.13 0.00 0.00 55.73 55.35 1wv7 s ARG 230 Cb -0.39 -5.38 1.45 0.00 -1.56 0.00 0.00 34.95 29.07 1wv7 s ARG 230 CO 0.30 -2.23 1.92 0.28 -0.81 0.00 0.00 175.30 174.77 1wv7 h VAL 231 N 6.65 0.61 -0.00 7.11 2.07 -1.82 -1.89 116.25 128.98 1wv7 h VAL 231 Ca 0.23 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.75 1wv7 h VAL 231 Cb 0.99 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1wv7 h VAL 231 CO 1.43 0.00 0.01 0.77 0.02 0.00 0.00 177.57 179.80 1wv7 h SER 232 N 0.01 0.00 1.42 0.57 4.64 -1.88 0.49 113.55 118.79 1wv7 h SER 232 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1wv7 h SER 232 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1wv7 h SER 232 CO -0.01 0.00 0.00 1.56 -0.87 0.00 0.00 176.83 177.51 1wv7 h GLN 233 N 0.00 0.00 -0.17 4.77 1.08 -1.70 -3.32 115.11 115.76 1wv7 h GLN 233 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1wv7 h GLN 233 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1wv7 h GLN 233 CO -0.00 0.00 0.00 0.66 -0.95 0.00 0.00 178.83 178.54 1wv7 n TYR 234 N -2.38 0.23 0.00 2.96 4.01 0.15 -4.79 117.16 117.35 1wv7 n TYR 234 Ca 0.05 -0.41 -0.13 0.00 -0.16 0.00 0.00 57.90 57.25 1wv7 n TYR 234 Cb 0.41 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.34 1wv7 n TYR 234 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1wv7 h ILE 235 N 1.25 0.11 0.00 -0.72 1.08 -1.64 0.18 117.51 117.76 1wv7 h ILE 235 Ca 0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.44 1wv7 h ILE 235 Cb 0.58 0.11 -0.00 0.00 -3.07 0.00 0.00 36.82 34.43 1wv7 h ILE 235 CO 0.00 0.00 -0.15 -0.33 -0.69 0.00 0.00 178.15 176.98 1wv7 h GLU 236 N -0.52 0.00 0.06 2.37 5.08 -1.88 -1.44 114.58 118.24 1wv7 h GLU 236 Ca 0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1wv7 h GLU 236 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1wv7 h GLU 236 CO -0.40 0.15 -0.03 2.35 -1.00 0.00 0.00 179.01 180.08 1wv7 h TRP 237 N 0.00 -0.07 -0.82 4.33 7.01 -1.48 -2.61 115.95 122.31 1wv7 h TRP 237 Ca -0.00 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 1wv7 h TRP 237 Cb 0.27 0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.32 1wv7 h TRP 237 CO 0.00 0.29 0.43 -0.07 -2.79 0.00 0.00 178.44 176.31 1wv7 h LEU 238 N -0.45 1.03 -0.36 0.65 3.38 -0.33 -2.82 115.31 116.41 1wv7 h LEU 238 Ca -0.01 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 1wv7 h LEU 238 Cb 0.40 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1wv7 h LEU 238 CO 0.01 0.84 -0.37 1.56 0.09 0.00 0.00 178.44 180.57 1wv7 h GLN 239 N 1.15 0.89 -0.42 1.13 4.20 -1.29 -1.69 115.11 119.09 1wv7 h GLN 239 Ca 0.29 -0.48 -0.08 0.00 0.06 0.00 0.00 58.65 58.44 1wv7 h GLN 239 Cb 0.05 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1wv7 h GLN 239 CO -0.04 1.12 -0.08 -0.22 -0.67 0.00 0.00 178.83 178.94 1wv7 h LYS 240 N 0.69 0.72 -0.32 1.46 3.64 -1.41 -2.86 116.57 118.48 1wv7 h LYS 240 Ca 0.06 -0.22 -0.18 0.00 -1.27 0.00 0.00 60.65 59.04 1wv7 h LYS 240 Cb 0.97 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1wv7 h LYS 240 CO 0.09 0.78 -0.49 -0.07 -2.27 0.00 0.00 179.45 177.49 1wv7 h LEU 241 N 0.66 0.99 -1.94 5.20 3.38 -1.41 -2.86 115.31 119.33 1wv7 h LEU 241 Ca 0.12 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 1wv7 h LEU 241 Cb 0.52 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1wv7 h LEU 241 CO 0.03 1.31 -0.03 0.24 0.09 0.00 0.00 178.44 180.08 1wv7 h MET 242 N 0.71 0.00 -0.01 1.13 2.86 -1.20 -1.57 114.93 116.85 1wv7 h MET 242 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1wv7 h MET 242 Cb 1.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.76 1wv7 h MET 242 CO 0.11 0.03 -0.32 0.54 1.06 0.00 0.00 176.91 178.34 1wv7 n ARG 243 N -3.18 1.08 -2.75 1.72 1.74 -1.09 -4.96 116.66 109.22 1wv7 n ARG 243 Ca -0.01 -0.76 -0.28 0.00 -0.77 0.00 0.00 57.85 56.04 1wv7 n ARG 243 Cb 0.24 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.18 1wv7 n ARG 243 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wv7 s SER 244 N -2.45 6.32 0.21 0.55 0.01 -0.59 -5.06 113.70 112.69 1wv7 s SER 244 Ca 0.23 0.93 -0.30 0.00 1.31 0.00 0.00 55.95 58.12 1wv7 s SER 244 Cb 0.19 -2.24 -0.08 0.00 0.21 0.00 0.00 66.02 64.09 1wv7 s SER 244 CO 0.52 -0.51 1.08 -1.61 0.41 0.00 0.00 173.24 173.13 1wv7 s GLU 245 N -4.50 4.64 0.22 12.44 2.02 -1.26 -4.99 118.70 127.28 1wv7 s GLU 245 Ca 0.47 1.71 -0.31 0.00 0.02 0.00 0.00 54.97 56.86 1wv7 s GLU 245 Cb -0.10 -3.25 -0.12 0.00 0.10 0.00 0.00 34.13 30.76 1wv7 s GLU 245 CO 0.41 0.17 1.68 -1.25 0.02 0.00 0.00 175.26 176.29 1wv7 s PRO 246 N -0.78 4.13 0.73 0.39 0.04 -1.26 -4.99 135.00 133.27 1wv7 s PRO 246 Ca 0.47 2.58 -0.11 0.00 0.04 0.00 0.00 61.00 63.97 1wv7 s PRO 246 Cb -0.30 -3.07 0.03 0.00 0.04 0.00 0.00 34.50 31.21 1wv7 s PRO 246 CO 0.36 -0.71 1.09 1.03 0.04 0.00 0.00 177.00 178.82 1wv7 s ARG 247 N 0.76 2.63 0.10 4.56 1.81 -1.26 -5.00 118.95 122.54 1wv7 s ARG 247 Ca 0.71 0.56 -0.27 0.00 -1.72 0.00 0.00 55.73 55.01 1wv7 s ARG 247 Cb -0.49 -1.99 -0.12 0.00 -0.45 0.00 0.00 34.95 31.90 1wv7 s ARG 247 CO 0.36 -1.22 1.66 -1.35 -0.68 0.00 0.00 175.30 174.07 1wv7 h PRO 248 N -0.79 -0.42 -7.84 3.54 0.11 -1.97 -3.45 132.00 121.17 1wv7 h PRO 248 Ca -0.46 0.03 -0.44 0.00 0.11 0.00 0.00 66.00 65.24 1wv7 h PRO 248 Cb 1.25 0.10 0.17 0.00 0.11 0.00 0.00 31.00 32.63 1wv7 h PRO 248 CO 0.62 -0.28 0.42 0.20 -0.21 0.00 0.00 178.00 178.75 1wv7 s GLY 249 N -2.29 1.81 -0.16 -0.55 0.00 -1.26 -5.03 107.32 99.85 1wv7 s GLY 249 Ca -0.15 -1.31 -0.16 0.00 0.00 0.00 0.00 44.72 43.09 1wv7 s GLY 249 CO 0.65 -0.50 0.22 -2.08 0.00 0.00 0.00 173.10 171.39 1wv7 h VAL 250 N -1.71 0.74 -3.48 1.40 2.07 -1.87 -3.46 116.25 109.94 1wv7 h VAL 250 Ca -0.44 -1.72 -0.53 0.00 0.82 0.00 0.00 66.70 64.83 1wv7 h VAL 250 Cb 1.22 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1wv7 h VAL 250 CO 0.33 0.25 0.38 -0.22 0.02 0.00 0.00 177.57 178.33 1wv7 s LEU 251 N -8.17 4.44 -0.03 2.57 2.96 -1.26 -1.27 118.68 117.92 1wv7 s LEU 251 Ca -0.18 1.76 -0.01 0.00 -0.22 0.00 0.00 54.13 55.48 1wv7 s LEU 251 Cb 0.02 -3.58 0.03 0.00 0.50 0.00 0.00 46.19 43.16 1wv7 s LEU 251 CO 0.42 -0.18 0.07 -0.22 -1.32 0.00 0.00 176.35 175.12 1wv7 s LEU 252 N 0.47 1.08 -0.29 -0.68 2.96 -0.71 -4.95 118.68 116.56 1wv7 s LEU 252 Ca 0.50 0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 54.48 1wv7 s LEU 252 Cb -0.23 0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.58 1wv7 s LEU 252 CO 0.29 -0.12 0.07 -0.13 -1.32 0.00 0.00 176.35 175.15 1wv7 s ARG 253 N 0.94 3.12 -0.15 1.98 3.00 -1.26 -1.88 118.95 124.70 1wv7 s ARG 253 Ca -0.08 -0.84 -0.07 0.00 0.00 0.00 0.00 55.73 54.75 1wv7 s ARG 253 Cb -0.10 -3.34 -0.04 0.00 0.00 0.00 0.00 34.95 31.46 1wv7 s ARG 253 CO -0.03 -0.42 0.10 0.00 0.00 0.00 0.00 175.30 174.94 1wv7 s ALA 254 N 1.50 3.63 0.78 2.13 0.00 -0.96 -4.71 121.76 124.13 1wv7 s ALA 254 Ca 0.03 -0.70 -0.15 0.00 0.00 0.00 0.00 51.96 51.13 1wv7 s ALA 254 Cb -0.17 -1.92 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1wv7 s ALA 254 CO 0.02 0.40 0.53 -0.35 0.00 0.00 0.00 175.76 176.36 1wv7 n PRO 255 N 2.73 0.16 -3.67 0.00 -0.04 -1.26 -0.61 135.00 132.31 1wv7 n PRO 255 Ca -0.18 0.10 -0.10 0.00 -0.04 0.00 0.00 63.50 63.28 1wv7 n PRO 255 Cb 0.53 -1.87 -0.09 0.00 -0.04 0.00 0.00 33.50 32.04 1wv7 n PRO 255 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1wv7 s PHE 256 N -2.03 -0.77 -0.25 0.54 5.36 -1.26 -4.68 117.98 114.88 1wv7 s PHE 256 Ca 0.64 1.63 0.00 0.00 -0.96 0.00 0.00 56.93 58.24 1wv7 s PHE 256 Cb -0.31 0.39 0.00 0.00 -0.34 0.00 0.00 43.02 42.76 1wv7 s PHE 256 CO 0.60 -0.40 0.06 -2.30 -1.46 0.00 0.00 175.22 171.72