#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwv s ILE 8 N 0.00 2.02 0.59 5.15 1.01 -1.26 -5.02 121.20 123.70 1bwv s ILE 8 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.56 1bwv s ILE 8 Cb 0.00 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 1bwv s ILE 8 CO 0.00 -0.00 0.98 -0.75 0.00 0.00 0.00 174.94 175.17 1bwv s LYS 9 N -3.47 3.58 -0.37 2.79 2.47 -1.26 -5.08 119.74 118.40 1bwv s LYS 9 Ca 0.82 0.64 0.04 0.00 -1.56 0.00 0.00 55.97 55.91 1bwv s LYS 9 Cb -0.37 -2.14 0.16 0.00 -1.46 0.00 0.00 37.83 34.03 1bwv s LYS 9 CO 0.41 -0.50 0.42 1.21 0.16 0.00 0.00 175.35 177.05 1bwv s ASN 10 N -4.17 0.60 0.00 1.43 3.84 -1.26 -4.69 114.94 110.69 1bwv s ASN 10 Ca 0.54 -1.29 0.00 0.00 0.21 0.00 0.00 52.86 52.31 1bwv s ASN 10 Cb -0.11 0.87 0.00 0.00 -0.55 0.00 0.00 41.25 41.47 1bwv s ASN 10 CO 0.52 -0.26 0.00 -1.54 -2.79 0.00 0.00 177.10 173.04 1bwv n SER 11 N 4.41 0.00 0.32 -4.21 3.41 -1.26 -4.94 113.62 111.36 1bwv n SER 11 Ca 0.10 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.91 1bwv n SER 11 Cb 0.48 0.00 1.11 0.00 -0.26 0.00 0.00 64.21 65.54 1bwv n SER 11 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1bwv h ARG 12 N 0.00 0.00 -0.48 4.33 9.65 -2.03 -2.69 114.38 123.17 1bwv h ARG 12 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1bwv h ARG 12 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1bwv h ARG 12 CO 0.00 0.00 0.00 0.66 2.80 0.00 0.00 179.97 183.43 1bwv n TYR 13 N -3.32 1.70 -3.02 2.20 4.01 -1.26 -4.95 117.16 112.52 1bwv n TYR 13 Ca -0.03 -0.77 -0.36 0.00 -0.16 0.00 0.00 57.90 56.58 1bwv n TYR 13 Cb 0.08 -0.44 -0.06 0.00 -0.31 0.00 0.00 39.34 38.61 1bwv n TYR 13 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 1bwv s GLU 14 N -2.74 4.29 0.25 -0.72 -1.05 -1.02 -4.46 118.70 113.25 1bwv s GLU 14 Ca 0.50 0.95 -0.31 0.00 -0.15 0.00 0.00 54.97 55.97 1bwv s GLU 14 Cb 0.39 -2.77 -0.14 0.00 -0.44 0.00 0.00 34.13 31.18 1bwv s GLU 14 CO 0.14 0.32 1.32 0.43 0.95 0.00 0.00 175.26 178.41 1bwv n SER 15 N 0.48 2.42 0.00 0.83 7.64 -1.26 -4.81 113.62 118.91 1bwv n SER 15 Ca -0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1bwv n SER 15 Cb 0.51 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 1bwv n SER 15 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bwv n GLY 16 N 1.83 2.12 3.56 0.23 0.00 -1.26 -5.01 105.19 106.67 1bwv n GLY 16 Ca 0.11 -1.44 -0.36 0.00 0.00 0.00 0.00 46.02 44.33 1bwv n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bwv s VAL 17 N -1.91 4.77 0.14 1.61 1.01 -1.26 -1.27 120.40 123.48 1bwv s VAL 17 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 61.98 62.04 1bwv s VAL 17 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1bwv s VAL 17 CO 0.00 0.36 -0.18 0.27 0.00 0.00 0.00 175.10 175.55 1bwv s ILE 18 N 1.15 1.70 0.57 2.22 -4.36 -1.26 -5.02 121.20 116.20 1bwv s ILE 18 Ca 0.05 -1.76 -0.21 0.00 -0.26 0.00 0.00 60.65 58.48 1bwv s ILE 18 Cb -0.14 -1.69 -0.04 0.00 1.25 0.00 0.00 42.46 41.84 1bwv s ILE 18 CO 0.04 -0.25 1.30 -2.16 0.24 0.00 0.00 174.94 174.11 1bwv s PRO 19 N -2.48 3.05 0.49 0.37 0.04 -1.26 -4.85 135.00 130.35 1bwv s PRO 19 Ca 0.11 2.08 0.22 0.00 0.04 0.00 0.00 61.00 63.45 1bwv s PRO 19 Cb -0.07 -2.12 1.26 0.00 0.04 0.00 0.00 34.50 33.61 1bwv s PRO 19 CO 0.05 -1.22 1.95 1.88 0.04 0.00 0.00 177.00 179.71 1bwv h TYR 20 N 1.22 0.21 -0.41 0.56 0.05 -1.91 -0.02 116.97 116.67 1bwv h TYR 20 Ca -0.51 0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.20 1bwv h TYR 20 Cb 1.30 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.96 1bwv h TYR 20 CO 0.46 0.08 -0.07 0.00 -1.05 0.00 0.00 178.16 177.58 1bwv h ALA 21 N 1.67 1.12 0.00 3.88 0.00 -1.88 -2.40 119.26 121.65 1bwv h ALA 21 Ca 0.33 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bwv h ALA 21 Cb 1.03 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1bwv h ALA 21 CO -0.06 0.56 -0.00 0.87 0.00 0.00 0.00 179.25 180.62 1bwv h LYS 22 N 0.64 0.00 0.00 0.00 6.56 -1.38 -3.20 116.57 119.19 1bwv h LYS 22 Ca 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.71 1bwv h LYS 22 Cb 0.50 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.16 1bwv h LYS 22 CO 0.03 0.00 0.00 -1.33 -2.06 0.00 0.00 179.45 176.09 1bwv n MET 22 N -3.10 0.22 0.00 3.15 2.81 -0.87 -4.89 117.12 114.45 1bwv n MET 22 Ca 0.03 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1bwv n MET 22 Cb 0.48 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 1bwv n MET 22 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bwv n GLY 23 N 0.82 1.05 0.46 3.03 0.00 -1.21 -5.00 105.19 104.34 1bwv n GLY 23 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 1bwv n GLY 23 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1bwv n TYR 24 N -1.11 0.00 -4.11 1.61 4.01 -1.20 -4.71 117.16 111.65 1bwv n TYR 24 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.40 1bwv n TYR 24 Cb 0.00 -0.05 -0.15 0.00 -0.31 0.00 0.00 39.34 38.83 1bwv n TYR 24 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1bwv s TRP 25 N -2.27 2.85 -0.35 -0.72 -0.00 -1.26 -0.57 118.94 116.62 1bwv s TRP 25 Ca 0.28 -1.25 0.03 0.00 -0.00 0.00 0.00 56.10 55.17 1bwv s TRP 25 Cb 0.20 -1.99 0.16 0.00 -0.00 0.00 0.00 33.47 31.84 1bwv s TRP 25 CO 0.44 -0.64 0.42 1.21 -0.00 0.00 0.00 176.95 178.37 1bwv s ASN 26 N 1.27 0.62 0.09 5.86 3.84 -0.45 -4.94 114.94 121.24 1bwv s ASN 26 Ca 0.03 -1.11 0.14 0.00 0.21 0.00 0.00 52.86 52.13 1bwv s ASN 26 Cb -0.14 0.90 0.61 0.00 -0.55 0.00 0.00 41.25 42.06 1bwv s ASN 26 CO -0.07 -0.28 1.42 -0.81 -2.79 0.00 0.00 177.10 174.58 1bwv n PRO 27 N 4.62 0.06 -0.16 0.43 -0.04 -1.26 -2.50 135.00 136.15 1bwv n PRO 27 Ca 0.08 0.40 0.11 0.00 -0.04 0.00 0.00 63.50 64.04 1bwv n PRO 27 Cb 0.48 -1.63 0.19 0.00 -0.04 0.00 0.00 33.50 32.49 1bwv n PRO 27 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1bwv n ASP 28 N -1.75 3.31 -4.74 3.54 8.00 -1.26 -4.90 116.55 118.75 1bwv n ASP 28 Ca 0.02 -1.96 -0.42 0.00 0.71 0.00 0.00 54.79 53.14 1bwv n ASP 28 Cb 0.12 -0.21 -0.02 0.00 -0.02 0.00 0.00 41.12 40.99 1bwv n ASP 28 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1bwv s TYR 29 N -1.47 2.99 -0.27 1.24 5.04 -1.04 -4.97 117.35 118.88 1bwv s TYR 29 Ca 0.35 0.87 -0.13 0.00 -2.44 0.00 0.00 57.07 55.72 1bwv s TYR 29 Cb 0.21 -3.89 -0.04 0.00 0.35 0.00 0.00 41.96 38.59 1bwv s TYR 29 CO 0.29 -3.03 0.29 -0.65 -1.34 0.00 0.00 175.55 171.11 1bwv s GLN 30 N 0.07 4.01 -0.09 4.97 -1.52 -1.26 -5.03 119.66 120.81 1bwv s GLN 30 Ca 0.63 -0.11 -0.29 0.00 -1.95 0.00 0.00 55.36 53.63 1bwv s GLN 30 Cb -0.43 -3.64 -0.05 0.00 -0.22 0.00 0.00 33.01 28.67 1bwv s GLN 30 CO 0.40 -0.19 1.66 0.08 -0.25 0.00 0.00 175.29 176.99 1bwv s VAL 31 N 1.81 3.59 0.32 1.09 1.01 -1.26 -4.99 120.40 121.97 1bwv s VAL 31 Ca 0.11 0.70 -0.26 0.00 0.00 0.00 0.00 61.98 62.53 1bwv s VAL 31 Cb -0.16 -3.49 -0.10 0.00 0.00 0.00 0.00 36.38 32.64 1bwv s VAL 31 CO 0.10 -0.10 0.95 -0.54 0.00 0.00 0.00 175.10 175.51 1bwv s LYS 32 N 4.22 4.57 0.46 2.72 1.02 -1.26 -4.95 119.74 126.52 1bwv s LYS 32 Ca 0.74 1.36 0.31 0.00 0.02 0.00 0.00 55.97 58.39 1bwv s LYS 32 Cb -0.32 -2.81 1.68 0.00 -0.52 0.00 0.00 37.83 35.86 1bwv s LYS 32 CO 0.30 0.26 1.95 -0.44 -0.92 0.00 0.00 175.35 176.50 1bwv h ASP 33 N 3.19 0.00 -0.02 2.83 3.32 -2.03 -1.40 116.42 122.31 1bwv h ASP 33 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1bwv h ASP 33 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1bwv h ASP 33 CO 0.65 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 178.52 1bwv n THR 34 N -2.59 0.01 -2.88 0.35 -2.24 -1.26 -4.54 114.28 101.13 1bwv n THR 34 Ca -0.02 -0.28 -0.34 0.00 -2.27 0.00 0.00 64.05 61.14 1bwv n THR 34 Cb 0.05 0.60 -0.07 0.00 -2.10 0.00 0.00 70.33 68.81 1bwv n THR 34 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bwv s ASP 35 N -1.98 7.03 -0.16 3.42 1.01 -0.53 -3.71 116.67 121.75 1bwv s ASP 35 Ca 0.37 1.65 -0.19 0.00 0.71 0.00 0.00 52.55 55.09 1bwv s ASP 35 Cb 0.21 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.59 1bwv s ASP 35 CO 0.33 -0.23 0.53 -0.69 0.21 0.00 0.00 175.17 175.32 1bwv s VAL 36 N -1.95 5.12 -0.01 -1.27 1.01 0.05 -4.15 120.40 119.20 1bwv s VAL 36 Ca 0.56 1.02 0.04 0.00 0.00 0.00 0.00 61.98 63.60 1bwv s VAL 36 Cb -0.12 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 1bwv s VAL 36 CO 0.17 0.23 -0.12 -0.76 0.00 0.00 0.00 175.10 174.62 1bwv s LEU 37 N 1.24 2.88 0.01 3.92 1.43 -0.51 -0.26 118.68 127.38 1bwv s LEU 37 Ca 0.26 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.18 1bwv s LEU 37 Cb -0.16 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 1bwv s LEU 37 CO 0.11 0.31 -0.10 0.00 0.23 0.00 0.00 176.35 176.89 1bwv s ALA 38 N -0.86 0.81 -0.18 4.21 0.00 -0.21 -0.47 121.76 125.06 1bwv s ALA 38 Ca 0.14 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.56 1bwv s ALA 38 Cb -0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1bwv s ALA 38 CO 0.04 0.17 -0.08 -1.17 0.00 0.00 0.00 175.76 174.72 1bwv s LEU 39 N -0.54 2.84 0.03 0.00 2.96 -0.12 -1.25 118.68 122.59 1bwv s LEU 39 Ca 0.02 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 53.63 1bwv s LEU 39 Cb -0.05 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 1bwv s LEU 39 CO 0.00 0.06 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.60 1bwv s PHE 40 N 0.98 2.70 -0.41 5.38 0.08 -0.41 -1.02 117.98 125.28 1bwv s PHE 40 Ca -0.01 -0.16 -0.12 0.00 0.12 0.00 0.00 56.93 56.76 1bwv s PHE 40 Cb -0.15 -1.52 0.05 0.00 -0.57 0.00 0.00 43.02 40.83 1bwv s PHE 40 CO -0.00 0.31 0.27 0.50 -0.10 0.00 0.00 175.22 176.20 1bwv s ARG 41 N -1.47 2.84 -0.20 0.44 3.52 0.23 -0.65 118.95 123.66 1bwv s ARG 41 Ca 0.16 -1.20 -0.08 0.00 -0.13 0.00 0.00 55.73 54.48 1bwv s ARG 41 Cb -0.11 -3.87 -0.04 0.00 -1.56 0.00 0.00 34.95 29.37 1bwv s ARG 41 CO 0.07 -0.83 0.08 0.08 -0.81 0.00 0.00 175.30 173.89 1bwv s VAL 42 N 1.57 4.88 -0.41 7.11 1.01 0.40 -1.24 120.40 133.73 1bwv s VAL 42 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 1bwv s VAL 42 Cb -0.21 -3.22 0.11 0.00 0.00 0.00 0.00 36.38 33.06 1bwv s VAL 42 CO 0.06 0.43 0.21 -0.89 0.00 0.00 0.00 175.10 174.91 1bwv s THR 43 N 0.61 3.34 0.78 3.92 2.01 -0.20 -0.91 115.64 125.19 1bwv s THR 43 Ca 0.04 -2.04 -0.11 0.00 0.31 0.00 0.00 61.69 59.90 1bwv s THR 43 Cb -0.13 -3.28 0.06 0.00 0.01 0.00 0.00 72.50 69.16 1bwv s THR 43 CO 0.01 -0.69 1.11 -2.16 -0.69 0.00 0.00 174.62 172.20 1bwv s PRO 44 N 1.15 2.11 0.58 4.92 0.04 -1.26 -0.24 135.00 142.30 1bwv s PRO 44 Ca 0.08 1.29 -0.18 0.00 0.04 0.00 0.00 61.00 62.23 1bwv s PRO 44 Cb -0.23 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1bwv s PRO 44 CO -0.04 -1.77 1.14 -0.65 0.04 0.00 0.00 177.00 175.71 1bwv s GLN 45 N -4.70 3.16 -0.12 4.56 -1.52 -0.34 -4.37 119.66 116.33 1bwv s GLN 45 Ca 0.64 1.60 -0.38 0.00 -1.95 0.00 0.00 55.36 55.26 1bwv s GLN 45 Cb -0.19 -1.98 -0.16 0.00 -0.22 0.00 0.00 33.01 30.46 1bwv s GLN 45 CO 0.54 -1.00 1.58 -0.35 -0.25 0.00 0.00 175.29 175.80 1bwv n PRO 46 N -1.61 1.19 0.00 2.91 -0.04 -1.26 -1.61 135.00 134.58 1bwv n PRO 46 Ca 0.12 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 1bwv n PRO 46 Cb 0.51 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.86 1bwv n PRO 46 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bwv n GLY 47 N 3.49 3.18 3.69 0.55 0.00 -1.26 -5.04 105.19 109.80 1bwv n GLY 47 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 1bwv n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bwv s VAL 48 N -2.85 4.93 0.18 1.61 1.01 -0.63 -5.01 120.40 119.63 1bwv s VAL 48 Ca 0.00 1.62 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 1bwv s VAL 48 Cb 0.00 -4.13 -0.10 0.00 0.00 0.00 0.00 36.38 32.16 1bwv s VAL 48 CO 0.00 0.12 1.51 -0.62 0.00 0.00 0.00 175.10 176.11 1bwv s ASP 49 N 1.03 6.64 0.31 3.32 2.15 -1.26 -4.75 116.67 124.10 1bwv s ASP 49 Ca 0.40 2.58 0.07 0.00 0.43 0.00 0.00 52.55 56.03 1bwv s ASP 49 Cb -0.17 -2.60 0.81 0.00 -0.30 0.00 0.00 42.92 40.65 1bwv s ASP 49 CO 0.16 -0.77 1.75 1.55 -0.17 0.00 0.00 175.17 177.69 1bwv h PRO 50 N 6.37 0.62 -0.79 4.34 0.13 -1.96 -0.54 132.00 140.18 1bwv h PRO 50 Ca -0.43 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1bwv h PRO 50 Cb 1.21 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.16 1bwv h PRO 50 CO 0.87 0.41 0.32 0.82 -0.23 0.00 0.00 178.00 180.20 1bwv h ILE 51 N 0.64 1.26 -0.31 -3.56 2.04 -1.99 -0.36 117.51 115.23 1bwv h ILE 51 Ca 0.61 -0.80 -0.14 0.00 1.00 0.00 0.00 64.86 65.53 1bwv h ILE 51 Cb 1.07 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1bwv h ILE 51 CO -0.44 0.33 -0.37 -0.08 0.00 0.00 0.00 178.15 177.59 1bwv h GLU 52 N 1.15 0.71 -0.45 2.37 4.57 -1.51 -0.84 114.58 120.57 1bwv h GLU 52 Ca 0.26 -0.35 -0.06 0.00 -1.18 0.00 0.00 59.36 58.03 1bwv h GLU 52 Cb 0.20 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1bwv h GLU 52 CO -0.02 0.96 0.03 0.00 -1.18 0.00 0.00 179.01 178.80 1bwv h ALA 53 N 1.00 0.60 -0.57 2.92 0.00 -0.93 0.98 119.26 123.27 1bwv h ALA 53 Ca 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1bwv h ALA 53 Cb 0.90 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1bwv h ALA 53 CO 0.08 0.36 0.19 0.00 0.00 0.00 0.00 179.25 179.87 1bwv h ALA 54 N 0.92 0.74 -0.60 0.00 0.00 -0.89 -1.33 119.26 118.11 1bwv h ALA 54 Ca 0.13 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1bwv h ALA 54 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1bwv h ALA 54 CO 0.02 0.40 0.20 0.00 0.00 0.00 0.00 179.25 179.86 1bwv h ALA 55 N 1.05 1.23 -0.53 0.00 0.00 -1.01 -1.06 119.26 118.94 1bwv h ALA 55 Ca 0.18 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1bwv h ALA 55 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1bwv h ALA 55 CO -0.01 0.55 0.14 0.00 0.00 0.00 0.00 179.25 179.93 1bwv h ALA 56 N 1.35 0.69 0.09 0.00 0.00 -0.20 0.58 119.26 121.76 1bwv h ALA 56 Ca 0.20 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bwv h ALA 56 Cb 0.23 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1bwv h ALA 56 CO -0.01 0.38 -0.04 0.28 0.00 0.00 0.00 179.25 179.86 1bwv h VAL 57 N 0.74 1.01 -0.78 0.00 2.07 -0.94 -1.40 116.25 116.95 1bwv h VAL 57 Ca 0.17 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.42 1bwv h VAL 57 Cb 0.32 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 1bwv h VAL 57 CO 0.00 0.08 0.48 0.00 0.02 0.00 0.00 177.57 178.15 1bwv h ALA 58 N 0.64 1.05 0.17 1.67 0.00 -1.07 -1.70 119.26 120.02 1bwv h ALA 58 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1bwv h ALA 58 Cb 0.22 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1bwv h ALA 58 CO 0.02 0.23 -0.08 0.78 0.00 0.00 0.00 179.25 180.20 1bwv h GLY 59 N 0.90 -0.24 2.00 0.00 0.00 -0.74 -2.89 103.07 102.10 1bwv h GLY 59 Ca 0.33 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1bwv h GLY 59 CO -0.15 -0.09 0.00 1.18 0.00 0.00 0.00 176.54 177.49 1bwv n GLU 60 N -5.08 0.13 -0.07 4.80 -0.58 -0.54 -1.19 120.64 118.12 1bwv n GLU 60 Ca -0.09 0.22 0.12 0.00 -0.42 0.00 0.00 57.16 56.99 1bwv n GLU 60 Cb 0.20 -1.69 0.31 0.00 -0.57 0.00 0.00 31.44 29.69 1bwv n GLU 60 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1bwv n SER 61 N -1.93 2.33 0.00 1.62 3.41 -0.65 -4.79 113.62 113.61 1bwv n SER 61 Ca 0.05 -1.79 0.00 0.00 -0.26 0.00 0.00 58.87 56.87 1bwv n SER 61 Cb 0.31 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1bwv n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1bwv n SER 62 N 0.78 0.00 0.00 4.04 3.41 -0.90 -4.58 113.62 116.37 1bwv n SER 62 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1bwv n SER 62 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1bwv n SER 62 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1bwv n THR 63 N -2.42 0.00 -2.22 6.66 -2.24 -0.69 -5.01 114.28 108.36 1bwv n THR 63 Ca 0.00 -0.03 -0.28 0.00 -2.27 0.00 0.00 64.05 61.47 1bwv n THR 63 Cb 0.00 0.35 0.03 0.00 -2.10 0.00 0.00 70.33 68.61 1bwv n THR 63 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bwv s ALA 64 N -0.30 3.16 0.36 6.98 0.00 -0.33 -5.03 121.76 126.59 1bwv s ALA 64 Ca 0.00 -0.53 0.07 0.00 0.00 0.00 0.00 51.96 51.50 1bwv s ALA 64 Cb 0.00 -2.77 -0.02 0.00 0.00 0.00 0.00 23.12 20.32 1bwv s ALA 64 CO 0.00 -0.87 0.24 -2.37 0.00 0.00 0.00 175.76 172.77 1bwv n THR 65 N -2.70 0.00 0.31 0.00 5.66 -1.26 -4.55 114.28 111.73 1bwv n THR 65 Ca 0.05 -2.42 0.16 0.00 -3.05 0.00 0.00 64.05 58.79 1bwv n THR 65 Cb 0.57 1.11 0.74 0.00 -1.55 0.00 0.00 70.33 71.19 1bwv n THR 65 CO 0.00 0.00 0.00 4.11 -3.05 0.00 0.00 175.07 176.13 1bwv h TRP 66 N 1.95 0.00 -3.29 1.09 5.08 -1.99 -3.44 115.95 115.35 1bwv h TRP 66 Ca -0.26 0.00 -0.37 0.00 1.08 0.00 0.00 58.89 59.34 1bwv h TRP 66 Cb 1.20 0.00 -0.14 0.00 -3.00 0.00 0.00 29.16 27.22 1bwv h TRP 66 CO 0.00 0.00 -0.68 -0.08 -1.28 0.00 0.00 178.44 176.40 1bwv s THR 67 N -3.67 1.15 0.16 0.12 -1.32 -1.26 -4.68 115.64 106.15 1bwv s THR 67 Ca 0.00 -2.06 -0.30 0.00 -1.21 0.00 0.00 61.69 58.12 1bwv s THR 67 Cb 0.10 -2.14 -0.08 0.00 -1.51 0.00 0.00 72.50 68.87 1bwv s THR 67 CO 0.44 -0.50 1.28 -0.69 -2.21 0.00 0.00 174.62 172.94 1bwv s VAL 68 N -3.34 3.41 -0.12 5.08 1.01 -0.40 -5.01 120.40 121.03 1bwv s VAL 68 Ca 0.24 1.11 0.03 0.00 0.00 0.00 0.00 61.98 63.36 1bwv s VAL 68 Cb 0.04 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.71 1bwv s VAL 68 CO 0.05 0.15 -0.21 0.68 0.00 0.00 0.00 175.10 175.77 1bwv s VAL 69 N 0.36 1.90 0.50 2.92 -7.23 -1.26 -4.56 120.40 113.03 1bwv s VAL 69 Ca 0.57 -0.90 0.29 0.00 -1.81 0.00 0.00 61.98 60.13 1bwv s VAL 69 Cb -0.35 -1.67 0.32 0.00 0.56 0.00 0.00 36.38 35.24 1bwv s VAL 69 CO 0.35 0.52 2.16 4.11 -0.31 0.00 0.00 175.10 181.94 1bwv h TRP 70 N 7.13 0.00 0.00 2.82 5.08 -1.96 -3.08 115.95 125.94 1bwv h TRP 70 Ca -0.28 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.69 1bwv h TRP 70 Cb 1.20 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 1bwv h TRP 70 CO 0.47 0.06 0.03 1.79 -1.28 0.00 0.00 178.44 179.51 1bwv h THR 71 N 0.00 0.00 -0.95 0.12 1.35 -1.95 -1.01 112.91 110.47 1bwv h THR 71 Ca -0.00 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 66.02 1bwv h THR 71 Cb 0.17 0.51 -0.08 0.00 -1.73 0.00 0.00 68.15 67.02 1bwv h THR 71 CO 0.01 0.00 0.60 0.44 -0.25 0.00 0.00 175.52 176.32 1bwv h ASP 72 N 0.00 0.71 0.16 5.36 3.32 -1.93 -1.14 116.42 122.91 1bwv h ASP 72 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1bwv h ASP 72 Cb 0.06 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1bwv h ASP 72 CO 0.00 0.33 0.00 -0.07 -1.72 0.00 0.00 179.24 177.78 1bwv h LEU 73 N 0.74 0.00 -0.72 1.55 4.07 -1.45 -0.15 115.31 119.35 1bwv h LEU 73 Ca 0.49 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.45 1bwv h LEU 73 Cb 0.77 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.51 1bwv h LEU 73 CO -0.26 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.28 1bwv n LEU 74 N -2.86 1.07 -4.38 1.67 4.77 -0.43 -4.87 117.00 111.96 1bwv n LEU 74 Ca -0.02 -0.47 -0.19 0.00 -0.03 0.00 0.00 56.01 55.30 1bwv n LEU 74 Cb 0.10 -0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 1bwv n LEU 74 CO 0.19 0.24 -0.25 0.42 -1.33 0.00 0.00 177.39 176.65 1bwv s THR 75 N -1.83 0.77 -1.40 -5.08 -4.23 -0.07 -5.02 115.64 98.78 1bwv s THR 75 Ca 0.26 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.66 1bwv s THR 75 Cb 0.13 -2.66 0.08 0.00 1.34 0.00 0.00 72.50 71.39 1bwv s THR 75 CO 0.21 0.00 2.17 0.00 -0.54 0.00 0.00 174.62 176.46 1bwv n ALA 76 N -0.59 5.73 -0.27 3.99 0.00 -1.26 -4.79 120.51 123.32 1bwv n ALA 76 Ca -0.01 -4.02 0.07 0.00 0.00 0.00 0.00 53.44 49.48 1bwv n ALA 76 Cb 0.66 -3.29 0.21 0.00 0.00 0.00 0.00 19.45 17.04 1bwv n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bwv h ALA 77 N 5.75 1.11 -0.18 0.00 0.00 -1.94 -1.18 119.26 122.82 1bwv h ALA 77 Ca 0.54 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.64 1bwv h ALA 77 Cb 0.59 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1bwv h ALA 77 CO 1.77 -0.28 0.13 -0.44 0.00 0.00 0.00 179.25 180.43 1bwv h ASP 78 N 0.38 0.00 0.22 0.00 3.32 -1.93 -1.43 116.42 116.98 1bwv h ASP 78 Ca 0.45 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.15 1bwv h ASP 78 Cb 0.75 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.31 1bwv h ASP 78 CO -0.47 0.00 -1.71 0.25 -1.72 0.00 0.00 179.24 175.60 1bwv h LEU 79 N 0.00 0.63 -0.62 1.55 7.12 -1.63 -3.36 115.31 118.99 1bwv h LEU 79 Ca 0.09 -0.90 -0.04 0.00 0.13 0.00 0.00 57.88 57.16 1bwv h LEU 79 Cb 0.35 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.27 1bwv h LEU 79 CO -0.00 1.75 -0.18 1.88 -0.13 0.00 0.00 178.44 181.76 1bwv h TYR 80 N 0.11 0.00 -3.27 1.25 0.05 -1.10 -3.43 116.97 110.58 1bwv h TYR 80 Ca -0.33 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 57.93 1bwv h TYR 80 Cb 2.10 0.00 0.06 0.00 1.01 0.00 0.00 36.73 39.90 1bwv h TYR 80 CO 0.10 0.18 0.80 1.03 -1.05 0.00 0.00 178.16 179.23 1bwv s ARG 81 N -3.38 4.23 0.38 4.88 0.52 -0.60 -4.70 118.95 120.28 1bwv s ARG 81 Ca 0.03 2.36 -0.21 0.00 -0.52 0.00 0.00 55.73 57.39 1bwv s ARG 81 Cb 0.08 -3.10 -0.10 0.00 0.52 0.00 0.00 34.95 32.34 1bwv s ARG 81 CO 0.65 -0.49 0.90 0.00 0.02 0.00 0.00 175.30 176.38 1bwv s ALA 82 N 0.21 3.14 -0.11 2.13 0.00 -1.26 -4.78 121.76 121.09 1bwv s ALA 82 Ca 0.62 0.35 0.02 0.00 0.00 0.00 0.00 51.96 52.96 1bwv s ALA 82 Cb -0.43 -3.08 0.01 0.00 0.00 0.00 0.00 23.12 19.63 1bwv s ALA 82 CO 0.42 0.18 -0.17 0.15 0.00 0.00 0.00 175.76 176.34 1bwv s LYS 83 N -2.84 2.39 -0.09 0.00 -0.14 -0.70 -4.49 119.74 113.87 1bwv s LYS 83 Ca 0.57 -0.63 -0.30 0.00 -1.36 0.00 0.00 55.97 54.25 1bwv s LYS 83 Cb -0.12 -1.96 -0.02 0.00 -1.68 0.00 0.00 37.83 34.06 1bwv s LYS 83 CO 0.16 -0.00 1.08 0.00 -0.76 0.00 0.00 175.35 175.83 1bwv s ALA 84 N 0.81 3.44 -0.24 5.17 0.00 0.26 -0.95 121.76 130.26 1bwv s ALA 84 Ca -0.10 0.47 0.04 0.00 0.00 0.00 0.00 51.96 52.37 1bwv s ALA 84 Cb -0.16 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1bwv s ALA 84 CO 0.01 -0.67 0.23 2.48 0.00 0.00 0.00 175.76 177.81 1bwv n TYR 85 N 5.10 0.00 -3.67 0.00 4.11 -0.36 -1.34 117.16 121.00 1bwv n TYR 85 Ca 0.10 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.89 1bwv n TYR 85 Cb 0.48 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.73 1bwv n TYR 85 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1bwv s LYS 86 N -1.29 0.62 -0.09 -3.48 2.20 -1.24 -4.29 119.74 112.16 1bwv s LYS 86 Ca 0.02 0.93 -0.00 0.00 -0.36 0.00 0.00 55.97 56.56 1bwv s LYS 86 Cb 0.03 0.18 0.02 0.00 -1.51 0.00 0.00 37.83 36.56 1bwv s LYS 86 CO 0.16 -0.12 -0.07 0.08 -0.36 0.00 0.00 175.35 175.04 1bwv s VAL 87 N 0.99 0.92 0.21 4.02 1.01 -1.26 -1.38 120.40 124.91 1bwv s VAL 87 Ca -0.05 -0.25 0.10 0.00 0.00 0.00 0.00 61.98 61.78 1bwv s VAL 87 Cb -0.05 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1bwv s VAL 87 CO -0.09 0.34 -0.19 -1.81 0.00 0.00 0.00 175.10 173.35 1bwv s ASP 88 N 1.52 3.06 0.16 3.32 1.01 -0.51 -4.97 116.67 120.26 1bwv s ASP 88 Ca 0.01 -0.93 -0.12 0.00 0.71 0.00 0.00 52.55 52.22 1bwv s ASP 88 Cb -0.13 -0.21 -0.07 0.00 1.01 0.00 0.00 42.92 43.52 1bwv s ASP 88 CO -0.05 -0.00 0.52 -1.58 0.21 0.00 0.00 175.17 174.27 1bwv s GLN 89 N -3.07 3.88 0.02 8.23 0.74 -1.26 -0.35 119.66 127.85 1bwv s GLN 89 Ca 0.21 0.36 -0.30 0.00 0.05 0.00 0.00 55.36 55.68 1bwv s GLN 89 Cb -0.05 -2.85 -0.05 0.00 1.10 0.00 0.00 33.01 31.16 1bwv s GLN 89 CO 0.09 0.44 1.31 0.08 -0.55 0.00 0.00 175.29 176.66 1bwv s VAL 90 N -1.58 3.84 0.15 1.34 1.01 -0.57 -4.78 120.40 119.81 1bwv s VAL 90 Ca 0.40 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 63.54 1bwv s VAL 90 Cb -0.14 -3.81 0.17 0.00 0.00 0.00 0.00 36.38 32.60 1bwv s VAL 90 CO 0.20 0.04 0.98 -2.65 0.00 0.00 0.00 175.10 173.66 1bwv n PRO 91 N 4.77 -0.14 -1.30 2.72 -0.02 -1.26 -1.43 135.00 138.34 1bwv n PRO 91 Ca 0.11 0.97 -0.07 0.00 -2.02 0.00 0.00 63.50 62.50 1bwv n PRO 91 Cb 0.45 -1.44 0.12 0.00 -0.02 0.00 0.00 33.50 32.60 1bwv n PRO 91 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1bwv n ASN 92 N -4.94 3.01 -3.49 2.55 5.03 -1.26 -4.93 115.26 111.24 1bwv n ASN 92 Ca 0.07 -3.71 -0.20 0.00 0.87 0.00 0.00 54.58 51.61 1bwv n ASN 92 Cb 0.26 -0.44 -0.13 0.00 -1.02 0.00 0.00 39.78 38.45 1bwv n ASN 92 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1bwv s ASN 93 N -3.36 1.78 0.59 6.41 3.84 -0.52 -5.02 114.94 118.66 1bwv s ASN 93 Ca 0.43 -0.49 0.35 0.00 0.21 0.00 0.00 52.86 53.35 1bwv s ASN 93 Cb 0.39 0.27 1.86 0.00 -0.55 0.00 0.00 41.25 43.21 1bwv s ASN 93 CO -0.03 -0.35 2.21 1.55 -2.79 0.00 0.00 177.10 177.68 1bwv h PRO 94 N 8.32 0.00 0.00 0.43 0.13 -1.92 -3.07 132.00 135.89 1bwv h PRO 94 Ca -0.16 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.88 1bwv h PRO 94 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1bwv h PRO 94 CO 0.31 0.04 -0.65 0.93 -0.23 0.00 0.00 178.00 178.40 1bwv h GLU 95 N 0.00 0.00 -5.87 0.86 5.08 -1.95 -3.47 114.58 109.23 1bwv h GLU 95 Ca -0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1bwv h GLU 95 Cb 0.17 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.36 1bwv h GLU 95 CO 0.00 0.32 -0.52 -0.65 -1.00 0.00 0.00 179.01 177.17 1bwv s GLN 96 N -3.03 3.32 0.04 2.33 -0.21 -1.16 -4.22 119.66 116.73 1bwv s GLN 96 Ca 0.03 -0.38 0.04 0.00 0.02 0.00 0.00 55.36 55.07 1bwv s GLN 96 Cb 0.08 -3.02 -0.02 0.00 1.00 0.00 0.00 33.01 31.04 1bwv s GLN 96 CO 0.75 0.66 -0.11 0.71 -2.12 0.00 0.00 175.29 175.18 1bwv s TYR 97 N -1.29 0.99 -0.29 0.91 1.51 -0.09 -1.52 117.35 117.57 1bwv s TYR 97 Ca 0.26 -0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 55.82 1bwv s TYR 97 Cb -0.12 -0.58 -0.05 0.00 -0.11 0.00 0.00 41.96 41.10 1bwv s TYR 97 CO 0.18 0.00 0.19 -0.06 -1.11 0.00 0.00 175.55 174.75 1bwv s PHE 98 N -1.03 3.22 -0.15 2.71 0.08 0.53 -0.45 117.98 122.88 1bwv s PHE 98 Ca -0.03 0.07 0.00 0.00 0.12 0.00 0.00 56.93 57.09 1bwv s PHE 98 Cb -0.08 -2.39 -0.00 0.00 -0.57 0.00 0.00 43.02 39.97 1bwv s PHE 98 CO 0.01 -0.19 -0.14 0.00 -0.10 0.00 0.00 175.22 174.80 1bwv s ALA 99 N 1.75 2.53 -0.26 5.36 0.00 0.18 -1.43 121.76 129.88 1bwv s ALA 99 Ca 0.07 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 1bwv s ALA 99 Cb -0.16 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.68 1bwv s ALA 99 CO 0.11 0.01 0.26 0.71 0.00 0.00 0.00 175.76 176.84 1bwv s TYR 100 N 0.75 3.26 -0.02 0.00 1.51 -0.48 -1.29 117.35 121.09 1bwv s TYR 100 Ca -0.06 0.27 0.07 0.00 -1.01 0.00 0.00 57.07 56.33 1bwv s TYR 100 Cb -0.15 -2.43 -0.02 0.00 -0.11 0.00 0.00 41.96 39.25 1bwv s TYR 100 CO 0.01 -0.13 -0.21 0.42 -1.11 0.00 0.00 175.55 174.53 1bwv s ILE 101 N 1.69 1.67 -0.10 2.71 1.01 -0.38 -1.22 121.20 126.58 1bwv s ILE 101 Ca 0.10 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1bwv s ILE 101 Cb -0.15 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 1bwv s ILE 101 CO 0.09 0.47 -0.13 0.00 0.00 0.00 0.00 174.94 175.37 1bwv s ALA 102 N -0.50 2.66 -0.05 9.38 0.00 -0.12 -1.04 121.76 132.08 1bwv s ALA 102 Ca 0.08 -0.92 0.05 0.00 0.00 0.00 0.00 51.96 51.17 1bwv s ALA 102 Cb -0.08 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 1bwv s ALA 102 CO -0.01 0.37 -0.21 0.71 0.00 0.00 0.00 175.76 176.63 1bwv s TYR 103 N -0.09 2.08 0.25 0.00 1.51 0.64 -1.71 117.35 120.02 1bwv s TYR 103 Ca -0.02 -0.64 -0.30 0.00 -1.01 0.00 0.00 57.07 55.11 1bwv s TYR 103 Cb -0.14 -1.38 -0.09 0.00 -0.11 0.00 0.00 41.96 40.24 1bwv s TYR 103 CO 0.04 -0.21 1.28 -2.00 -1.11 0.00 0.00 175.55 173.54 1bwv s GLU 104 N -0.00 4.41 0.31 -0.62 2.56 -1.26 -0.77 118.70 123.33 1bwv s GLU 104 Ca -0.05 2.07 0.07 0.00 0.00 0.00 0.00 54.97 57.06 1bwv s GLU 104 Cb -0.13 -3.16 0.84 0.00 2.00 0.00 0.00 34.13 33.69 1bwv s GLU 104 CO 0.03 -0.17 1.68 1.25 -0.56 0.00 0.00 175.26 177.50 1bwv h LEU 105 N 4.56 0.35 -0.56 2.70 6.46 -1.94 -1.26 115.31 125.62 1bwv h LEU 105 Ca -0.46 0.17 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1bwv h LEU 105 Cb 1.22 0.15 0.00 0.00 -0.73 0.00 0.00 40.66 41.30 1bwv h LEU 105 CO 0.72 -0.06 0.00 0.47 -0.62 0.00 0.00 178.44 178.95 1bwv n ASP 106 N -5.07 0.24 0.11 1.25 9.92 -1.26 -1.99 116.55 119.74 1bwv n ASP 106 Ca 0.25 0.61 0.13 0.00 -0.53 0.00 0.00 54.79 55.25 1bwv n ASP 106 Cb 0.76 -0.64 0.42 0.00 -0.64 0.00 0.00 41.12 41.02 1bwv n ASP 106 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1bwv n LEU 107 N -1.81 0.79 -4.61 0.64 4.77 -0.47 -4.88 117.00 111.43 1bwv n LEU 107 Ca -0.00 0.58 -0.31 0.00 -0.03 0.00 0.00 56.01 56.25 1bwv n LEU 107 Cb 0.03 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 40.68 1bwv n LEU 107 CO 0.05 -0.21 -0.39 -0.36 -1.33 0.00 0.00 177.39 175.15 1bwv s PHE 108 N -3.12 2.86 0.07 -1.77 0.08 -0.84 -5.04 117.98 110.21 1bwv s PHE 108 Ca 0.10 -0.08 -0.27 0.00 0.12 0.00 0.00 56.93 56.80 1bwv s PHE 108 Cb 0.12 -1.53 -0.06 0.00 -0.57 0.00 0.00 43.02 40.99 1bwv s PHE 108 CO 0.58 0.42 0.84 -2.00 -0.10 0.00 0.00 175.22 174.95 1bwv s GLU 109 N -1.91 4.57 0.30 0.44 2.12 -1.26 -5.01 118.70 117.95 1bwv s GLU 109 Ca 0.21 1.20 -0.29 0.00 0.36 0.00 0.00 54.97 56.45 1bwv s GLU 109 Cb -0.11 -3.37 -0.10 0.00 0.26 0.00 0.00 34.13 30.81 1bwv s GLU 109 CO 0.12 0.26 1.42 -1.21 -0.54 0.00 0.00 175.26 175.31 1bwv s GLU 110 N -0.04 4.25 -0.77 4.30 8.01 -1.26 -3.02 118.70 130.17 1bwv s GLU 110 Ca 0.41 2.36 0.00 0.00 0.01 0.00 0.00 54.97 57.75 1bwv s GLU 110 Cb -0.21 -3.06 0.00 0.00 -4.31 0.00 0.00 34.13 26.55 1bwv s GLU 110 CO 0.25 -0.39 0.00 0.41 0.01 0.00 0.00 175.26 175.54 1bwv n GLY 111 N 1.40 0.80 3.09 -1.39 0.00 -1.23 -4.98 105.19 102.89 1bwv n GLY 111 Ca 0.04 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1bwv n GLY 111 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bwv s SER 112 N -2.38 4.49 0.17 1.61 0.15 -1.17 -4.93 113.70 111.64 1bwv s SER 112 Ca 0.00 -1.35 -0.10 0.00 0.70 0.00 0.00 55.95 55.20 1bwv s SER 112 Cb 0.00 -1.58 0.06 0.00 -1.71 0.00 0.00 66.02 62.79 1bwv s SER 112 CO 0.00 -0.20 1.64 0.40 1.20 0.00 0.00 173.24 176.29 1bwv h ILE 113 N 6.68 1.26 -0.60 6.45 1.08 -1.94 -2.53 117.51 127.93 1bwv h ILE 113 Ca -0.20 -1.09 0.09 0.00 -0.39 0.00 0.00 64.86 63.27 1bwv h ILE 113 Cb 1.05 0.80 -0.07 0.00 -3.07 0.00 0.00 36.82 35.52 1bwv h ILE 113 CO 0.48 0.40 0.21 0.00 -0.69 0.00 0.00 178.15 178.54 1bwv h ALA 114 N 0.99 0.76 -0.41 1.87 0.00 -1.92 -0.52 119.26 120.02 1bwv h ALA 114 Ca 0.17 0.09 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1bwv h ALA 114 Cb 0.51 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1bwv h ALA 114 CO 0.02 -0.21 -0.33 -0.97 0.00 0.00 0.00 179.25 177.77 1bwv h ASN 115 N 0.38 0.98 0.07 0.00 -0.73 -1.88 -1.12 115.58 113.28 1bwv h ASN 115 Ca 0.30 -0.42 0.01 0.00 1.87 0.00 0.00 56.30 58.06 1bwv h ASN 115 Cb 0.38 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.68 1bwv h ASN 115 CO -0.31 1.21 -0.10 0.25 -0.37 0.00 0.00 177.43 178.11 1bwv h LEU 116 N 0.78 -0.27 -1.01 0.34 5.85 -0.99 -2.84 115.31 117.17 1bwv h LEU 116 Ca 0.08 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1bwv h LEU 116 Cb 0.91 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 1bwv h LEU 116 CO 0.08 -0.15 -0.27 0.71 -0.34 0.00 0.00 178.44 178.47 1bwv h THR 117 N -0.21 1.26 -0.40 1.05 1.35 -1.05 -1.70 112.91 113.21 1bwv h THR 117 Ca 0.01 -1.25 0.03 0.00 -0.55 0.00 0.00 66.41 64.65 1bwv h THR 117 Cb 0.21 1.41 -0.02 0.00 -1.73 0.00 0.00 68.15 68.02 1bwv h THR 117 CO -0.05 0.39 0.27 0.00 -0.25 0.00 0.00 175.52 175.88 1bwv h ALA 118 N 1.38 1.86 0.00 6.62 0.00 -0.96 0.99 119.26 129.15 1bwv h ALA 118 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1bwv h ALA 118 Cb 0.66 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1bwv h ALA 118 CO 0.05 0.09 -0.22 0.77 0.00 0.00 0.00 179.25 179.94 1bwv h SER 119 N 0.41 0.00 -0.31 0.00 0.02 -1.33 -3.19 113.55 109.15 1bwv h SER 119 Ca 0.16 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1bwv h SER 119 Cb 0.14 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1bwv h SER 119 CO -0.04 0.70 0.11 0.40 -1.14 0.00 0.00 176.83 176.87 1bwv h ILE 120 N -1.00 1.19 -0.25 3.27 1.08 -1.13 -3.21 117.51 117.46 1bwv h ILE 120 Ca -0.02 -0.60 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1bwv h ILE 120 Cb 0.36 1.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1bwv h ILE 120 CO -0.01 0.20 0.00 2.30 -0.69 0.00 0.00 178.15 179.95 1bwv n ILE 121 N -4.71 1.11 0.14 -0.67 -5.35 0.30 -4.81 119.36 105.37 1bwv n ILE 121 Ca -0.02 -1.09 -0.10 0.00 -0.27 0.00 0.00 62.75 61.27 1bwv n ILE 121 Cb 0.15 0.43 -0.06 0.00 -1.74 0.00 0.00 39.64 38.42 1bwv n ILE 121 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1bwv h GLY 122 N 1.49 -1.06 0.00 3.28 0.00 -1.43 -3.42 103.07 101.93 1bwv h GLY 122 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1bwv h GLY 122 CO 0.02 -0.33 -0.75 0.70 0.00 0.00 0.00 176.54 176.18 1bwv n ASN 123 N -4.12 3.64 0.22 0.19 3.02 -1.26 -4.86 115.26 112.09 1bwv n ASN 123 Ca -0.06 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.66 1bwv n ASN 123 Cb 0.25 0.33 0.77 0.00 -0.61 0.00 0.00 39.78 40.53 1bwv n ASN 123 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1bwv h VAL 124 N 0.00 0.19 0.00 2.41 -1.51 -1.87 -1.96 116.25 113.51 1bwv h VAL 124 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1bwv h VAL 124 Cb 0.75 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.55 1bwv h VAL 124 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.83 1bwv n PHE 125 N -3.29 0.39 -0.70 5.19 3.01 -1.26 -2.74 117.46 118.05 1bwv n PHE 125 Ca 0.03 0.13 0.07 0.00 1.01 0.00 0.00 57.45 58.69 1bwv n PHE 125 Cb 0.51 -0.71 0.21 0.00 -0.01 0.00 0.00 39.48 39.48 1bwv n PHE 125 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bwv n GLY 126 N 0.83 3.64 3.68 1.37 0.00 -0.74 -4.89 105.19 109.08 1bwv n GLY 126 Ca 0.05 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 1bwv n GLY 126 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bwv s PHE 127 N -2.18 2.94 0.34 1.61 5.36 -1.11 -4.92 117.98 120.02 1bwv s PHE 127 Ca 0.34 1.02 0.10 0.00 -0.96 0.00 0.00 56.93 57.43 1bwv s PHE 127 Cb 0.26 -3.51 0.85 0.00 -0.34 0.00 0.00 43.02 40.28 1bwv s PHE 127 CO 0.10 -1.76 1.79 0.87 -1.46 0.00 0.00 175.22 174.77 1bwv h LYS 128 N 7.92 0.63 0.00 10.12 1.57 -1.94 -1.85 116.57 133.01 1bwv h LYS 128 Ca -0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1bwv h LYS 128 Cb 1.14 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1bwv h LYS 128 CO 0.92 0.42 0.00 0.00 -0.57 0.00 0.00 179.45 180.22 1bwv h ALA 129 N 1.64 1.00 -3.13 3.86 0.00 -1.98 -3.40 119.26 117.25 1bwv h ALA 129 Ca 0.56 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.83 1bwv h ALA 129 Cb 1.04 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.60 1bwv h ALA 129 CO -0.34 0.00 -0.65 0.08 0.00 0.00 0.00 179.25 178.34 1bwv s VAL 130 N -3.61 4.06 0.09 0.00 1.01 -0.70 -1.20 120.40 120.05 1bwv s VAL 130 Ca 0.01 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 1bwv s VAL 130 Cb 0.09 -2.84 -0.25 0.00 0.00 0.00 0.00 36.38 33.38 1bwv s VAL 130 CO 0.41 0.43 1.19 0.50 0.00 0.00 0.00 175.10 177.62 1bwv h LYS 131 N 7.45 0.38 -3.48 2.72 3.64 -0.81 -3.44 116.57 123.03 1bwv h LYS 131 Ca -0.36 -0.53 -0.06 0.00 -1.27 0.00 0.00 60.65 58.43 1bwv h LYS 131 Cb 1.18 0.18 -0.13 0.00 -0.41 0.00 0.00 32.23 33.05 1bwv h LYS 131 CO 0.62 1.21 -0.13 0.00 -2.27 0.00 0.00 179.45 178.88 1bwv s ALA 132 N -2.92 -0.77 -0.28 5.00 0.00 -0.92 -5.01 121.76 116.87 1bwv s ALA 132 Ca -0.06 -0.19 -0.19 0.00 0.00 0.00 0.00 51.96 51.53 1bwv s ALA 132 Cb 0.07 0.67 0.11 0.00 0.00 0.00 0.00 23.12 23.96 1bwv s ALA 132 CO 0.89 -0.62 0.84 -1.17 0.00 0.00 0.00 175.76 175.69 1bwv s LEU 133 N -2.82 -0.70 -0.02 0.00 2.96 -1.17 -1.03 118.68 115.89 1bwv s LEU 133 Ca 0.04 1.18 0.01 0.00 -0.22 0.00 0.00 54.13 55.15 1bwv s LEU 133 Cb 0.02 2.12 0.01 0.00 0.50 0.00 0.00 46.19 48.84 1bwv s LEU 133 CO -0.11 -0.19 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.09 1bwv s ARG 134 N 1.13 0.51 -0.29 1.98 3.52 -0.37 -2.09 118.95 123.34 1bwv s ARG 134 Ca -0.06 -0.09 -0.20 0.00 -0.13 0.00 0.00 55.73 55.24 1bwv s ARG 134 Cb -0.05 -0.55 -0.01 0.00 -1.56 0.00 0.00 34.95 32.78 1bwv s ARG 134 CO -0.13 -0.01 0.62 -1.17 -0.81 0.00 0.00 175.30 173.81 1bwv s LEU 135 N 0.47 4.13 -0.21 -0.88 2.96 -0.42 -0.60 118.68 124.13 1bwv s LEU 135 Ca -0.05 0.48 -0.14 0.00 -0.22 0.00 0.00 54.13 54.19 1bwv s LEU 135 Cb -0.09 -2.82 -0.19 0.00 0.50 0.00 0.00 46.19 43.60 1bwv s LEU 135 CO -0.00 -0.45 0.05 -0.62 -1.32 0.00 0.00 176.35 174.01 1bwv n GLU 136 N 5.84 0.62 -3.80 1.98 -0.58 -0.19 -0.89 120.64 123.61 1bwv n GLU 136 Ca -0.01 0.39 -0.09 0.00 -0.42 0.00 0.00 57.16 57.03 1bwv n GLU 136 Cb 0.49 -1.65 -0.03 0.00 -0.57 0.00 0.00 31.44 29.67 1bwv n GLU 136 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1bwv s ASP 137 N -7.03 -0.26 -0.04 1.62 2.15 -1.22 -4.46 116.67 107.44 1bwv s ASP 137 Ca -0.31 -0.57 -0.10 0.00 0.43 0.00 0.00 52.55 52.01 1bwv s ASP 137 Cb 0.09 0.64 0.02 0.00 -0.30 0.00 0.00 42.92 43.36 1bwv s ASP 137 CO 0.60 -1.17 0.22 -0.04 -0.17 0.00 0.00 175.17 174.62 1bwv s MET 138 N -3.91 0.44 -0.28 4.34 -1.94 -1.26 -0.94 119.30 115.75 1bwv s MET 138 Ca 0.11 -0.03 -0.05 0.00 -1.71 0.00 0.00 55.69 54.02 1bwv s MET 138 Cb -0.03 0.19 0.01 0.00 2.01 0.00 0.00 34.83 37.02 1bwv s MET 138 CO 0.02 -0.09 0.04 0.50 -0.01 0.00 0.00 175.02 175.47 1bwv s ARG 139 N -0.70 3.04 -0.24 2.03 3.00 0.39 -4.92 118.95 121.55 1bwv s ARG 139 Ca -0.08 -0.88 -0.09 0.00 -1.00 0.00 0.00 55.73 53.68 1bwv s ARG 139 Cb -0.04 -3.25 -0.04 0.00 0.00 0.00 0.00 34.95 31.61 1bwv s ARG 139 CO 0.02 -0.42 0.12 -0.51 0.00 0.00 0.00 175.30 174.51 1bwv s LEU 140 N 1.45 3.86 0.51 -0.88 1.43 -1.26 -1.43 118.68 122.37 1bwv s LEU 140 Ca 0.02 0.00 -0.19 0.00 -1.03 0.00 0.00 54.13 52.94 1bwv s LEU 140 Cb -0.17 -2.03 -0.07 0.00 0.03 0.00 0.00 46.19 43.95 1bwv s LEU 140 CO 0.00 0.05 1.03 -2.16 0.23 0.00 0.00 176.35 175.50 1bwv s PRO 141 N 1.15 3.71 0.23 1.29 0.04 -1.26 -4.78 135.00 135.38 1bwv s PRO 141 Ca 0.06 1.27 -0.09 0.00 0.04 0.00 0.00 61.00 62.27 1bwv s PRO 141 Cb -0.14 -2.09 0.36 0.00 0.04 0.00 0.00 34.50 32.67 1bwv s PRO 141 CO 0.05 -0.50 1.63 1.25 0.04 0.00 0.00 177.00 179.47 1bwv h LEU 142 N 1.21 -0.45 -1.54 -3.56 5.85 -1.86 0.51 115.31 115.48 1bwv h LEU 142 Ca -0.48 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 1bwv h LEU 142 Cb 1.21 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.60 1bwv h LEU 142 CO 0.59 -0.19 -0.14 0.00 -0.34 0.00 0.00 178.44 178.36 1bwv h ALA 143 N 1.68 1.62 0.18 1.25 0.00 -1.93 -1.87 119.26 120.19 1bwv h ALA 143 Ca 0.37 -0.18 -0.25 0.00 0.00 0.00 0.00 54.91 54.85 1bwv h ALA 143 Cb 0.62 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.38 1bwv h ALA 143 CO -0.66 0.28 -1.10 -0.92 0.00 0.00 0.00 179.25 176.84 1bwv h TYR 144 N 0.12 0.76 -0.87 0.00 3.20 -1.34 -3.33 116.97 115.51 1bwv h TYR 144 Ca 0.02 -0.54 0.06 0.00 3.14 0.00 0.00 58.73 61.41 1bwv h TYR 144 Cb 0.33 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.50 1bwv h TYR 144 CO 0.00 1.42 0.57 -0.07 -1.64 0.00 0.00 178.16 178.44 1bwv h LEU 145 N -0.11 0.86 0.00 2.82 4.07 -0.71 -1.25 115.31 121.00 1bwv h LEU 145 Ca -0.19 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.78 1bwv h LEU 145 Cb 1.86 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.42 1bwv h LEU 145 CO 0.21 0.56 0.00 0.29 -1.08 0.00 0.00 178.44 178.41 1bwv n LYS 146 N -4.48 0.02 -0.08 1.13 4.76 -0.74 -1.64 118.16 117.12 1bwv n LYS 146 Ca 0.13 0.34 0.11 0.00 -2.87 0.00 0.00 58.31 56.02 1bwv n LYS 146 Cb 0.20 -1.50 0.36 0.00 -1.84 0.00 0.00 35.03 32.25 1bwv n LYS 146 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1bwv n THR 147 N -1.46 0.22 -4.14 -0.18 -2.24 -0.47 -4.88 114.28 101.13 1bwv n THR 147 Ca 0.02 -0.39 -0.30 0.00 -2.27 0.00 0.00 64.05 61.12 1bwv n THR 147 Cb 0.09 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 68.73 1bwv n THR 147 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1bwv s PHE 148 N -1.78 2.97 0.10 4.78 0.40 -0.65 -3.49 117.98 120.30 1bwv s PHE 148 Ca 0.33 -0.04 -0.14 0.00 -0.60 0.00 0.00 56.93 56.48 1bwv s PHE 148 Cb 0.18 -1.52 -0.10 0.00 0.51 0.00 0.00 43.02 42.09 1bwv s PHE 148 CO 0.28 0.48 1.38 0.37 0.70 0.00 0.00 175.22 178.43 1bwv h GLN 149 N 3.40 0.74 -0.35 0.44 4.15 -1.85 -3.50 115.11 118.13 1bwv h GLN 149 Ca -0.48 -0.45 0.04 0.00 0.77 0.00 0.00 58.65 58.53 1bwv h GLN 149 Cb 1.17 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 1bwv h GLN 149 CO 0.59 1.08 -0.07 0.41 -1.93 0.00 0.00 178.83 178.91 1bwv n GLY 150 N 0.34 -1.53 3.57 2.39 0.00 -0.98 -4.82 105.19 104.16 1bwv n GLY 150 Ca -0.05 -1.49 -0.54 0.00 0.00 0.00 0.00 46.02 43.95 1bwv n GLY 150 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bwv n PRO 151 N -1.74 0.83 -0.16 1.61 -0.02 -1.23 -4.02 135.00 130.28 1bwv n PRO 151 Ca -0.00 0.30 -0.03 0.00 -2.02 0.00 0.00 63.50 61.75 1bwv n PRO 151 Cb 0.07 -1.90 0.06 0.00 -0.02 0.00 0.00 33.50 31.71 1bwv n PRO 151 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bwv h ALA 152 N 4.18 0.57 0.00 3.55 0.00 -1.44 -3.38 119.26 122.75 1bwv h ALA 152 Ca -0.49 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1bwv h ALA 152 Cb 1.36 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1bwv h ALA 152 CO 0.75 -0.26 -0.80 2.41 0.00 0.00 0.00 179.25 181.34 1bwv n THR 153 N -5.05 1.40 0.00 0.00 -1.04 -1.26 -4.64 114.28 103.68 1bwv n THR 153 Ca 0.05 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 1bwv n THR 153 Cb 0.22 -2.10 0.00 0.00 -1.82 0.00 0.00 70.33 66.63 1bwv n THR 153 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bwv n GLY 154 N 2.05 -1.38 0.34 3.41 0.00 -1.26 -4.26 105.19 104.10 1bwv n GLY 154 Ca -0.12 -1.42 -0.02 0.00 0.00 0.00 0.00 46.02 44.47 1bwv n GLY 154 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bwv h VAL 155 N 0.00 0.13 0.24 1.61 2.07 -1.58 -0.65 116.25 118.08 1bwv h VAL 155 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1bwv h VAL 155 Cb 0.00 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.90 1bwv h VAL 155 CO 0.00 0.00 -0.12 0.40 0.02 0.00 0.00 177.57 177.87 1bwv h ILE 156 N -0.07 0.78 -0.47 4.57 1.08 -1.87 -1.54 117.51 120.00 1bwv h ILE 156 Ca 0.31 -0.11 -0.08 0.00 -0.39 0.00 0.00 64.86 64.59 1bwv h ILE 156 Cb 0.58 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 1bwv h ILE 156 CO -0.81 0.03 -0.04 0.25 -0.69 0.00 0.00 178.15 176.89 1bwv h LEU 157 N -0.38 0.78 -0.09 1.44 5.85 -1.69 -2.52 115.31 118.70 1bwv h LEU 157 Ca -0.03 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.51 1bwv h LEU 157 Cb 0.29 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1bwv h LEU 157 CO 0.05 0.87 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.81 1bwv h GLU 158 N 0.74 -0.17 -0.46 1.25 4.81 -0.81 -0.14 114.58 119.81 1bwv h GLU 158 Ca 0.14 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1bwv h GLU 158 Cb 0.51 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 1bwv h GLU 158 CO 0.03 -0.11 0.18 0.00 -0.73 0.00 0.00 179.01 178.37 1bwv h ARG 159 N -0.17 0.65 -0.56 1.92 3.08 -1.14 -0.87 114.38 117.28 1bwv h ARG 159 Ca 0.07 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1bwv h ARG 159 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1bwv h ARG 159 CO -0.19 0.54 -0.03 0.93 -1.07 0.00 0.00 179.97 180.15 1bwv h GLU 160 N 0.65 1.00 0.00 0.04 5.08 -0.92 0.27 114.58 120.70 1bwv h GLU 160 Ca 0.16 -0.32 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1bwv h GLU 160 Cb 0.14 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1bwv h GLU 160 CO -0.01 1.00 -0.50 0.00 -1.00 0.00 0.00 179.01 178.50 1bwv h ARG 161 N 0.91 0.00 0.00 2.33 3.08 -0.23 -3.12 114.38 117.36 1bwv h ARG 161 Ca 0.16 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1bwv h ARG 161 Cb 0.58 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.62 1bwv h ARG 161 CO 0.03 0.50 -1.06 1.28 -1.07 0.00 0.00 179.97 179.65 1bwv n LEU 162 N -3.74 0.81 -3.41 3.04 4.77 -0.41 -4.98 117.00 113.09 1bwv n LEU 162 Ca -0.01 0.31 -0.20 0.00 -0.03 0.00 0.00 56.01 56.08 1bwv n LEU 162 Cb 0.55 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.67 1bwv n LEU 162 CO 0.40 -0.17 0.18 -0.67 -1.33 0.00 0.00 177.39 175.80 1bwv n ASP 163 N -2.66 -4.48 -3.83 -1.43 2.03 0.92 -4.39 116.55 102.72 1bwv n ASP 163 Ca -0.00 -0.55 -0.27 0.00 0.52 0.00 0.00 54.79 54.48 1bwv n ASP 163 Cb 0.56 -4.89 -0.17 0.00 -0.72 0.00 0.00 41.12 35.91 1bwv n ASP 163 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1bwv s LYS 164 N -5.86 1.07 0.07 -0.67 1.02 -1.04 -5.04 119.74 109.28 1bwv s LYS 164 Ca 0.33 -0.44 0.00 0.00 0.02 0.00 0.00 55.97 55.89 1bwv s LYS 164 Cb -0.15 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 1bwv s LYS 164 CO 0.70 -0.50 -0.05 -0.06 -0.92 0.00 0.00 175.35 174.52 1bwv s PHE 165 N 1.74 0.67 0.00 3.18 0.08 -1.26 -4.69 117.98 117.69 1bwv s PHE 165 Ca 0.00 -0.94 0.00 0.00 0.12 0.00 0.00 56.93 56.11 1bwv s PHE 165 Cb -0.16 -0.43 0.00 0.00 -0.57 0.00 0.00 43.02 41.86 1bwv s PHE 165 CO -0.07 -0.25 0.00 0.41 -0.10 0.00 0.00 175.22 175.21 1bwv n GLY 166 N 0.21 2.61 3.05 4.36 0.00 -1.26 -4.99 105.19 109.18 1bwv n GLY 166 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1bwv n GLY 166 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bwv s ARG 167 N -0.15 0.51 0.79 1.61 1.70 -1.26 -5.05 118.95 117.10 1bwv s ARG 167 Ca 0.00 -0.94 -0.15 0.00 -0.47 0.00 0.00 55.73 54.17 1bwv s ARG 167 Cb 0.00 0.06 0.01 0.00 -0.57 0.00 0.00 34.95 34.45 1bwv s ARG 167 CO 0.00 -0.06 0.69 -2.30 -1.08 0.00 0.00 175.30 172.55 1bwv n PRO 168 N 0.83 0.18 -3.46 3.89 -0.02 -1.13 -4.88 135.00 130.40 1bwv n PRO 168 Ca -0.19 0.11 -0.29 0.00 -2.02 0.00 0.00 63.50 61.12 1bwv n PRO 168 Cb 0.58 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 1bwv n PRO 168 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bwv s LEU 169 N -1.83 4.12 -0.07 2.45 1.43 -0.69 -4.94 118.68 119.15 1bwv s LEU 169 Ca 0.66 0.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.44 1bwv s LEU 169 Cb -0.31 -3.43 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 1bwv s LEU 169 CO 0.58 -0.13 -0.21 -0.76 0.23 0.00 0.00 176.35 176.06 1bwv s LEU 170 N -3.38 2.30 0.00 1.79 1.43 -1.26 -0.39 118.68 119.17 1bwv s LEU 170 Ca 0.42 -0.43 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1bwv s LEU 170 Cb -0.11 -1.45 -0.01 0.00 0.03 0.00 0.00 46.19 44.65 1bwv s LEU 170 CO 0.29 0.24 0.12 0.61 0.23 0.00 0.00 176.35 177.84 1bwv n GLY 171 N 2.97 3.46 3.62 -3.19 0.00 0.22 -1.01 105.19 111.26 1bwv n GLY 171 Ca -0.18 -2.01 -0.03 0.00 0.00 0.00 0.00 46.02 43.80 1bwv n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwv s THR 173 N 1.63 4.89 0.28 0.00 2.01 -1.26 -4.38 115.64 118.81 1bwv s THR 173 Ca -0.08 1.49 -0.29 0.00 0.31 0.00 0.00 61.69 63.11 1bwv s THR 173 Cb -0.05 -4.05 -0.10 0.00 0.01 0.00 0.00 72.50 68.31 1bwv s THR 173 CO -0.17 0.33 1.36 -0.89 -0.69 0.00 0.00 174.62 174.56 1bwv s THR 174 N 0.28 2.76 0.05 -0.82 2.01 -1.26 -4.44 115.64 114.23 1bwv s THR 174 Ca 0.37 0.69 0.06 0.00 0.31 0.00 0.00 61.69 63.12 1bwv s THR 174 Cb -0.19 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1bwv s THR 174 CO 0.20 0.14 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.57 1bwv s LYS 175 N -1.00 1.00 0.73 4.92 -0.14 -1.26 -4.33 119.74 119.65 1bwv s LYS 175 Ca 0.54 -0.87 -0.15 0.00 -1.36 0.00 0.00 55.97 54.13 1bwv s LYS 175 Cb -0.40 -1.06 0.04 0.00 -1.68 0.00 0.00 37.83 34.73 1bwv s LYS 175 CO 0.47 0.26 1.22 -1.25 -0.76 0.00 0.00 175.35 175.29 1bwv s PRO 176 N -1.34 2.13 0.17 -1.68 0.04 -1.26 -5.07 135.00 127.99 1bwv s PRO 176 Ca 0.02 1.81 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 1bwv s PRO 176 Cb -0.09 -1.83 0.13 0.00 0.04 0.00 0.00 34.50 32.76 1bwv s PRO 176 CO 0.02 -1.85 1.72 0.87 0.04 0.00 0.00 177.00 177.79 1bwv h LYS 177 N -0.24 0.19 -6.09 4.56 1.57 -1.99 -3.43 116.57 111.14 1bwv h LYS 177 Ca -0.48 -0.01 -0.54 0.00 -1.87 0.00 0.00 60.65 57.74 1bwv h LYS 177 Cb 1.30 -0.04 -0.22 0.00 0.08 0.00 0.00 32.23 33.35 1bwv h LYS 177 CO 0.50 0.13 -0.82 -0.51 -0.57 0.00 0.00 179.45 178.17 1bwv s LEU 178 N -10.44 2.30 0.00 2.94 1.43 -1.26 -4.70 118.68 108.94 1bwv s LEU 178 Ca -0.13 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1bwv s LEU 178 Cb 0.14 -0.85 0.00 0.00 0.03 0.00 0.00 46.19 45.51 1bwv s LEU 178 CO 0.72 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.95 1bwv n GLY 179 N 1.11 1.43 3.79 -3.19 0.00 -1.26 -5.10 105.19 101.97 1bwv n GLY 179 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1bwv n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwv s LEU 180 N 0.00 3.54 0.74 0.99 1.43 -1.26 -4.93 118.68 119.19 1bwv s LEU 180 Ca 0.00 1.92 -0.08 0.00 -1.03 0.00 0.00 54.13 54.94 1bwv s LEU 180 Cb 0.00 -4.55 0.08 0.00 0.03 0.00 0.00 46.19 41.75 1bwv s LEU 180 CO 0.00 -1.25 1.07 -0.94 0.23 0.00 0.00 176.35 175.46 1bwv s SER 181 N -2.50 4.61 0.12 2.29 1.04 -1.26 -4.44 113.70 113.56 1bwv s SER 181 Ca 0.66 0.47 -0.19 0.00 0.48 0.00 0.00 55.95 57.37 1bwv s SER 181 Cb -0.18 -1.03 -0.06 0.00 0.10 0.00 0.00 66.02 64.84 1bwv s SER 181 CO 0.35 -1.75 1.75 1.23 0.98 0.00 0.00 173.24 175.79 1bwv h GLY 182 N -0.76 0.33 0.56 7.32 0.00 -1.90 -0.37 103.07 108.25 1bwv h GLY 182 Ca -0.44 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 46.80 1bwv h GLY 182 CO 0.59 0.13 0.05 1.70 0.00 0.00 0.00 176.54 179.01 1bwv h LYS 183 N 0.28 0.15 -0.02 4.80 1.63 -1.95 -1.64 116.57 119.83 1bwv h LYS 183 Ca 0.08 -0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 59.75 1bwv h LYS 183 Cb 0.02 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1bwv h LYS 183 CO -0.02 0.10 -0.56 -0.91 -3.45 0.00 0.00 179.45 174.62 1bwv h ASN 184 N 0.16 0.07 -0.46 4.20 2.35 -1.89 -2.47 115.58 117.53 1bwv h ASN 184 Ca 0.16 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1bwv h ASN 184 Cb 0.19 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 1bwv h ASN 184 CO -0.23 0.62 0.24 0.22 -1.65 0.00 0.00 177.43 176.62 1bwv h TYR 185 N 0.05 0.64 -0.50 1.19 3.20 -0.53 -2.37 116.97 118.65 1bwv h TYR 185 Ca -0.00 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1bwv h TYR 185 Cb 1.00 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 1bwv h TYR 185 CO 0.01 0.50 0.24 0.78 -1.64 0.00 0.00 178.16 178.04 1bwv h GLY 186 N 0.60 0.75 0.74 1.82 0.00 -1.08 -1.58 103.07 104.33 1bwv h GLY 186 Ca 0.16 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.15 1bwv h GLY 186 CO -0.02 0.33 -0.19 -0.09 0.00 0.00 0.00 176.54 176.57 1bwv h ARG 187 N 0.71 -0.38 -0.54 4.80 1.12 -0.98 -0.94 114.38 118.17 1bwv h ARG 187 Ca 0.18 0.03 0.01 0.00 -1.11 0.00 0.00 59.98 59.08 1bwv h ARG 187 Cb 0.08 0.09 -0.03 0.00 -0.01 0.00 0.00 29.97 30.10 1bwv h ARG 187 CO -0.02 -0.25 0.35 0.28 -3.11 0.00 0.00 179.97 177.21 1bwv h VAL 188 N -0.39 1.12 -0.08 0.20 2.07 -1.06 -1.58 116.25 116.52 1bwv h VAL 188 Ca 0.01 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1bwv h VAL 188 Cb 0.38 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1bwv h VAL 188 CO -0.06 0.13 -0.03 0.58 0.02 0.00 0.00 177.57 178.21 1bwv h VAL 189 N 0.71 0.90 -0.06 2.57 2.07 -1.13 -1.24 116.25 120.07 1bwv h VAL 189 Ca 0.20 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.74 1bwv h VAL 189 Cb -0.06 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1bwv h VAL 189 CO -0.05 0.00 -0.07 0.22 0.02 0.00 0.00 177.57 177.69 1bwv h TYR 190 N -0.01 -0.16 -0.26 1.57 3.20 -0.83 -1.33 116.97 119.15 1bwv h TYR 190 Ca 0.04 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1bwv h TYR 190 Cb 0.07 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1bwv h TYR 190 CO -0.14 -0.11 0.17 0.93 -1.64 0.00 0.00 178.16 177.38 1bwv h GLU 191 N -0.09 0.34 -0.42 1.82 4.39 -1.09 -0.74 114.58 118.78 1bwv h GLU 191 Ca 0.05 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 1bwv h GLU 191 Cb 0.16 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1bwv h GLU 191 CO -0.11 0.23 -0.02 0.00 -1.16 0.00 0.00 179.01 177.95 1bwv h ALA 192 N 1.09 0.57 -0.18 3.43 0.00 -1.08 -0.82 119.26 122.27 1bwv h ALA 192 Ca 0.10 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1bwv h ALA 192 Cb -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1bwv h ALA 192 CO -0.02 0.38 -0.07 -0.07 0.00 0.00 0.00 179.25 179.46 1bwv h LEU 193 N 0.59 0.38 -0.98 0.00 3.38 -1.15 -2.05 115.31 115.49 1bwv h LEU 193 Ca 0.12 -0.40 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1bwv h LEU 193 Cb 0.51 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1bwv h LEU 193 CO 0.02 0.69 0.65 0.50 0.09 0.00 0.00 178.44 180.40 1bwv h LYS 194 N 0.07 1.27 0.00 1.13 3.64 -1.10 -1.61 116.57 119.96 1bwv h LYS 194 Ca 0.04 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1bwv h LYS 194 Cb 0.54 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1bwv h LYS 194 CO 0.02 0.84 0.00 0.78 -2.27 0.00 0.00 179.45 178.82 1bwv h GLY 195 N 1.30 0.00 0.00 5.01 0.00 -1.01 -3.46 103.07 104.92 1bwv h GLY 195 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1bwv h GLY 195 CO -0.09 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.06 1bwv n GLY 196 N -0.57 -0.43 3.85 4.60 0.00 -0.61 -2.14 105.19 109.89 1bwv n GLY 196 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1bwv n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwv s LEU 197 N 0.00 3.93 0.03 0.99 1.43 -0.79 -4.78 118.68 119.49 1bwv s LEU 197 Ca 0.00 1.38 -0.01 0.00 -1.03 0.00 0.00 54.13 54.47 1bwv s LEU 197 Cb 0.00 -4.23 -0.27 0.00 0.03 0.00 0.00 46.19 41.72 1bwv s LEU 197 CO 0.00 -0.33 0.97 0.44 0.23 0.00 0.00 176.35 177.66 1bwv h ASP 198 N 1.79 0.33 -4.96 2.29 3.32 -1.40 -3.41 116.42 114.39 1bwv h ASP 198 Ca -0.48 -0.42 -0.18 0.00 0.02 0.00 0.00 57.03 55.98 1bwv h ASP 198 Cb 1.18 -0.11 -0.17 0.00 0.22 0.00 0.00 39.33 40.45 1bwv h ASP 198 CO 0.64 1.34 -0.70 -0.36 -1.72 0.00 0.00 179.24 178.44 1bwv s PHE 199 N -2.64 0.58 0.01 4.55 0.08 -0.40 -2.75 117.98 117.41 1bwv s PHE 199 Ca -0.06 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 56.16 1bwv s PHE 199 Cb 0.07 -0.38 -0.00 0.00 -0.57 0.00 0.00 43.02 42.14 1bwv s PHE 199 CO 0.86 -0.24 0.00 0.28 -0.10 0.00 0.00 175.22 176.02 1bwv n VAL 200 N 0.58 0.00 -3.78 -0.44 0.31 -1.05 -3.00 118.33 110.96 1bwv n VAL 200 Ca -0.17 -0.04 -0.31 0.00 -0.01 0.00 0.00 64.34 63.80 1bwv n VAL 200 Cb 0.59 0.02 -0.04 0.00 -0.91 0.00 0.00 33.84 33.49 1bwv n VAL 200 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1bwv s ASP 202 N -1.04 6.44 0.44 4.52 1.01 -0.93 -1.14 116.67 125.97 1bwv s ASP 202 Ca 0.00 0.46 -0.21 0.00 0.71 0.00 0.00 52.55 53.52 1bwv s ASP 202 Cb 0.00 -2.04 -0.11 0.00 1.01 0.00 0.00 42.92 41.79 1bwv s ASP 202 CO 0.00 0.10 0.96 -0.62 0.21 0.00 0.00 175.17 175.83 1bwv s ASP 203 N -2.45 6.88 0.57 0.27 -1.08 -1.26 -4.81 116.67 114.79 1bwv s ASP 203 Ca 0.38 1.70 0.34 0.00 -0.52 0.00 0.00 52.55 54.45 1bwv s ASP 203 Cb -0.12 -2.54 1.41 0.00 -1.46 0.00 0.00 42.92 40.21 1bwv s ASP 203 CO 0.26 -0.41 1.70 1.05 0.52 0.00 0.00 175.17 178.29 1bwv h GLU 204 N 1.83 0.00 -0.33 4.34 9.09 -1.98 0.14 114.58 127.68 1bwv h GLU 204 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 1bwv h GLU 204 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.28 1bwv h GLU 204 CO 0.61 0.00 0.00 0.27 0.05 0.00 0.00 179.01 179.94 1bwv n ASN 205 N -3.81 3.13 -4.58 3.06 6.94 -1.26 -4.81 115.26 113.94 1bwv n ASN 205 Ca 0.22 -1.95 -0.42 0.00 -0.02 0.00 0.00 54.58 52.40 1bwv n ASN 205 Cb 1.21 -0.21 -0.05 0.00 -2.36 0.00 0.00 39.78 38.38 1bwv n ASN 205 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1bwv s ILE 206 N -1.59 4.68 0.00 1.53 -1.09 0.48 -4.83 121.20 120.38 1bwv s ILE 206 Ca 0.37 0.82 0.00 0.00 -2.23 0.00 0.00 60.65 59.61 1bwv s ILE 206 Cb 0.22 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.83 1bwv s ILE 206 CO 0.31 -0.54 0.00 0.59 -1.23 0.00 0.00 174.94 174.07 1bwv n ASN 207 N 6.59 0.00 -3.34 3.58 5.03 -1.26 -4.76 115.26 121.10 1bwv n ASN 207 Ca 0.04 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.47 1bwv n ASN 207 Cb 0.48 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 39.20 1bwv n ASN 207 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1bwv s SER 208 N 1.00 -0.81 0.16 6.41 0.15 -1.26 -4.06 113.70 115.29 1bwv s SER 208 Ca 0.00 0.85 -0.01 0.00 0.70 0.00 0.00 55.95 57.49 1bwv s SER 208 Cb 0.00 1.84 -0.04 0.00 -1.71 0.00 0.00 66.02 66.11 1bwv s SER 208 CO 0.00 -0.26 0.07 -1.10 1.20 0.00 0.00 173.24 173.15 1bwv s GLN 209 N 2.76 1.03 0.33 5.44 1.11 0.03 -4.94 119.66 125.42 1bwv s GLN 209 Ca 0.12 -1.51 0.12 0.00 0.01 0.00 0.00 55.36 54.10 1bwv s GLN 209 Cb -0.14 0.20 1.02 0.00 -1.01 0.00 0.00 33.01 33.08 1bwv s GLN 209 CO -0.18 -0.29 1.64 -1.35 0.01 0.00 0.00 175.29 175.12 1bwv h PRO 210 N 2.77 0.23 0.00 2.91 0.11 -2.02 -1.06 132.00 134.95 1bwv h PRO 210 Ca -0.36 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.73 1bwv h PRO 210 Cb 1.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1bwv h PRO 210 CO 0.58 0.15 -0.07 0.27 -0.21 0.00 0.00 178.00 178.72 1bwv h PHE 211 N 0.24 0.00 -1.17 0.65 -5.15 -1.93 -3.44 116.94 106.14 1bwv h PHE 211 Ca 0.70 0.00 0.14 0.00 -0.20 0.00 0.00 57.97 58.61 1bwv h PHE 211 Cb 1.59 0.00 -0.22 0.00 0.22 0.00 0.00 35.95 37.54 1bwv h PHE 211 CO -0.10 0.07 0.03 1.41 -2.00 0.00 0.00 178.31 177.73 1bwv s MET 212 N -3.46 0.40 0.57 6.09 0.00 -0.40 -4.38 119.30 118.12 1bwv s MET 212 Ca 0.03 0.91 -0.03 0.00 0.00 0.00 0.00 55.69 56.61 1bwv s MET 212 Cb 0.08 0.54 0.02 0.00 0.00 0.00 0.00 34.83 35.47 1bwv s MET 212 CO 0.62 -0.23 0.84 1.03 0.00 0.00 0.00 175.02 177.28 1bwv s ARG 213 N 2.71 2.76 0.13 4.11 1.81 -1.21 -0.79 118.95 128.47 1bwv s ARG 213 Ca 0.01 -0.31 -0.08 0.00 -1.72 0.00 0.00 55.73 53.63 1bwv s ARG 213 Cb -0.10 -2.36 -0.08 0.00 -0.45 0.00 0.00 34.95 31.96 1bwv s ARG 213 CO -0.18 -0.69 1.34 0.11 -0.68 0.00 0.00 175.30 175.21 1bwv h TRP 214 N -0.06 0.85 -0.63 -0.53 5.08 -1.92 -3.25 115.95 115.49 1bwv h TRP 214 Ca -0.45 -0.39 -0.01 0.00 1.08 0.00 0.00 58.89 59.13 1bwv h TRP 214 Cb 1.27 -0.13 -0.03 0.00 -3.00 0.00 0.00 29.16 27.28 1bwv h TRP 214 CO 0.43 1.19 0.36 0.00 -1.28 0.00 0.00 178.44 179.14 1bwv h ARG 215 N 0.41 0.85 -0.44 0.12 3.08 -1.95 -1.09 114.38 115.36 1bwv h ARG 215 Ca -0.05 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 1bwv h ARG 215 Cb 1.40 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 1bwv h ARG 215 CO 0.15 0.61 0.14 0.93 -1.07 0.00 0.00 179.97 180.74 1bwv h GLU 216 N 0.86 0.68 -0.48 0.04 3.07 -1.99 -1.33 114.58 115.43 1bwv h GLU 216 Ca 0.22 -0.14 -0.04 0.00 -0.50 0.00 0.00 59.36 58.90 1bwv h GLU 216 Cb -0.01 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1bwv h GLU 216 CO -0.04 0.65 0.13 -0.09 -1.40 0.00 0.00 179.01 178.26 1bwv h ARG 217 N 0.57 0.76 -0.17 2.33 2.43 -1.37 -0.08 114.38 118.85 1bwv h ARG 217 Ca 0.14 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1bwv h ARG 217 Cb 0.25 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1bwv h ARG 217 CO -0.01 0.74 0.08 1.88 -1.51 0.00 0.00 179.97 181.16 1bwv h TYR 218 N 0.65 0.25 0.01 2.20 -1.99 -1.04 0.08 116.97 117.13 1bwv h TYR 218 Ca 0.15 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.87 1bwv h TYR 218 Cb 0.31 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1bwv h TYR 218 CO 0.02 0.27 -0.00 -0.07 -0.00 0.00 0.00 178.16 178.37 1bwv h LEU 219 N 0.15 -0.01 -0.62 3.88 -0.00 -1.02 -1.77 115.31 115.93 1bwv h LEU 219 Ca 0.06 -0.08 -0.12 0.00 -0.00 0.00 0.00 57.88 57.74 1bwv h LEU 219 Cb 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.76 1bwv h LEU 219 CO -0.01 0.07 -0.17 -0.26 -0.00 0.00 0.00 178.44 178.07 1bwv h PHE 220 N -0.09 1.03 -0.42 1.13 0.04 -0.97 -2.80 116.94 114.86 1bwv h PHE 220 Ca -0.00 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.53 1bwv h PHE 220 Cb 0.09 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 37.97 1bwv h PHE 220 CO -0.05 1.01 0.23 1.15 -0.60 0.00 0.00 178.31 180.05 1bwv h THR 221 N 0.80 1.15 -0.24 -1.55 2.02 -0.92 -2.09 112.91 112.09 1bwv h THR 221 Ca 0.12 -0.39 -0.05 0.00 0.77 0.00 0.00 66.41 66.86 1bwv h THR 221 Cb 0.72 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1bwv h THR 221 CO 0.06 0.16 -0.06 0.24 0.37 0.00 0.00 175.52 176.29 1bwv h MET 222 N 0.54 0.38 -0.13 6.66 2.86 -1.19 0.14 114.93 124.19 1bwv h MET 222 Ca 0.15 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1bwv h MET 222 Cb 0.05 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1bwv h MET 222 CO -0.02 0.45 0.07 1.49 1.06 0.00 0.00 176.91 179.95 1bwv h GLU 223 N 0.36 0.18 -0.72 1.72 4.57 -1.31 -1.54 114.58 117.84 1bwv h GLU 223 Ca 0.08 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1bwv h GLU 223 Cb 0.33 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 1bwv h GLU 223 CO 0.01 0.21 0.38 0.00 -1.18 0.00 0.00 179.01 178.43 1bwv h ALA 224 N 0.96 0.92 -0.29 2.92 0.00 -0.60 -0.86 119.26 122.32 1bwv h ALA 224 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bwv h ALA 224 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1bwv h ALA 224 CO -0.01 0.45 0.17 0.28 0.00 0.00 0.00 179.25 180.15 1bwv h VAL 225 N 0.99 1.10 -0.20 0.00 2.07 -0.65 -0.88 116.25 118.68 1bwv h VAL 225 Ca 0.25 -0.23 -0.15 0.00 0.82 0.00 0.00 66.70 67.38 1bwv h VAL 225 Cb 0.07 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1bwv h VAL 225 CO -0.04 0.10 -0.51 0.78 0.02 0.00 0.00 177.57 177.93 1bwv h ASN 226 N 0.36 0.60 -0.28 0.57 2.35 -1.03 -0.69 115.58 117.45 1bwv h ASN 226 Ca 0.10 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.54 1bwv h ASN 226 Cb 0.01 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1bwv h ASN 226 CO -0.02 1.00 0.14 0.11 -1.65 0.00 0.00 177.43 177.01 1bwv h LYS 227 N 0.43 0.40 -0.71 0.81 1.57 -1.00 -1.40 116.57 116.67 1bwv h LYS 227 Ca 0.02 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1bwv h LYS 227 Cb 1.03 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 1bwv h LYS 227 CO 0.10 0.37 0.47 0.00 -0.57 0.00 0.00 179.45 179.81 1bwv h ALA 228 N 1.01 0.91 -0.05 3.86 0.00 -0.97 -0.09 119.26 123.92 1bwv h ALA 228 Ca 0.10 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1bwv h ALA 228 Cb 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1bwv h ALA 228 CO -0.01 0.30 -0.00 1.03 0.00 0.00 0.00 179.25 180.57 1bwv h SER 229 N 0.94 -0.02 0.11 0.00 0.87 -0.94 -0.54 113.55 113.97 1bwv h SER 229 Ca 0.27 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.80 1bwv h SER 229 Cb -0.08 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1bwv h SER 229 CO -0.07 -0.00 -0.14 0.00 -0.53 0.00 0.00 176.83 176.09 1bwv h ALA 230 N 1.04 1.68 0.00 6.23 0.00 -0.84 0.73 119.26 128.10 1bwv h ALA 230 Ca 0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1bwv h ALA 230 Cb 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1bwv h ALA 230 CO -0.04 0.24 -0.14 0.00 0.00 0.00 0.00 179.25 179.31 1bwv h ALA 231 N 1.79 0.93 0.00 0.00 0.00 -0.43 -3.38 119.26 118.16 1bwv h ALA 231 Ca 0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1bwv h ALA 231 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1bwv h ALA 231 CO 0.02 0.17 -1.39 0.25 0.00 0.00 0.00 179.25 178.30 1bwv n THR 232 N -3.16 0.24 -1.23 0.00 -2.24 -0.27 -5.01 114.28 102.61 1bwv n THR 232 Ca 0.03 -0.23 -0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1bwv n THR 232 Cb 0.53 -0.27 -0.00 0.00 -2.10 0.00 0.00 70.33 68.49 1bwv n THR 232 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bwv n GLY 233 N 2.36 0.40 3.56 3.38 0.00 0.19 -5.06 105.19 110.02 1bwv n GLY 233 Ca -0.06 -1.03 -0.24 0.00 0.00 0.00 0.00 46.02 44.69 1bwv n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bwv s GLU 234 N -2.48 1.96 -0.09 1.61 2.02 -1.24 -5.08 118.70 115.39 1bwv s GLU 234 Ca 0.00 -1.68 -0.26 0.00 0.02 0.00 0.00 54.97 53.06 1bwv s GLU 234 Cb 0.00 -1.91 -0.03 0.00 0.10 0.00 0.00 34.13 32.29 1bwv s GLU 234 CO 0.00 0.28 0.81 0.08 0.02 0.00 0.00 175.26 176.46 1bwv s VAL 235 N -2.47 4.94 0.33 2.63 1.01 -1.26 -4.52 120.40 121.06 1bwv s VAL 235 Ca 0.32 1.66 0.10 0.00 0.00 0.00 0.00 61.98 64.05 1bwv s VAL 235 Cb -0.04 -4.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 1bwv s VAL 235 CO 0.17 0.14 -0.12 -0.54 0.00 0.00 0.00 175.10 174.75 1bwv s LYS 236 N 1.38 1.78 0.18 2.72 -0.14 -1.26 -4.99 119.74 119.40 1bwv s LYS 236 Ca 0.41 -1.89 -0.22 0.00 -1.36 0.00 0.00 55.97 52.91 1bwv s LYS 236 Cb -0.18 -1.71 0.06 0.00 -1.68 0.00 0.00 37.83 34.32 1bwv s LYS 236 CO 0.18 0.19 0.60 0.20 -0.76 0.00 0.00 175.35 175.77 1bwv s GLY 237 N -3.58 -0.51 -0.03 -3.33 0.00 -1.11 -4.80 107.32 93.97 1bwv s GLY 237 Ca 0.32 0.32 0.01 0.00 0.00 0.00 0.00 44.72 45.37 1bwv s GLY 237 CO 0.16 0.09 -0.00 -1.58 0.00 0.00 0.00 173.10 171.76 1bwv s HIS 238 N -3.78 0.34 -0.53 1.90 2.46 -1.26 -2.52 115.29 111.90 1bwv s HIS 238 Ca 0.03 -0.02 -0.28 0.00 0.47 0.00 0.00 55.06 55.26 1bwv s HIS 238 Cb -0.02 -0.42 0.00 0.00 -0.13 0.00 0.00 32.58 32.02 1bwv s HIS 238 CO -0.10 -0.13 1.53 0.71 -2.47 0.00 0.00 174.74 174.28 1bwv s TYR 239 N 0.97 2.14 -0.13 3.88 2.02 -0.29 -4.66 117.35 121.27 1bwv s TYR 239 Ca -0.10 0.55 -0.27 0.00 -0.37 0.00 0.00 57.07 56.88 1bwv s TYR 239 Cb -0.13 -4.31 -0.01 0.00 -0.40 0.00 0.00 41.96 37.10 1bwv s TYR 239 CO -0.01 -2.15 0.91 -0.51 -1.57 0.00 0.00 175.55 172.21 1bwv s LEU 240 N 6.57 4.22 -0.38 -1.29 1.43 -1.25 -2.18 118.68 125.80 1bwv s LEU 240 Ca 0.58 1.34 -0.25 0.00 -1.03 0.00 0.00 54.13 54.78 1bwv s LEU 240 Cb -0.13 -3.38 0.02 0.00 0.03 0.00 0.00 46.19 42.73 1bwv s LEU 240 CO 0.26 -0.41 0.89 0.21 0.23 0.00 0.00 176.35 177.53 1bwv s ASN 241 N 1.11 6.61 0.00 2.29 3.04 -1.26 -0.66 114.94 126.07 1bwv s ASN 241 Ca 0.43 0.43 0.20 0.00 0.04 0.00 0.00 52.86 53.96 1bwv s ASN 241 Cb -0.17 -2.44 0.55 0.00 -1.54 0.00 0.00 41.25 37.64 1bwv s ASN 241 CO 0.15 -0.86 1.46 1.33 -3.04 0.00 0.00 177.10 176.14 1bwv n VAL 242 N 6.01 0.77 -1.69 -5.21 0.24 -0.51 -4.86 118.33 113.08 1bwv n VAL 242 Ca 0.06 -0.81 -0.44 0.00 -2.04 0.00 0.00 64.34 61.11 1bwv n VAL 242 Cb 0.48 0.48 -0.03 0.00 -1.47 0.00 0.00 33.84 33.30 1bwv n VAL 242 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1bwv n THR 243 N 1.31 0.40 -3.94 3.34 -1.04 -1.26 -4.48 114.28 108.62 1bwv n THR 243 Ca 0.21 -0.10 -0.09 0.00 -2.04 0.00 0.00 64.05 62.03 1bwv n THR 243 Cb 0.53 -1.67 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 1bwv n THR 243 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bwv s ALA 244 N 0.58 -0.59 0.17 2.41 0.00 -1.26 -4.88 121.76 118.18 1bwv s ALA 244 Ca 0.73 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.91 1bwv s ALA 244 Cb -0.61 0.96 0.04 0.00 0.00 0.00 0.00 23.12 23.51 1bwv s ALA 244 CO 0.41 -0.93 1.57 0.00 0.00 0.00 0.00 175.76 176.81 1bwv h ALA 245 N 2.13 0.73 -2.06 0.00 0.00 -1.96 -3.46 119.26 114.64 1bwv h ALA 245 Ca -0.24 -0.39 -0.61 0.00 0.00 0.00 0.00 54.91 53.68 1bwv h ALA 245 Cb 1.25 -0.17 -0.14 0.00 0.00 0.00 0.00 17.79 18.73 1bwv h ALA 245 CO 0.31 0.67 -0.71 0.95 0.00 0.00 0.00 179.25 180.47 1bwv s THR 246 N -4.68 2.31 0.20 0.00 -4.23 -1.26 -5.05 115.64 102.92 1bwv s THR 246 Ca -0.11 -2.29 -0.09 0.00 -1.18 0.00 0.00 61.69 58.02 1bwv s THR 246 Cb 0.12 -2.49 0.12 0.00 1.34 0.00 0.00 72.50 71.60 1bwv s THR 246 CO 0.87 -0.29 1.73 -0.03 -0.54 0.00 0.00 174.62 176.35 1bwv h MET 247 N 2.14 1.11 -0.84 3.99 4.05 -2.00 -2.15 114.93 121.24 1bwv h MET 247 Ca -0.41 -0.24 -0.00 0.00 -0.28 0.00 0.00 59.70 58.77 1bwv h MET 247 Cb 1.25 -0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.85 1bwv h MET 247 CO 0.66 0.95 0.52 0.93 0.23 0.00 0.00 176.91 180.19 1bwv h GLU 248 N 1.05 1.13 -0.42 0.39 3.07 -1.99 -0.14 114.58 117.67 1bwv h GLU 248 Ca 0.23 -0.09 -0.11 0.00 -0.50 0.00 0.00 59.36 58.89 1bwv h GLU 248 Cb 0.30 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1bwv h GLU 248 CO -0.01 0.78 -0.19 1.49 -1.40 0.00 0.00 179.01 179.69 1bwv h GLU 249 N 1.14 0.81 -0.41 2.33 4.57 -1.92 -1.19 114.58 119.92 1bwv h GLU 249 Ca 0.30 -0.31 -0.04 0.00 -1.18 0.00 0.00 59.36 58.13 1bwv h GLU 249 Cb -0.07 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 1bwv h GLU 249 CO -0.06 0.93 0.11 0.52 -1.18 0.00 0.00 179.01 179.34 1bwv h MET 250 N 0.71 0.64 -0.97 1.92 2.86 -0.72 -2.36 114.93 117.02 1bwv h MET 250 Ca 0.10 -0.15 0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1bwv h MET 250 Cb 0.70 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.22 1bwv h MET 250 CO 0.05 0.65 0.63 1.88 1.06 0.00 0.00 176.91 181.19 1bwv h TYR 251 N 0.51 1.20 -0.59 -0.22 0.05 -0.87 0.19 116.97 117.25 1bwv h TYR 251 Ca 0.13 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.95 1bwv h TYR 251 Cb 0.29 -0.40 -0.03 0.00 1.01 0.00 0.00 36.73 37.60 1bwv h TYR 251 CO 0.01 0.71 0.39 0.00 -1.05 0.00 0.00 178.16 178.23 1bwv h ALA 252 N 1.38 0.75 -0.20 3.88 0.00 -0.92 0.11 119.26 124.27 1bwv h ALA 252 Ca 0.37 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1bwv h ALA 252 Cb -0.06 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1bwv h ALA 252 CO -0.11 0.17 -0.18 0.00 0.00 0.00 0.00 179.25 179.13 1bwv h ARG 253 N 0.79 0.47 -0.44 0.00 3.08 -0.90 -1.93 114.38 115.44 1bwv h ARG 253 Ca 0.22 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 60.03 1bwv h ARG 253 Cb -0.08 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1bwv h ARG 253 CO -0.05 0.81 0.28 0.00 -1.07 0.00 0.00 179.97 179.94 1bwv h ALA 254 N 0.65 0.56 -0.20 0.04 0.00 -0.79 -1.70 119.26 117.81 1bwv h ALA 254 Ca 0.03 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1bwv h ALA 254 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bwv h ALA 254 CO 0.05 -0.01 -0.26 -0.91 0.00 0.00 0.00 179.25 178.11 1bwv h ASN 255 N 0.57 0.38 -0.41 0.00 -0.26 -0.72 -0.47 115.58 114.68 1bwv h ASN 255 Ca 0.17 -0.13 -0.10 0.00 -0.56 0.00 0.00 56.30 55.68 1bwv h ASN 255 Cb -0.04 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.10 1bwv h ASN 255 CO -0.05 0.64 -0.14 0.15 -1.06 0.00 0.00 177.43 176.97 1bwv h PHE 256 N 0.34 0.93 -1.01 1.19 3.57 -1.06 -0.25 116.94 120.66 1bwv h PHE 256 Ca 0.05 -0.22 0.03 0.00 3.53 0.00 0.00 57.97 61.36 1bwv h PHE 256 Cb 0.64 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 1bwv h PHE 256 CO 0.02 0.96 0.66 0.00 -2.23 0.00 0.00 178.31 177.72 1bwv h ALA 257 N 0.83 1.32 -0.14 2.41 0.00 -0.83 -1.05 119.26 121.80 1bwv h ALA 257 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bwv h ALA 257 Cb 0.69 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1bwv h ALA 257 CO 0.05 0.59 0.09 -0.22 0.00 0.00 0.00 179.25 179.76 1bwv h LYS 258 N 1.30 0.18 -0.98 0.00 3.64 -0.82 -2.07 116.57 117.83 1bwv h LYS 258 Ca 0.39 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.79 1bwv h LYS 258 Cb -0.05 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 1bwv h LYS 258 CO -0.11 0.13 0.64 0.93 -2.27 0.00 0.00 179.45 178.77 1bwv h GLU 259 N 0.18 1.23 0.00 1.90 5.08 -0.18 -1.96 114.58 120.81 1bwv h GLU 259 Ca 0.05 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1bwv h GLU 259 Cb -0.01 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1bwv h GLU 259 CO -0.01 0.81 0.00 1.28 -1.00 0.00 0.00 179.01 180.09 1bwv n LEU 260 N -4.42 0.00 0.00 1.33 4.77 -0.48 -4.92 117.00 113.28 1bwv n LEU 260 Ca 0.13 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1bwv n LEU 260 Cb 0.07 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1bwv n LEU 260 CO 0.35 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1bwv n GLY 261 N 0.93 0.59 3.77 -0.72 0.00 -0.74 -5.03 105.19 103.99 1bwv n GLY 261 Ca 0.13 -0.80 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 1bwv n GLY 261 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bwv s SER 262 N -2.79 6.94 0.29 1.61 0.15 -0.80 -4.92 113.70 114.18 1bwv s SER 262 Ca 0.00 2.51 0.25 0.00 0.70 0.00 0.00 55.95 59.41 1bwv s SER 262 Cb 0.00 -2.64 0.60 0.00 -1.71 0.00 0.00 66.02 62.27 1bwv s SER 262 CO 0.00 -0.40 1.68 1.62 1.20 0.00 0.00 173.24 177.34 1bwv h VAL 263 N 3.01 0.00 -3.17 4.45 3.04 -1.90 -3.45 116.25 118.23 1bwv h VAL 263 Ca -0.48 -0.68 -0.10 0.00 -1.01 0.00 0.00 66.70 64.43 1bwv h VAL 263 Cb 1.22 1.64 -0.18 0.00 -2.01 0.00 0.00 31.29 31.96 1bwv h VAL 263 CO 0.66 0.00 -0.24 -0.51 -1.01 0.00 0.00 177.57 176.46 1bwv s ILE 264 N -3.15 0.07 0.24 3.17 2.07 -1.26 -1.71 121.20 120.63 1bwv s ILE 264 Ca 0.09 -0.58 0.01 0.00 -1.41 0.00 0.00 60.65 58.75 1bwv s ILE 264 Cb 0.10 -0.82 -0.05 0.00 0.13 0.00 0.00 42.46 41.81 1bwv s ILE 264 CO 0.63 -0.32 0.10 0.27 -1.91 0.00 0.00 174.94 173.71 1bwv s ILE 265 N -2.09 0.43 0.03 2.00 -4.36 -0.59 -3.77 121.20 112.85 1bwv s ILE 265 Ca -0.08 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.32 1bwv s ILE 265 Cb -0.02 -2.58 -0.02 0.00 1.25 0.00 0.00 42.46 41.08 1bwv s ILE 265 CO -0.00 -0.03 -0.05 0.00 0.24 0.00 0.00 174.94 175.10 1bwv s MET 266 N -4.06 0.43 0.20 0.37 0.23 0.17 -1.36 119.30 115.28 1bwv s MET 266 Ca 0.37 -0.75 0.04 0.00 -1.03 0.00 0.00 55.69 54.33 1bwv s MET 266 Cb 0.08 -0.03 -0.05 0.00 -1.53 0.00 0.00 34.83 33.30 1bwv s MET 266 CO 0.13 -0.02 -0.05 0.96 -2.03 0.00 0.00 175.02 174.00 1bwv s ILE 267 N -1.77 1.15 -0.07 3.16 -4.36 -0.24 -1.43 121.20 117.64 1bwv s ILE 267 Ca -0.11 -2.06 0.02 0.00 -0.26 0.00 0.00 60.65 58.25 1bwv s ILE 267 Cb -0.08 -2.13 -0.03 0.00 1.25 0.00 0.00 42.46 41.48 1bwv s ILE 267 CO -0.02 -0.51 -0.11 -1.81 0.24 0.00 0.00 174.94 172.73 1bwv s ASP 268 N -3.25 4.27 0.43 4.36 1.01 -1.26 -1.02 116.67 121.20 1bwv s ASP 268 Ca 0.23 -0.14 0.23 0.00 0.71 0.00 0.00 52.55 53.58 1bwv s ASP 268 Cb 0.04 -1.05 1.22 0.00 1.01 0.00 0.00 42.92 44.13 1bwv s ASP 268 CO 0.05 0.33 1.76 0.25 0.21 0.00 0.00 175.17 177.78 1bwv h LEU 270 N 5.47 0.34 -2.00 1.23 5.85 -1.12 -0.52 115.31 124.57 1bwv h LEU 270 Ca -0.45 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1bwv h LEU 270 Cb 1.17 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1bwv h LEU 270 CO 0.52 0.04 0.17 1.62 -0.34 0.00 0.00 178.44 180.45 1bwv h VAL 271 N 0.29 0.00 0.00 1.05 3.04 -1.82 -0.31 116.25 118.50 1bwv h VAL 271 Ca 0.61 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 66.25 1bwv h VAL 271 Cb 1.74 0.67 -0.01 0.00 -2.01 0.00 0.00 31.29 31.68 1bwv h VAL 271 CO -0.25 0.00 -0.22 0.16 -1.01 0.00 0.00 177.57 176.25 1bwv h ILE 272 N 0.00 0.69 0.00 3.17 3.07 -1.46 -3.49 117.51 119.50 1bwv h ILE 272 Ca 0.00 -0.94 0.00 0.00 1.55 0.00 0.00 64.86 65.47 1bwv h ILE 272 Cb 0.33 1.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.47 1bwv h ILE 272 CO 0.00 0.21 0.00 0.61 -1.05 0.00 0.00 178.15 177.92 1bwv n GLY 273 N -0.29 1.89 0.13 0.16 0.00 -0.13 -4.60 105.19 102.36 1bwv n GLY 273 Ca -0.01 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 43.96 1bwv n GLY 273 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1bwv h TYR 274 N 0.00 0.33 -0.43 1.61 0.05 -1.95 -1.00 116.97 115.58 1bwv h TYR 274 Ca 0.00 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1bwv h TYR 274 Cb 0.00 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 37.61 1bwv h TYR 274 CO 0.00 0.21 0.20 1.15 -1.05 0.00 0.00 178.16 178.67 1bwv h THR 275 N 0.35 1.18 -0.79 -2.88 2.02 -1.99 -0.36 112.91 110.44 1bwv h THR 275 Ca 0.10 -0.53 -0.04 0.00 0.77 0.00 0.00 66.41 66.71 1bwv h THR 275 Cb -0.04 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 1bwv h THR 275 CO -0.02 0.20 0.34 0.00 0.37 0.00 0.00 175.52 176.42 1bwv h ALA 276 N 1.05 1.12 -0.06 6.16 0.00 -1.77 -0.88 119.26 124.88 1bwv h ALA 276 Ca 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1bwv h ALA 276 Cb 0.13 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1bwv h ALA 276 CO -0.02 0.64 0.03 0.82 0.00 0.00 0.00 179.25 180.73 1bwv h ILE 277 N 1.13 1.08 -0.97 0.00 2.04 -0.76 -0.79 117.51 119.24 1bwv h ILE 277 Ca 0.27 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1bwv h ILE 277 Cb 0.17 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1bwv h ILE 277 CO -0.03 0.07 0.61 1.56 0.00 0.00 0.00 178.15 180.36 1bwv h GLN 278 N 0.00 1.31 -0.64 2.37 4.20 -0.81 0.65 115.11 122.19 1bwv h GLN 278 Ca 0.02 -0.10 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 1bwv h GLN 278 Cb 0.08 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 1bwv h GLN 278 CO -0.00 0.89 0.30 1.15 -0.67 0.00 0.00 178.83 180.50 1bwv h THR 279 N 1.33 1.22 -0.00 -0.54 2.02 -0.97 -2.16 112.91 113.81 1bwv h THR 279 Ca 0.35 -0.64 -0.13 0.00 0.77 0.00 0.00 66.41 66.77 1bwv h THR 279 Cb -0.10 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 1bwv h THR 279 CO -0.07 0.26 -0.61 0.24 0.37 0.00 0.00 175.52 175.71 1bwv h MET 280 N 0.88 0.00 -0.66 6.66 2.86 -0.41 -2.03 114.93 122.23 1bwv h MET 280 Ca 0.22 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.77 1bwv h MET 280 Cb 0.14 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 1bwv h MET 280 CO -0.03 0.61 0.09 0.00 1.06 0.00 0.00 176.91 178.64 1bwv h ALA 281 N 1.39 0.90 -0.25 6.32 0.00 -0.49 -0.00 119.26 127.13 1bwv h ALA 281 Ca -0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1bwv h ALA 281 Cb 1.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1bwv h ALA 281 CO 0.08 0.67 0.03 -0.22 0.00 0.00 0.00 179.25 179.81 1bwv h LYS 282 N 1.03 0.42 -0.44 0.00 3.64 -1.28 -2.31 116.57 117.62 1bwv h LYS 282 Ca 0.20 -0.12 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1bwv h LYS 282 Cb 0.47 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 1bwv h LYS 282 CO 0.02 0.56 0.16 2.35 -2.27 0.00 0.00 179.45 180.27 1bwv h TRP 283 N 0.21 0.29 -0.74 1.91 7.01 -1.00 -1.21 115.95 122.42 1bwv h TRP 283 Ca 0.07 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.10 1bwv h TRP 283 Cb 0.35 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 27.31 1bwv h TRP 283 CO 0.03 0.11 0.48 0.00 -2.79 0.00 0.00 178.44 176.27 1bwv h ALA 284 N 1.29 0.93 -0.40 2.65 0.00 -0.90 -0.12 119.26 122.71 1bwv h ALA 284 Ca 0.21 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1bwv h ALA 284 Cb 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1bwv h ALA 284 CO -0.21 0.36 0.19 -0.09 0.00 0.00 0.00 179.25 179.51 1bwv h ARG 285 N 1.00 0.58 0.00 0.00 9.65 -0.96 -1.24 114.38 123.40 1bwv h ARG 285 Ca 0.27 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1bwv h ARG 285 Cb -0.10 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.37 1bwv h ARG 285 CO -0.06 0.51 0.00 -0.44 2.80 0.00 0.00 179.97 182.78 1bwv h ASP 286 N 0.51 0.00 0.00 -3.80 3.32 -0.80 -3.29 116.42 112.37 1bwv h ASP 286 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1bwv h ASP 286 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1bwv h ASP 286 CO -0.02 0.00 -0.05 0.59 -1.72 0.00 0.00 179.24 178.04 1bwv n ASN 287 N -2.90 2.07 -3.82 6.45 3.02 -0.09 -5.02 115.26 114.96 1bwv n ASN 287 Ca 0.01 -2.91 -0.24 0.00 -0.03 0.00 0.00 54.58 51.41 1bwv n ASN 287 Cb 0.32 -0.38 0.01 0.00 -0.61 0.00 0.00 39.78 39.11 1bwv n ASN 287 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1bwv n ASP 288 N -1.24 -1.24 -4.20 6.41 8.00 -0.53 -4.98 116.55 118.78 1bwv n ASP 288 Ca 0.13 -0.94 -0.29 0.00 0.71 0.00 0.00 54.79 54.41 1bwv n ASP 288 Cb 0.63 -3.48 -0.16 0.00 -0.02 0.00 0.00 41.12 38.09 1bwv n ASP 288 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1bwv s MET 289 N -6.25 2.27 0.08 -1.24 1.75 -0.86 -4.96 119.30 110.09 1bwv s MET 289 Ca 0.06 -0.76 -0.30 0.00 -1.25 0.00 0.00 55.69 53.44 1bwv s MET 289 Cb -0.02 -1.90 -0.05 0.00 2.84 0.00 0.00 34.83 35.70 1bwv s MET 289 CO 0.86 0.29 1.01 0.42 -0.65 0.00 0.00 175.02 176.94 1bwv s ILE 290 N 0.02 4.46 -0.30 10.11 1.01 -0.69 -4.60 121.20 131.20 1bwv s ILE 290 Ca -0.06 1.94 -0.06 0.00 0.00 0.00 0.00 60.65 62.47 1bwv s ILE 290 Cb -0.13 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.12 1bwv s ILE 290 CO 0.04 0.25 0.06 -0.22 0.00 0.00 0.00 174.94 175.07 1bwv s LEU 291 N 0.34 3.86 -0.16 2.97 2.96 -1.26 -1.54 118.68 125.84 1bwv s LEU 291 Ca 0.50 -0.85 -0.12 0.00 -0.22 0.00 0.00 54.13 53.44 1bwv s LEU 291 Cb -0.24 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 1bwv s LEU 291 CO 0.30 -0.21 0.22 -2.28 -1.32 0.00 0.00 176.35 173.06 1bwv s HIS 292 N 1.44 3.47 -0.16 5.38 5.65 -0.47 -0.85 115.29 129.76 1bwv s HIS 292 Ca 0.01 0.51 -0.06 0.00 0.25 0.00 0.00 55.06 55.78 1bwv s HIS 292 Cb -0.18 -2.23 -0.04 0.00 -1.18 0.00 0.00 32.58 28.95 1bwv s HIS 292 CO 0.01 0.33 0.04 -1.17 -0.65 0.00 0.00 174.74 173.30 1bwv s LEU 293 N 0.20 3.70 -0.23 8.88 2.96 0.02 -1.08 118.68 133.14 1bwv s LEU 293 Ca 0.14 0.08 -0.08 0.00 -0.22 0.00 0.00 54.13 54.04 1bwv s LEU 293 Cb -0.12 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 1bwv s LEU 293 CO 0.02 0.22 0.10 -2.28 -1.32 0.00 0.00 176.35 173.10 1bwv s HIS 294 N 0.05 3.20 -0.83 5.38 5.65 -0.19 -3.61 115.29 124.95 1bwv s HIS 294 Ca 0.04 -0.06 -0.08 0.00 0.25 0.00 0.00 55.06 55.21 1bwv s HIS 294 Cb -0.12 -2.21 -0.17 0.00 -1.18 0.00 0.00 32.58 28.90 1bwv s HIS 294 CO 0.01 -0.08 3.27 2.89 -0.65 0.00 0.00 174.74 180.18 1bwv n ARG 295 N 4.35 2.89 -1.99 2.88 -4.01 -1.26 -0.72 116.66 118.80 1bwv n ARG 295 Ca -0.16 -1.66 -0.42 0.00 -1.04 0.00 0.00 57.85 54.57 1bwv n ARG 295 Cb 0.52 -2.41 -0.03 0.00 -3.04 0.00 0.00 32.46 27.50 1bwv n ARG 295 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1bwv s ALA 296 N 1.48 3.71 0.00 2.89 0.00 -1.26 -1.66 121.76 126.92 1bwv s ALA 296 Ca 0.68 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1bwv s ALA 296 Cb 0.25 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1bwv s ALA 296 CO -0.04 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.29 1bwv n GLY 297 N 3.77 1.86 0.22 0.00 0.00 -1.26 -3.27 105.19 106.50 1bwv n GLY 297 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 1bwv n GLY 297 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1bwv h ASN 298 N 0.00 0.11 0.25 1.61 -1.24 -1.72 -2.09 115.58 112.50 1bwv h ASN 298 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 56.30 57.10 1bwv h ASN 298 Cb 0.00 0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.15 1bwv h ASN 298 CO 0.00 0.07 0.00 -1.20 -1.29 0.00 0.00 177.43 175.01 1bwv n SER 299 N -5.06 0.00 0.22 1.15 7.64 -1.26 -1.99 113.62 114.32 1bwv n SER 299 Ca 0.08 -0.19 0.06 0.00 1.01 0.00 0.00 58.87 59.82 1bwv n SER 299 Cb 0.27 -0.20 0.53 0.00 -1.01 0.00 0.00 64.21 63.80 1bwv n SER 299 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1bwv h THR 300 N 0.00 1.10 0.00 0.44 2.02 -1.78 -3.28 112.91 111.41 1bwv h THR 300 Ca 0.00 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1bwv h THR 300 Cb 0.12 1.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1bwv h THR 300 CO 0.00 0.13 -0.11 0.00 0.37 0.00 0.00 175.52 175.91 1bwv n TYR 301 N -4.38 0.00 0.71 3.16 0.18 -0.84 -4.83 117.16 111.16 1bwv n TYR 301 Ca -0.02 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.86 1bwv n TYR 301 Cb 0.20 0.00 0.11 0.00 -0.38 0.00 0.00 39.34 39.27 1bwv n TYR 301 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1bwv n SER 302 N -0.99 2.87 0.13 9.48 3.41 -0.98 -1.77 113.62 125.76 1bwv n SER 302 Ca 0.00 -1.89 -0.24 0.00 -0.26 0.00 0.00 58.87 56.48 1bwv n SER 302 Cb 0.00 -0.06 -0.16 0.00 -0.26 0.00 0.00 64.21 63.74 1bwv n SER 302 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1bwv h ARG 303 N 4.05 0.49 -5.66 4.33 9.65 -1.85 -3.44 114.38 121.96 1bwv h ARG 303 Ca 0.00 -0.85 -0.61 0.00 -1.10 0.00 0.00 59.98 57.42 1bwv h ARG 303 Cb 0.88 0.31 -0.08 0.00 -1.39 0.00 0.00 29.97 29.69 1bwv h ARG 303 CO 0.00 1.40 -0.33 -0.65 2.80 0.00 0.00 179.97 183.20 1bwv s GLN 304 N -2.60 3.99 0.52 0.20 -1.52 -1.26 -3.60 119.66 115.38 1bwv s GLN 304 Ca -0.11 0.13 0.26 0.00 -1.95 0.00 0.00 55.36 53.69 1bwv s GLN 304 Cb 0.05 -3.32 1.41 0.00 -0.22 0.00 0.00 33.01 30.93 1bwv s GLN 304 CO 0.92 0.48 2.08 -0.22 -0.25 0.00 0.00 175.29 178.29 1bwv h LYS 305 N 5.78 0.00 0.00 2.91 3.64 -1.89 -3.10 116.57 123.91 1bwv h LYS 305 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1bwv h LYS 305 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1bwv h LYS 305 CO 0.68 0.12 -0.99 0.27 -2.27 0.00 0.00 179.45 177.26 1bwv n ASN 306 N -3.76 0.68 -3.67 4.20 6.94 -1.26 -4.90 115.26 113.48 1bwv n ASN 306 Ca -0.02 0.08 -0.14 0.00 -0.02 0.00 0.00 54.58 54.48 1bwv n ASN 306 Cb 0.23 0.60 -0.08 0.00 -2.36 0.00 0.00 39.78 38.16 1bwv n ASN 306 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1bwv s HIS 307 N -3.27 -0.61 -0.03 -2.53 5.04 -1.17 -3.05 115.29 109.66 1bwv s HIS 307 Ca 0.02 1.44 0.00 0.00 -1.54 0.00 0.00 55.06 54.98 1bwv s HIS 307 Cb 0.12 0.23 0.00 0.00 0.04 0.00 0.00 32.58 32.97 1bwv s HIS 307 CO 0.79 -0.34 0.00 0.41 -2.34 0.00 0.00 174.74 173.26 1bwv n GLY 308 N 2.52 0.09 2.80 1.59 0.00 -0.89 -4.43 105.19 106.86 1bwv n GLY 308 Ca -0.15 -1.76 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 1bwv n GLY 308 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bwv s MET 309 N -0.32 0.01 0.31 1.61 -1.94 -0.73 -1.29 119.30 116.95 1bwv s MET 309 Ca 0.00 0.13 -0.28 0.00 -1.71 0.00 0.00 55.69 53.83 1bwv s MET 309 Cb 0.00 -0.22 -0.09 0.00 2.01 0.00 0.00 34.83 36.52 1bwv s MET 309 CO 0.00 -0.13 1.09 1.21 -0.01 0.00 0.00 175.02 177.18 1bwv s ASN 310 N 0.83 7.15 0.59 3.03 3.84 -0.07 -3.81 114.94 126.50 1bwv s ASN 310 Ca -0.07 2.21 0.29 0.00 0.21 0.00 0.00 52.86 55.50 1bwv s ASN 310 Cb -0.10 -2.62 1.63 0.00 -0.55 0.00 0.00 41.25 39.61 1bwv s ASN 310 CO -0.02 -0.22 2.07 0.15 -2.79 0.00 0.00 177.10 176.29 1bwv h PHE 311 N 3.52 0.00 0.00 0.43 3.57 -1.91 -2.04 116.94 120.51 1bwv h PHE 311 Ca -0.47 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.00 1bwv h PHE 311 Cb 1.21 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.95 1bwv h PHE 311 CO 0.58 0.00 -0.13 0.07 -2.23 0.00 0.00 178.31 176.61 1bwv h ARG 312 N 0.00 0.00 -0.32 1.11 0.11 -1.92 0.63 114.38 113.99 1bwv h ARG 312 Ca 0.10 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.14 1bwv h ARG 312 Cb 0.59 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.66 1bwv h ARG 312 CO -0.00 0.13 0.02 0.28 0.10 0.00 0.00 179.97 180.50 1bwv h VAL 313 N 0.00 1.25 -0.58 0.08 2.07 -1.58 -1.59 116.25 115.90 1bwv h VAL 313 Ca -0.00 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.53 1bwv h VAL 313 Cb 0.24 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1bwv h VAL 313 CO 0.02 0.30 0.03 0.40 0.02 0.00 0.00 177.57 178.33 1bwv h ILE 314 N 0.36 1.26 -0.80 4.57 5.03 -1.29 -1.05 117.51 125.59 1bwv h ILE 314 Ca 0.09 -1.06 0.08 0.00 -0.12 0.00 0.00 64.86 63.84 1bwv h ILE 314 Cb 0.41 0.78 -0.07 0.00 -3.03 0.00 0.00 36.82 34.92 1bwv h ILE 314 CO 0.01 0.39 0.46 0.00 -0.68 0.00 0.00 178.15 178.33 1bwv h LYS 316 N 0.82 -0.09 -0.77 0.00 1.57 -0.56 -1.15 116.57 116.39 1bwv h LYS 316 Ca 0.37 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.19 1bwv h LYS 316 Cb 0.26 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 1bwv h LYS 316 CO -0.21 0.22 0.50 -1.49 -0.57 0.00 0.00 179.45 177.90 1bwv h TRP 317 N -0.41 0.90 0.00 -1.35 6.55 -0.91 -0.77 115.95 119.97 1bwv h TRP 317 Ca -0.01 0.02 -0.20 0.00 0.95 0.00 0.00 58.89 59.65 1bwv h TRP 317 Cb 0.35 -0.30 -0.03 0.00 -0.86 0.00 0.00 29.16 28.33 1bwv h TRP 317 CO 0.03 0.52 -0.96 0.52 -1.05 0.00 0.00 178.44 177.50 1bwv h MET 318 N 0.93 0.00 -0.38 0.49 2.86 -0.89 0.29 114.93 118.23 1bwv h MET 318 Ca 0.31 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.84 1bwv h MET 318 Cb 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1bwv h MET 318 CO -0.09 0.96 -0.22 -0.09 1.06 0.00 0.00 176.91 178.53 1bwv h ARG 319 N 0.00 0.73 -0.11 1.72 2.43 -0.64 -1.83 114.38 116.70 1bwv h ARG 319 Ca -0.01 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.86 1bwv h ARG 319 Cb 1.71 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 31.22 1bwv h ARG 319 CO 0.12 0.89 0.03 0.52 -1.51 0.00 0.00 179.97 180.02 1bwv h MET 320 N 0.64 0.17 -0.90 0.20 2.86 -1.01 -3.16 114.93 113.73 1bwv h MET 320 Ca 0.09 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.76 1bwv h MET 320 Cb 0.71 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.28 1bwv h MET 320 CO 0.05 0.34 0.56 0.00 1.06 0.00 0.00 176.91 178.92 1bwv h ALA 321 N 0.83 1.24 0.00 6.32 0.00 -0.74 -2.59 119.26 124.31 1bwv h ALA 321 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bwv h ALA 321 Cb 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bwv h ALA 321 CO -0.00 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.97 1bwv n GLY 322 N -1.34 1.09 3.77 0.00 0.00 -0.70 -4.55 105.19 103.47 1bwv n GLY 322 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1bwv n GLY 322 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bwv s VAL 323 N -1.50 3.17 -0.12 1.61 1.01 -1.10 -1.30 120.40 122.17 1bwv s VAL 323 Ca 0.00 0.76 0.20 0.00 0.00 0.00 0.00 61.98 62.93 1bwv s VAL 323 Cb 0.00 -3.32 -0.26 0.00 0.00 0.00 0.00 36.38 32.80 1bwv s VAL 323 CO 0.00 -0.13 0.40 0.47 0.00 0.00 0.00 175.10 175.85 1bwv n ASP 324 N -1.12 0.19 -3.98 3.32 8.00 -0.03 -4.38 116.55 118.53 1bwv n ASP 324 Ca 0.11 0.08 -0.13 0.00 0.71 0.00 0.00 54.79 55.56 1bwv n ASP 324 Cb 0.50 1.23 -0.13 0.00 -0.02 0.00 0.00 41.12 42.71 1bwv n ASP 324 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1bwv s HIS 325 N -3.01 0.42 -0.05 1.24 3.76 -1.03 -0.87 115.29 115.75 1bwv s HIS 325 Ca -0.08 -0.30 -0.08 0.00 -0.15 0.00 0.00 55.06 54.45 1bwv s HIS 325 Cb 0.10 -0.26 0.02 0.00 1.11 0.00 0.00 32.58 33.54 1bwv s HIS 325 CO 0.86 -0.07 0.20 -1.50 -0.85 0.00 0.00 174.74 173.38 1bwv s ILE 326 N -0.80 0.03 0.01 0.60 2.07 -0.96 -0.80 121.20 121.36 1bwv s ILE 326 Ca -0.06 -0.26 -0.30 0.00 -1.41 0.00 0.00 60.65 58.62 1bwv s ILE 326 Cb -0.06 -0.37 -0.05 0.00 0.13 0.00 0.00 42.46 42.10 1bwv s ILE 326 CO -0.00 -0.14 1.32 -1.00 -1.91 0.00 0.00 174.94 173.21 1bwv s HIS 327 N -0.49 3.07 0.00 3.50 3.76 -1.24 -0.31 115.29 123.59 1bwv s HIS 327 Ca -0.06 1.00 0.00 0.00 -0.15 0.00 0.00 55.06 55.85 1bwv s HIS 327 Cb -0.04 -3.58 0.00 0.00 1.11 0.00 0.00 32.58 30.08 1bwv s HIS 327 CO 0.01 -2.01 0.82 0.00 -0.85 0.00 0.00 174.74 172.71 1bwv n ALA 328 N 4.91 2.01 0.00 -1.40 0.00 -0.05 -4.82 120.51 121.16 1bwv n ALA 328 Ca 0.12 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1bwv n ALA 328 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1bwv n ALA 328 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwv n GLY 329 N -0.34 1.72 3.45 0.00 0.00 -1.23 -4.91 105.19 103.88 1bwv n GLY 329 Ca 0.00 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 1bwv n GLY 329 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bwv s THR 330 N -2.67 2.81 0.06 2.61 -4.23 -1.26 -4.48 115.64 108.48 1bwv s THR 330 Ca 0.00 -1.02 -0.16 0.00 -1.18 0.00 0.00 61.69 59.33 1bwv s THR 330 Cb 0.00 -2.14 -0.18 0.00 1.34 0.00 0.00 72.50 71.52 1bwv s THR 330 CO 0.00 0.45 1.24 0.58 -0.54 0.00 0.00 174.62 176.34 1bwv h VAL 331 N 4.13 1.34 -0.44 2.29 2.07 -1.90 -3.33 116.25 120.40 1bwv h VAL 331 Ca -0.47 -1.93 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1bwv h VAL 331 Cb 1.15 2.18 0.00 0.00 -1.52 0.00 0.00 31.29 33.10 1bwv h VAL 331 CO 0.49 0.59 0.00 1.33 0.02 0.00 0.00 177.57 179.99 1bwv n VAL 332 N -4.11 1.94 -1.90 2.57 0.24 -1.26 -4.59 118.33 111.22 1bwv n VAL 332 Ca -0.08 -1.01 0.00 0.00 -2.04 0.00 0.00 64.34 61.21 1bwv n VAL 332 Cb 0.67 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.76 1bwv n VAL 332 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bwv n GLY 333 N 0.54 1.85 0.04 7.63 0.00 -1.25 -4.53 105.19 109.47 1bwv n GLY 333 Ca 0.20 -2.02 0.13 0.00 0.00 0.00 0.00 46.02 44.33 1bwv n GLY 333 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1bwv n LYS 334 N 0.00 0.16 -4.07 1.61 2.85 -0.93 -4.73 118.16 113.04 1bwv n LYS 334 Ca 0.00 0.07 -0.28 0.00 -1.05 0.00 0.00 58.31 57.05 1bwv n LYS 334 Cb 0.00 -1.62 -0.06 0.00 -0.65 0.00 0.00 35.03 32.70 1bwv n LYS 334 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1bwv s LEU 335 N -3.73 3.79 0.14 -5.58 2.01 -1.26 -5.03 118.68 109.02 1bwv s LEU 335 Ca 0.10 -0.09 -0.35 0.00 0.01 0.00 0.00 54.13 53.80 1bwv s LEU 335 Cb 0.15 -2.42 -0.15 0.00 0.01 0.00 0.00 46.19 43.77 1bwv s LEU 335 CO 0.66 0.11 1.39 1.21 1.01 0.00 0.00 176.35 180.72 1bwv n GLU 336 N -0.05 1.54 -2.92 1.70 4.07 -1.26 -4.76 120.64 118.96 1bwv n GLU 336 Ca -0.08 0.55 0.03 0.00 -0.06 0.00 0.00 57.16 57.60 1bwv n GLU 336 Cb 0.54 -2.21 0.00 0.00 -0.06 0.00 0.00 31.44 29.70 1bwv n GLU 336 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1bwv s GLY 337 N 0.51 -1.37 0.05 8.31 0.00 -1.26 -4.80 107.32 108.76 1bwv s GLY 337 Ca 0.79 1.31 -0.31 0.00 0.00 0.00 0.00 44.72 46.51 1bwv s GLY 337 CO 0.45 4.16 1.28 -0.35 0.00 0.00 0.00 173.10 178.64 1bwv s ASP 338 N 2.19 6.97 0.27 1.64 2.15 -1.26 -4.50 116.67 124.13 1bwv s ASP 338 Ca 0.17 2.09 -0.01 0.00 0.43 0.00 0.00 52.55 55.23 1bwv s ASP 338 Cb 0.01 -2.58 0.60 0.00 -0.30 0.00 0.00 42.92 40.65 1bwv s ASP 338 CO -0.16 -0.57 1.67 1.55 -0.17 0.00 0.00 175.17 177.49 1bwv h PRO 339 N 7.03 0.25 -0.16 4.34 0.13 -1.96 0.32 132.00 141.96 1bwv h PRO 339 Ca -0.40 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 64.58 1bwv h PRO 339 Cb 1.20 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1bwv h PRO 339 CO 0.85 0.17 -0.42 0.82 -0.23 0.00 0.00 178.00 179.19 1bwv h ILE 340 N 0.26 1.34 -0.32 -3.56 2.04 -1.94 -1.62 117.51 113.71 1bwv h ILE 340 Ca 0.49 -1.67 -0.17 0.00 1.00 0.00 0.00 64.86 64.50 1bwv h ILE 340 Cb 0.92 1.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.97 1bwv h ILE 340 CO -0.58 0.51 -0.47 0.40 0.00 0.00 0.00 178.15 178.01 1bwv h ILE 341 N 0.22 1.27 -0.58 -0.67 1.08 -1.66 -2.88 117.51 114.29 1bwv h ILE 341 Ca -0.01 -1.65 -0.02 0.00 -0.39 0.00 0.00 64.86 62.80 1bwv h ILE 341 Cb 1.03 1.54 -0.03 0.00 -3.07 0.00 0.00 36.82 36.29 1bwv h ILE 341 CO 0.09 0.54 0.29 0.74 -0.69 0.00 0.00 178.15 179.12 1bwv h THR 342 N 0.69 1.19 -1.00 -0.27 2.02 -0.96 -2.22 112.91 112.34 1bwv h THR 342 Ca 0.03 -0.51 0.01 0.00 0.77 0.00 0.00 66.41 66.72 1bwv h THR 342 Cb 1.07 0.43 -0.05 0.00 -1.74 0.00 0.00 68.15 67.86 1bwv h THR 342 CO 0.11 0.22 0.66 -0.09 0.37 0.00 0.00 175.52 176.79 1bwv h ARG 343 N 0.81 1.31 -0.58 6.66 2.43 -1.08 -1.83 114.38 122.10 1bwv h ARG 343 Ca 0.20 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1bwv h ARG 343 Cb 0.07 -0.29 -0.03 0.00 -0.42 0.00 0.00 29.97 29.29 1bwv h ARG 343 CO -0.03 0.86 0.38 0.78 -1.51 0.00 0.00 179.97 180.45 1bwv h GLY 344 N 1.35 0.81 0.79 2.80 0.00 -1.28 -1.22 103.07 106.33 1bwv h GLY 344 Ca 0.37 -0.30 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1bwv h GLY 344 CO -0.09 0.29 -0.03 0.74 0.00 0.00 0.00 176.54 177.45 1bwv h PHE 345 N 0.77 -0.08 -0.68 5.60 0.04 -1.10 -1.00 116.94 120.50 1bwv h PHE 345 Ca 0.21 0.01 0.01 0.00 2.80 0.00 0.00 57.97 61.01 1bwv h PHE 345 Cb -0.08 0.05 -0.04 0.00 2.20 0.00 0.00 35.95 38.08 1bwv h PHE 345 CO -0.04 -0.06 0.44 1.88 -0.60 0.00 0.00 178.31 179.94 1bwv h TYR 346 N -0.02 0.84 -0.71 -0.55 -1.99 -1.08 -1.93 116.97 111.52 1bwv h TYR 346 Ca 0.05 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.80 1bwv h TYR 346 Cb 0.09 -0.28 -0.03 0.00 2.00 0.00 0.00 36.73 38.51 1bwv h TYR 346 CO -0.15 0.51 0.45 0.87 -0.00 0.00 0.00 178.16 179.84 1bwv h LYS 347 N 0.90 0.96 -0.86 4.88 1.57 -0.96 -1.15 116.57 121.90 1bwv h LYS 347 Ca 0.26 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 1bwv h LYS 347 Cb -0.07 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 31.99 1bwv h LYS 347 CO -0.07 0.66 0.56 1.15 -0.57 0.00 0.00 179.45 181.19 1bwv h THR 348 N 0.97 1.10 0.15 -0.16 2.02 -0.44 -0.97 112.91 115.58 1bwv h THR 348 Ca 0.26 -0.35 -0.29 0.00 0.77 0.00 0.00 66.41 66.80 1bwv h THR 348 Cb -0.06 -0.01 0.01 0.00 -1.74 0.00 0.00 68.15 66.35 1bwv h THR 348 CO -0.05 0.19 -1.30 -0.07 0.37 0.00 0.00 175.52 174.66 1bwv h LEU 349 N 1.02 0.49 0.00 2.58 3.38 -0.95 -3.40 115.31 118.43 1bwv h LEU 349 Ca 0.35 -0.53 -0.22 0.00 0.09 0.00 0.00 57.88 57.57 1bwv h LEU 349 Cb 0.11 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1bwv h LEU 349 CO -0.12 1.42 -2.17 0.18 0.09 0.00 0.00 178.44 177.84 1bwv n LEU 350 N -3.56 0.08 -4.85 1.67 4.32 -0.48 -1.54 117.00 112.65 1bwv n LEU 350 Ca -0.10 0.03 -0.33 0.00 -0.02 0.00 0.00 56.01 55.59 1bwv n LEU 350 Cb 1.04 0.29 -0.06 0.00 -1.62 0.00 0.00 43.42 43.07 1bwv n LEU 350 CO 0.55 0.30 0.32 -0.76 -1.22 0.00 0.00 177.39 176.57 1bwv s LEU 351 N -5.18 4.17 0.43 2.23 1.02 -0.38 -4.89 118.68 116.08 1bwv s LEU 351 Ca -0.09 1.13 0.24 0.00 0.02 0.00 0.00 54.13 55.43 1bwv s LEU 351 Cb 0.09 -3.76 0.86 0.00 0.02 0.00 0.00 46.19 43.40 1bwv s LEU 351 CO 0.86 -0.08 1.80 1.55 0.02 0.00 0.00 176.35 180.49 1bwv h PRO 352 N 2.68 0.00 -2.98 1.29 0.13 -1.95 -3.45 132.00 127.72 1bwv h PRO 352 Ca -0.48 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.49 1bwv h PRO 352 Cb 1.18 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.04 1bwv h PRO 352 CO 0.67 0.23 -0.40 0.21 -0.23 0.00 0.00 178.00 178.48 1bwv s LYS 353 N -3.59 0.31 -0.15 0.86 2.20 -1.26 -1.24 119.74 116.87 1bwv s LYS 353 Ca 0.01 0.49 -0.07 0.00 -0.36 0.00 0.00 55.97 56.04 1bwv s LYS 353 Cb 0.10 0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.44 1bwv s LYS 353 CO 0.64 -0.09 0.07 -0.51 -0.36 0.00 0.00 175.35 175.11 1bwv s LEU 354 N 0.61 3.93 -0.06 5.43 1.02 0.14 -4.97 118.68 124.78 1bwv s LEU 354 Ca -0.04 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.29 1bwv s LEU 354 Cb -0.05 -1.97 -0.03 0.00 0.02 0.00 0.00 46.19 44.15 1bwv s LEU 354 CO -0.04 0.26 0.02 -1.61 0.02 0.00 0.00 176.35 175.00 1bwv s GLU 355 N -0.15 2.96 0.14 1.70 2.02 -1.26 -1.35 118.70 122.76 1bwv s GLU 355 Ca 0.08 -0.46 -0.31 0.00 0.02 0.00 0.00 54.97 54.30 1bwv s GLU 355 Cb -0.12 -2.79 -0.11 0.00 0.10 0.00 0.00 34.13 31.22 1bwv s GLU 355 CO 0.01 0.68 1.83 -2.13 0.02 0.00 0.00 175.26 175.67 1bwv n ARG 356 N 1.83 2.83 -3.35 1.61 0.63 -1.25 -4.86 116.66 114.09 1bwv n ARG 356 Ca -0.17 1.03 -0.11 0.00 -0.92 0.00 0.00 57.85 57.68 1bwv n ARG 356 Cb 0.53 -2.92 -0.08 0.00 0.45 0.00 0.00 32.46 30.45 1bwv n ARG 356 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1bwv s ASN 357 N 2.55 0.64 0.48 6.15 3.84 0.66 -5.02 114.94 124.24 1bwv s ASN 357 Ca 0.81 -0.23 0.14 0.00 0.21 0.00 0.00 52.86 53.78 1bwv s ASN 357 Cb -0.47 0.95 1.11 0.00 -0.55 0.00 0.00 41.25 42.29 1bwv s ASN 357 CO 0.36 -0.34 2.09 -0.07 -2.79 0.00 0.00 177.10 176.35 1bwv h LEU 358 N 8.20 0.10 -0.74 3.21 -0.00 -1.93 -0.89 115.31 123.26 1bwv h LEU 358 Ca -0.14 -0.01 -0.10 0.00 -0.00 0.00 0.00 57.88 57.63 1bwv h LEU 358 Cb 1.13 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.74 1bwv h LEU 358 CO 0.28 0.12 -0.14 1.56 -0.00 0.00 0.00 178.44 180.27 1bwv h GLN 359 N 0.11 0.82 0.00 1.13 4.20 -1.92 -2.44 115.11 117.01 1bwv h GLN 359 Ca 0.03 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1bwv h GLN 359 Cb 0.07 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1bwv h GLN 359 CO 0.00 0.91 -0.21 0.39 -0.67 0.00 0.00 178.83 179.26 1bwv n GLU 360 N -4.15 0.02 -0.72 1.46 1.02 -0.86 -4.69 120.64 112.72 1bwv n GLU 360 Ca 0.01 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1bwv n GLU 360 Cb 0.39 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1bwv n GLU 360 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bwv n GLY 361 N 1.49 0.61 3.48 0.62 0.00 -0.88 -4.67 105.19 105.83 1bwv n GLY 361 Ca 0.06 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1bwv n GLY 361 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bwv s LEU 362 N 0.00 4.35 0.00 0.99 1.02 -0.40 -4.82 118.68 119.82 1bwv s LEU 362 Ca 0.00 -1.39 0.29 0.00 0.02 0.00 0.00 54.13 53.05 1bwv s LEU 362 Cb 0.00 -2.45 1.19 0.00 0.02 0.00 0.00 46.19 44.95 1bwv s LEU 362 CO 0.00 -1.36 1.89 0.49 0.02 0.00 0.00 176.35 177.39 1bwv n PHE 363 N 7.66 0.00 -4.07 0.29 3.72 -1.26 -0.25 117.46 123.55 1bwv n PHE 363 Ca 0.13 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.40 1bwv n PHE 363 Cb 0.48 -0.45 -0.11 0.00 -0.94 0.00 0.00 39.48 38.46 1bwv n PHE 363 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1bwv s PHE 364 N -2.95 0.70 0.27 1.38 0.08 -1.26 -4.92 117.98 111.28 1bwv s PHE 364 Ca 0.15 -0.53 -0.23 0.00 0.12 0.00 0.00 56.93 56.44 1bwv s PHE 364 Cb 0.19 -0.42 -0.09 0.00 -0.57 0.00 0.00 43.02 42.13 1bwv s PHE 364 CO 0.54 -0.09 0.84 -0.51 -0.10 0.00 0.00 175.22 175.90 1bwv s ASP 365 N -1.68 7.24 -0.18 1.36 1.01 -1.26 -3.91 116.67 119.25 1bwv s ASP 365 Ca -0.08 1.65 -0.09 0.00 0.71 0.00 0.00 52.55 54.73 1bwv s ASP 365 Cb -0.09 -2.51 0.06 0.00 1.01 0.00 0.00 42.92 41.40 1bwv s ASP 365 CO 0.00 0.00 0.42 -0.32 0.21 0.00 0.00 175.17 175.49 1bwv s MET 366 N -1.92 0.40 0.07 8.23 1.75 -0.46 -4.95 119.30 122.43 1bwv s MET 366 Ca 0.46 0.83 -0.19 0.00 -1.25 0.00 0.00 55.69 55.54 1bwv s MET 366 Cb -0.18 0.02 -0.07 0.00 2.84 0.00 0.00 34.83 37.44 1bwv s MET 366 CO 0.23 -0.17 0.55 -1.21 -0.65 0.00 0.00 175.02 173.78 1bwv s GLU 367 N 1.53 4.16 -0.06 4.11 0.41 -1.26 -0.68 118.70 126.90 1bwv s GLU 367 Ca -0.09 0.69 0.10 0.00 -0.41 0.00 0.00 54.97 55.26 1bwv s GLU 367 Cb -0.09 -3.21 0.39 0.00 -1.78 0.00 0.00 34.13 29.45 1bwv s GLU 367 CO -0.13 0.63 1.23 0.91 -0.49 0.00 0.00 175.26 177.41 1bwv n TRP 368 N 1.65 0.82 -2.73 1.61 7.02 -0.37 -4.76 117.44 120.69 1bwv n TRP 368 Ca -0.10 -0.33 -0.14 0.00 -1.02 0.00 0.00 57.50 55.91 1bwv n TRP 368 Cb 0.51 -0.16 -0.00 0.00 -2.42 0.00 0.00 31.31 29.23 1bwv n TRP 368 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1bwv n ALA 369 N 0.49 -0.89 -1.97 6.99 0.00 -1.26 -1.49 120.51 122.38 1bwv n ALA 369 Ca 0.14 0.09 -0.18 0.00 0.00 0.00 0.00 53.44 53.48 1bwv n ALA 369 Cb 0.55 -1.81 -0.04 0.00 0.00 0.00 0.00 19.45 18.14 1bwv n ALA 369 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bwv n SER 370 N -1.93 -5.11 -4.77 0.00 7.64 -1.26 -4.91 113.62 103.28 1bwv n SER 370 Ca -0.09 0.25 -0.38 0.00 1.01 0.00 0.00 58.87 59.66 1bwv n SER 370 Cb 0.58 -4.42 -0.02 0.00 -1.01 0.00 0.00 64.21 59.35 1bwv n SER 370 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1bwv s LEU 371 N -5.18 4.14 0.92 -3.43 1.43 -0.56 -4.97 118.68 111.03 1bwv s LEU 371 Ca 0.00 2.32 -0.10 0.00 -1.03 0.00 0.00 54.13 55.32 1bwv s LEU 371 Cb 0.00 -4.09 0.15 0.00 0.03 0.00 0.00 46.19 42.27 1bwv s LEU 371 CO 0.00 -0.74 1.13 -0.13 0.23 0.00 0.00 176.35 176.84 1bwv s ARG 372 N -2.43 0.98 0.16 1.70 0.52 -1.26 -4.98 118.95 113.64 1bwv s ARG 372 Ca 0.59 1.46 -0.24 0.00 -0.52 0.00 0.00 55.73 57.03 1bwv s ARG 372 Cb -0.30 -1.73 -0.08 0.00 0.52 0.00 0.00 34.95 33.37 1bwv s ARG 372 CO 0.37 -2.63 0.74 0.15 0.02 0.00 0.00 175.30 173.95 1bwv s LYS 373 N -4.66 4.47 -0.01 3.54 1.02 -1.26 -4.40 119.74 118.45 1bwv s LYS 373 Ca 0.66 1.06 -0.17 0.00 0.02 0.00 0.00 55.97 57.54 1bwv s LYS 373 Cb -0.22 -3.19 -0.06 0.00 -0.52 0.00 0.00 37.83 33.84 1bwv s LYS 373 CO 0.58 0.55 0.48 0.08 -0.92 0.00 0.00 175.35 176.13 1bwv s VAL 374 N -1.21 4.97 -0.35 3.17 1.01 -0.59 -1.53 120.40 125.88 1bwv s VAL 374 Ca 0.36 1.01 -0.26 0.00 0.00 0.00 0.00 61.98 63.08 1bwv s VAL 374 Cb -0.22 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.37 1bwv s VAL 374 CO 0.24 0.50 0.95 -0.32 0.00 0.00 0.00 175.10 176.48 1bwv s MET 375 N -0.64 3.91 0.43 2.72 1.75 -0.04 -4.35 119.30 123.07 1bwv s MET 375 Ca 0.26 0.70 -0.25 0.00 -1.25 0.00 0.00 55.69 55.15 1bwv s MET 375 Cb -0.17 -3.78 -0.08 0.00 2.84 0.00 0.00 34.83 33.64 1bwv s MET 375 CO 0.15 -0.91 1.24 -1.25 -0.65 0.00 0.00 175.02 173.59 1bwv s PRO 376 N 3.47 3.87 -0.12 4.11 0.04 -1.26 -2.26 135.00 142.86 1bwv s PRO 376 Ca 0.39 1.98 0.02 0.00 0.04 0.00 0.00 61.00 63.44 1bwv s PRO 376 Cb -0.12 -2.61 -0.00 0.00 0.04 0.00 0.00 34.50 31.80 1bwv s PRO 376 CO 0.17 -0.52 -0.19 0.08 0.04 0.00 0.00 177.00 176.59 1bwv s VAL 377 N -1.37 2.49 -0.25 -0.36 1.01 0.58 -1.25 120.40 121.25 1bwv s VAL 377 Ca 0.60 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1bwv s VAL 377 Cb -0.34 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1bwv s VAL 377 CO 0.43 0.54 -0.00 0.00 0.00 0.00 0.00 175.10 176.06 1bwv s ALA 378 N 0.43 2.88 -0.01 5.51 0.00 0.33 -0.87 121.76 130.04 1bwv s ALA 378 Ca -0.14 -1.33 -0.16 0.00 0.00 0.00 0.00 51.96 50.33 1bwv s ALA 378 Cb -0.17 -1.86 0.03 0.00 0.00 0.00 0.00 23.12 21.12 1bwv s ALA 378 CO 0.06 -0.68 0.34 0.45 0.00 0.00 0.00 175.76 175.93 1bwv s SER 379 N 1.45 -0.22 0.00 0.00 0.15 -1.26 -0.91 113.70 112.91 1bwv s SER 379 Ca 0.03 0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.77 1bwv s SER 379 Cb -0.16 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1bwv s SER 379 CO -0.01 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1bwv n GLY 380 N 1.12 1.86 2.41 9.45 0.00 -1.26 -4.59 105.19 114.18 1bwv n GLY 380 Ca -0.21 -0.96 -0.18 0.00 0.00 0.00 0.00 46.02 44.66 1bwv n GLY 380 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bwv n GLY 381 N 1.22 -0.00 3.82 -0.02 0.00 -1.26 -2.19 105.19 106.75 1bwv n GLY 381 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1bwv n GLY 381 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bwv s ILE 382 N -2.84 4.47 0.09 -0.61 -4.36 -1.26 -4.28 121.20 112.40 1bwv s ILE 382 Ca 0.00 -1.32 -0.14 0.00 -0.26 0.00 0.00 60.65 58.93 1bwv s ILE 382 Cb 0.00 -3.39 0.02 0.00 1.25 0.00 0.00 42.46 40.35 1bwv s ILE 382 CO 0.00 -0.30 0.33 -1.38 0.24 0.00 0.00 174.94 173.83 1bwv s HIS 383 N -2.04 -0.10 0.51 1.37 -3.43 -1.26 -4.23 115.29 106.11 1bwv s HIS 383 Ca 0.32 -0.19 -0.23 0.00 -0.80 0.00 0.00 55.06 54.16 1bwv s HIS 383 Cb -0.08 0.14 -0.07 0.00 -1.43 0.00 0.00 32.58 31.14 1bwv s HIS 383 CO 0.25 -0.61 1.26 0.00 -2.00 0.00 0.00 174.74 173.63 1bwv n ALA 384 N 0.03 1.23 0.00 -1.38 0.00 -1.26 -1.78 120.51 117.35 1bwv n ALA 384 Ca -0.16 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bwv n ALA 384 Cb 0.62 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.79 1bwv n ALA 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bwv n GLY 385 N 0.87 3.20 0.07 0.00 0.00 -1.26 -4.75 105.19 103.32 1bwv n GLY 385 Ca 0.09 -0.96 0.14 0.00 0.00 0.00 0.00 46.02 45.29 1bwv n GLY 385 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bwv n GLN 386 N 0.00 0.47 -0.28 1.61 6.02 -0.73 -4.47 117.38 120.00 1bwv n GLN 386 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 1bwv n GLN 386 Cb 0.00 -1.50 0.07 0.00 1.02 0.00 0.00 30.24 29.83 1bwv n GLN 386 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 1bwv h MET 387 N 0.36 -0.04 -0.90 -1.09 4.05 -1.86 0.65 114.93 116.10 1bwv h MET 387 Ca 0.00 0.00 0.10 0.00 -0.28 0.00 0.00 59.70 59.52 1bwv h MET 387 Cb 0.39 0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 31.13 1bwv h MET 387 CO 0.00 -0.02 0.58 1.12 0.23 0.00 0.00 176.91 178.82 1bwv h HIS 388 N -0.04 0.97 0.00 1.39 2.07 -1.89 -0.77 115.15 116.88 1bwv h HIS 388 Ca 0.35 0.03 -0.10 0.00 -2.85 0.00 0.00 60.37 57.79 1bwv h HIS 388 Cb 0.59 -0.31 -0.02 0.00 2.57 0.00 0.00 27.41 30.24 1bwv h HIS 388 CO -0.68 0.44 -0.87 -0.56 -3.07 0.00 0.00 177.93 173.19 1bwv h GLN 389 N 0.89 0.00 -0.05 5.12 3.07 -1.26 -2.32 115.11 120.56 1bwv h GLN 389 Ca 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 59.16 1bwv h GLN 389 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.98 1bwv h GLN 389 CO -0.18 0.30 0.03 -0.07 0.09 0.00 0.00 178.83 178.99 1bwv h LEU 390 N 0.00 0.07 -0.67 0.06 3.38 -0.41 0.79 115.31 118.53 1bwv h LEU 390 Ca -0.06 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1bwv h LEU 390 Cb 1.36 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.06 1bwv h LEU 390 CO 0.04 0.14 0.44 0.40 0.09 0.00 0.00 178.44 179.56 1bwv h ILE 391 N -0.01 1.17 -0.79 1.22 1.08 -1.22 -0.12 117.51 118.83 1bwv h ILE 391 Ca 0.02 -0.31 -0.05 0.00 -0.39 0.00 0.00 64.86 64.13 1bwv h ILE 391 Cb 0.09 0.19 -0.03 0.00 -3.07 0.00 0.00 36.82 33.99 1bwv h ILE 391 CO -0.00 0.16 0.30 -0.74 -0.69 0.00 0.00 178.15 177.19 1bwv h HIS 392 N 0.90 1.22 0.02 1.37 2.76 -1.06 -0.78 115.15 119.59 1bwv h HIS 392 Ca 0.24 -0.10 -0.31 0.00 -2.20 0.00 0.00 60.37 58.01 1bwv h HIS 392 Cb -0.10 -0.36 -0.05 0.00 1.55 0.00 0.00 27.41 28.45 1bwv h HIS 392 CO -0.03 0.93 -1.80 0.66 -1.30 0.00 0.00 177.93 176.40 1bwv n TYR 393 N -4.27 0.97 -0.02 5.26 4.01 0.24 -4.55 117.16 118.80 1bwv n TYR 393 Ca 0.07 0.32 0.06 0.00 -0.16 0.00 0.00 57.90 58.19 1bwv n TYR 393 Cb 0.20 -1.17 -0.14 0.00 -0.31 0.00 0.00 39.34 37.92 1bwv n TYR 393 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1bwv n LEU 394 N -3.09 0.00 0.00 7.72 4.77 -0.08 -4.87 117.00 121.46 1bwv n LEU 394 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1bwv n LEU 394 Cb 1.06 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 42.22 1bwv n LEU 394 CO 0.44 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1bwv n GLY 395 N 1.57 -1.59 0.14 -0.72 0.00 -0.30 -4.57 105.19 99.73 1bwv n GLY 395 Ca -0.08 -1.35 -0.23 0.00 0.00 0.00 0.00 46.02 44.37 1bwv n GLY 395 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1bwv h GLU 396 N 0.00 0.37 -4.47 1.61 4.81 -1.95 -3.42 114.58 111.53 1bwv h GLU 396 Ca 0.00 -0.64 -0.73 0.00 -0.13 0.00 0.00 59.36 57.86 1bwv h GLU 396 Cb 0.00 0.24 -0.22 0.00 0.63 0.00 0.00 28.75 29.40 1bwv h GLU 396 CO 0.00 1.31 0.43 -0.51 -0.73 0.00 0.00 179.01 179.51 1bwv s ASP 397 N -7.26 6.64 -0.06 1.04 1.01 -1.26 -2.85 116.67 113.93 1bwv s ASP 397 Ca -0.17 -2.26 -0.30 0.00 0.71 0.00 0.00 52.55 50.54 1bwv s ASP 397 Cb 0.05 -2.31 0.09 0.00 1.01 0.00 0.00 42.92 41.77 1bwv s ASP 397 CO 0.84 -0.86 0.79 0.54 0.21 0.00 0.00 175.17 176.70 1bwv s VAL 398 N 1.59 0.00 -0.28 -1.27 0.11 -1.26 -4.38 120.40 114.91 1bwv s VAL 398 Ca 0.24 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.20 1bwv s VAL 398 Cb -0.09 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.73 1bwv s VAL 398 CO -0.07 0.00 0.11 -0.69 -3.33 0.00 0.00 175.10 171.12 1bwv s VAL 399 N -1.56 4.51 -0.30 2.04 1.01 -0.38 -1.70 120.40 124.01 1bwv s VAL 399 Ca -0.06 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 1bwv s VAL 399 Cb -0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 1bwv s VAL 399 CO 0.04 0.22 0.54 -0.76 0.00 0.00 0.00 175.10 175.13 1bwv s LEU 400 N 1.63 4.17 -0.21 3.92 1.02 0.48 -0.51 118.68 129.18 1bwv s LEU 400 Ca 0.06 0.29 -0.04 0.00 0.02 0.00 0.00 54.13 54.45 1bwv s LEU 400 Cb -0.16 -2.66 -0.02 0.00 0.02 0.00 0.00 46.19 43.37 1bwv s LEU 400 CO 0.05 -0.40 -0.02 -1.10 0.02 0.00 0.00 176.35 174.90 1bwv s GLN 401 N 2.41 3.49 -0.53 1.70 -0.21 -0.09 -0.61 119.66 125.81 1bwv s GLN 401 Ca 0.21 -0.58 0.00 0.00 0.02 0.00 0.00 55.36 55.01 1bwv s GLN 401 Cb -0.15 -3.03 0.14 0.00 1.00 0.00 0.00 33.01 30.96 1bwv s GLN 401 CO 0.11 -0.09 0.30 -0.06 -2.12 0.00 0.00 175.29 173.43 1bwv s PHE 402 N 1.23 3.41 0.00 0.91 0.40 -0.06 -4.08 117.98 119.79 1bwv s PHE 402 Ca 0.03 -2.85 0.00 0.00 -0.60 0.00 0.00 56.93 53.51 1bwv s PHE 402 Cb -0.14 -3.05 0.00 0.00 0.51 0.00 0.00 43.02 40.33 1bwv s PHE 402 CO -0.00 -0.84 0.15 0.41 0.70 0.00 0.00 175.22 175.63 1bwv n GLY 403 N 3.62 -0.13 0.36 4.36 0.00 -1.26 -3.26 105.19 108.89 1bwv n GLY 403 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 1bwv n GLY 403 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bwv h GLY 404 N 0.00 1.21 2.00 -0.02 0.00 -1.91 -0.18 103.07 104.17 1bwv h GLY 404 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1bwv h GLY 404 CO 0.00 0.47 0.00 0.61 0.00 0.00 0.00 176.54 177.62 1bwv n GLY 405 N -1.33 -0.68 0.60 4.60 0.00 -1.26 -0.62 105.19 106.50 1bwv n GLY 405 Ca 0.09 0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 1bwv n GLY 405 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bwv n THR 406 N -1.73 0.97 0.24 2.61 -1.04 -0.28 -4.77 114.28 110.28 1bwv n THR 406 Ca 0.00 0.27 0.09 0.00 -2.04 0.00 0.00 64.05 62.37 1bwv n THR 406 Cb 0.04 -1.73 0.60 0.00 -1.82 0.00 0.00 70.33 67.42 1bwv n THR 406 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1bwv h ILE 407 N -0.32 0.87 0.00 12.58 2.04 -1.11 -2.10 117.51 129.48 1bwv h ILE 407 Ca 0.00 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1bwv h ILE 407 Cb 0.32 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.76 1bwv h ILE 407 CO 0.00 0.16 0.00 0.61 0.00 0.00 0.00 178.15 178.92 1bwv n GLY 408 N -0.83 -0.96 3.72 5.37 0.00 0.21 -4.76 105.19 107.93 1bwv n GLY 408 Ca -0.02 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1bwv n GLY 408 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1bwv s HIS 409 N -2.30 3.14 0.34 1.61 5.04 -0.79 -4.94 115.29 117.40 1bwv s HIS 409 Ca 0.31 0.77 0.03 0.00 -1.54 0.00 0.00 55.06 54.63 1bwv s HIS 409 Cb 0.17 -3.83 0.62 0.00 0.04 0.00 0.00 32.58 29.58 1bwv s HIS 409 CO 0.34 -2.98 1.95 -1.00 -2.34 0.00 0.00 174.74 170.70 1bwv h PRO 410 N 6.75 0.70 -0.34 2.88 0.13 -1.91 -2.47 132.00 137.75 1bwv h PRO 410 Ca -0.42 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1bwv h PRO 410 Cb 1.21 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1bwv h PRO 410 CO 0.89 0.56 0.00 -0.25 -0.23 0.00 0.00 178.00 178.97 1bwv n ASP 411 N -4.37 1.04 0.00 1.44 8.00 -1.26 -5.01 116.55 116.39 1bwv n ASP 411 Ca 0.04 -2.04 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1bwv n ASP 411 Cb 0.13 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1bwv n ASP 411 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bwv n GLY 412 N 0.57 2.21 0.21 0.44 0.00 -0.93 -4.59 105.19 103.10 1bwv n GLY 412 Ca 0.05 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.95 1bwv n GLY 412 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bwv h ILE 413 N 0.00 1.29 -0.47 -0.61 2.04 -1.83 -1.98 117.51 115.95 1bwv h ILE 413 Ca 0.00 -1.22 0.04 0.00 1.00 0.00 0.00 64.86 64.68 1bwv h ILE 413 Cb 0.00 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1bwv h ILE 413 CO 0.00 0.40 0.24 1.56 0.00 0.00 0.00 178.15 180.35 1bwv h GLN 414 N 0.43 0.46 -0.68 2.37 4.20 -1.89 -1.18 115.11 118.82 1bwv h GLN 414 Ca 0.08 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1bwv h GLN 414 Cb 0.65 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.29 1bwv h GLN 414 CO 0.04 0.31 0.45 0.00 -0.67 0.00 0.00 178.83 178.96 1bwv h ALA 415 N 1.25 1.51 -0.35 3.87 0.00 -1.78 -0.76 119.26 123.00 1bwv h ALA 415 Ca 0.20 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1bwv h ALA 415 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1bwv h ALA 415 CO -0.14 0.45 0.08 0.78 0.00 0.00 0.00 179.25 180.42 1bwv h GLY 416 N 0.93 0.61 0.91 0.00 0.00 -0.52 -2.06 103.07 102.93 1bwv h GLY 416 Ca 0.25 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1bwv h GLY 416 CO -0.05 0.36 0.09 0.00 0.00 0.00 0.00 176.54 176.94 1bwv h ALA 417 N 0.92 0.27 -0.45 3.60 0.00 -0.71 -2.44 119.26 120.45 1bwv h ALA 417 Ca 0.11 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1bwv h ALA 417 Cb 0.32 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1bwv h ALA 417 CO 0.00 -0.15 0.23 1.15 0.00 0.00 0.00 179.25 180.48 1bwv h THR 418 N 0.20 0.98 -0.55 0.00 2.02 -0.62 -1.12 112.91 113.81 1bwv h THR 418 Ca 0.07 -0.16 0.09 0.00 0.77 0.00 0.00 66.41 67.18 1bwv h THR 418 Cb 0.15 0.48 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 1bwv h THR 418 CO -0.01 0.08 0.17 0.00 0.37 0.00 0.00 175.52 176.14 1bwv h ALA 419 N 1.23 0.68 -0.36 6.16 0.00 -1.17 0.62 119.26 126.42 1bwv h ALA 419 Ca 0.19 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1bwv h ALA 419 Cb 0.09 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1bwv h ALA 419 CO -0.13 -0.24 -0.10 -0.91 0.00 0.00 0.00 179.25 177.87 1bwv h ASN 420 N 0.33 0.71 -0.33 0.00 2.35 -1.04 -1.60 115.58 116.00 1bwv h ASN 420 Ca 0.28 -0.37 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 1bwv h ASN 420 Cb 0.35 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1bwv h ASN 420 CO -0.31 0.91 0.07 -0.09 -1.65 0.00 0.00 177.43 176.36 1bwv h ARG 421 N 0.49 0.54 -0.41 0.81 9.65 -0.48 -1.21 114.38 123.77 1bwv h ARG 421 Ca 0.09 -0.14 -0.04 0.00 -1.10 0.00 0.00 59.98 58.79 1bwv h ARG 421 Cb 0.61 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.10 1bwv h ARG 421 CO 0.04 0.61 0.09 0.28 2.80 0.00 0.00 179.97 183.78 1bwv h VAL 422 N 0.38 1.24 -0.60 0.20 2.07 -0.91 -1.85 116.25 116.77 1bwv h VAL 422 Ca 0.10 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.84 1bwv h VAL 422 Cb 0.32 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1bwv h VAL 422 CO 0.00 0.29 0.33 0.00 0.02 0.00 0.00 177.57 178.21 1bwv h ALA 423 N 0.94 0.79 0.41 1.67 0.00 -1.13 -1.13 119.26 120.81 1bwv h ALA 423 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1bwv h ALA 423 Cb 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1bwv h ALA 423 CO 0.00 0.01 -0.20 1.25 0.00 0.00 0.00 179.25 180.32 1bwv h LEU 424 N 0.63 -0.46 -0.62 0.00 5.85 -0.94 -2.19 115.31 117.58 1bwv h LEU 424 Ca 0.26 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1bwv h LEU 424 Cb 0.13 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1bwv h LEU 424 CO -0.16 -0.29 0.34 -0.33 -0.34 0.00 0.00 178.44 177.66 1bwv h GLU 425 N -0.60 0.87 -0.95 1.25 5.08 -1.15 -1.17 114.58 117.90 1bwv h GLU 425 Ca -0.06 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1bwv h GLU 425 Cb 0.45 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 1bwv h GLU 425 CO 0.09 0.66 0.63 0.00 -1.00 0.00 0.00 179.01 179.40 1bwv h ALA 426 N 1.16 1.33 -0.14 3.43 0.00 -1.20 -0.63 119.26 123.20 1bwv h ALA 426 Ca 0.22 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1bwv h ALA 426 Cb 0.05 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1bwv h ALA 426 CO -0.03 0.62 -0.07 1.98 0.00 0.00 0.00 179.25 181.75 1bwv h MET 427 N 1.29 0.29 0.00 0.00 1.85 -0.71 -1.58 114.93 116.07 1bwv h MET 427 Ca 0.35 -0.13 -0.04 0.00 -0.61 0.00 0.00 59.70 59.28 1bwv h MET 427 Cb -0.14 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 31.88 1bwv h MET 427 CO -0.08 0.62 -0.18 -0.84 -0.40 0.00 0.00 176.91 176.03 1bwv h ILE 428 N -0.05 0.35 -0.14 1.77 -0.00 -1.06 -0.90 117.51 117.48 1bwv h ILE 428 Ca 0.03 -1.26 -0.01 0.00 -0.00 0.00 0.00 64.86 63.62 1bwv h ILE 428 Cb 0.54 1.97 -0.01 0.00 -0.00 0.00 0.00 36.82 39.32 1bwv h ILE 428 CO 0.02 0.18 0.06 0.25 -0.00 0.00 0.00 178.15 178.66 1bwv h LEU 429 N 0.00 0.18 -0.52 0.16 7.12 -1.00 -0.20 115.31 121.04 1bwv h LEU 429 Ca -0.00 -0.13 -0.01 0.00 0.13 0.00 0.00 57.88 57.88 1bwv h LEU 429 Cb 0.96 -0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 41.02 1bwv h LEU 429 CO 0.02 0.26 0.31 0.00 -0.13 0.00 0.00 178.44 178.90 1bwv h ALA 430 N 0.93 0.67 -0.19 1.25 0.00 -1.01 -0.95 119.26 119.97 1bwv h ALA 430 Ca 0.05 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1bwv h ALA 430 Cb 0.13 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1bwv h ALA 430 CO -0.01 0.17 -0.09 -0.09 0.00 0.00 0.00 179.25 179.23 1bwv h ARG 431 N 0.70 -0.06 0.00 0.00 2.43 -0.94 -1.95 114.38 114.57 1bwv h ARG 431 Ca 0.19 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1bwv h ARG 431 Cb 0.01 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1bwv h ARG 431 CO -0.03 -0.04 -0.10 -0.91 -1.51 0.00 0.00 179.97 177.38 1bwv h ASN 432 N -0.06 0.00 0.00 -3.80 4.21 -0.61 0.02 115.58 115.34 1bwv h ASN 432 Ca 0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.61 1bwv h ASN 432 Cb 0.22 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.42 1bwv h ASN 432 CO -0.23 0.10 0.00 -0.62 -1.29 0.00 0.00 177.43 175.39 1bwv n GLU 433 N -4.17 0.96 -2.56 0.81 1.02 -0.40 -4.89 120.64 111.41 1bwv n GLU 433 Ca -0.03 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.94 1bwv n GLU 433 Cb 0.18 -1.21 0.01 0.00 -0.02 0.00 0.00 31.44 30.40 1bwv n GLU 433 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1bwv n ASN 434 N -0.71 -5.06 -4.84 1.62 3.02 -0.01 -5.02 115.26 104.27 1bwv n ASN 434 Ca 0.10 -0.11 -0.34 0.00 -0.03 0.00 0.00 54.58 54.20 1bwv n ASN 434 Cb 0.04 -4.05 -0.06 0.00 -0.61 0.00 0.00 39.78 35.11 1bwv n ASN 434 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1bwv s ARG 435 N -5.11 4.03 -1.26 3.52 0.52 -1.04 -4.96 118.95 114.65 1bwv s ARG 435 Ca 0.11 0.63 -0.20 0.00 -0.52 0.00 0.00 55.73 55.75 1bwv s ARG 435 Cb -0.05 -2.65 0.01 0.00 0.52 0.00 0.00 34.95 32.78 1bwv s ARG 435 CO 0.13 0.29 1.83 -3.47 0.02 0.00 0.00 175.30 174.10 1bwv n ASP 436 N 0.11 4.21 0.30 0.23 2.03 -1.26 -4.61 116.55 117.57 1bwv n ASP 436 Ca 0.00 -2.84 0.17 0.00 0.52 0.00 0.00 54.79 52.65 1bwv n ASP 436 Cb 0.52 -1.73 0.95 0.00 -0.72 0.00 0.00 41.12 40.14 1bwv n ASP 436 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1bwv h TYR 437 N 8.24 0.00 0.22 -0.67 -0.00 -1.93 -0.51 116.97 122.33 1bwv h TYR 437 Ca 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.09 1bwv h TYR 437 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.61 1bwv h TYR 437 CO 1.35 0.03 -0.11 1.25 -0.00 0.00 0.00 178.16 180.69 1bwv h LEU 438 N 0.00 -0.25 -0.01 0.10 6.46 -1.86 0.11 115.31 119.86 1bwv h LEU 438 Ca -0.00 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.61 1bwv h LEU 438 Cb 0.13 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1bwv h LEU 438 CO 0.00 0.00 -0.03 0.74 -0.62 0.00 0.00 178.44 178.53 1bwv h THR 439 N -0.51 1.51 0.00 1.05 2.02 -1.92 -3.28 112.91 111.78 1bwv h THR 439 Ca -0.03 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1bwv h THR 439 Cb 0.38 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.33 1bwv h THR 439 CO 0.05 0.41 0.00 -0.62 0.37 0.00 0.00 175.52 175.73 1bwv n GLU 440 N -4.74 0.05 -0.40 6.66 1.02 -0.22 -4.40 120.64 118.62 1bwv n GLU 440 Ca -0.09 0.11 -0.08 0.00 -0.02 0.00 0.00 57.16 57.07 1bwv n GLU 440 Cb 0.34 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.20 1bwv n GLU 440 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1bwv h GLY 441 N 3.84 -0.60 0.06 0.62 0.00 -0.83 0.62 103.07 106.77 1bwv h GLY 441 Ca 0.00 0.72 0.21 0.00 0.00 0.00 0.00 47.33 48.26 1bwv h GLY 441 CO 0.00 -0.02 0.61 -2.55 0.00 0.00 0.00 176.54 174.58 1bwv h PRO 442 N -0.02 0.68 -0.08 4.80 0.11 -1.85 -1.24 132.00 134.41 1bwv h PRO 442 Ca 0.21 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 66.06 1bwv h PRO 442 Cb 0.47 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1bwv h PRO 442 CO -0.94 0.45 -0.81 0.93 -0.21 0.00 0.00 178.00 177.42 1bwv h GLU 443 N 0.70 0.53 -0.35 1.05 4.39 -1.25 -1.12 114.58 118.53 1bwv h GLU 443 Ca 0.59 -0.47 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 1bwv h GLU 443 Cb 1.01 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.75 1bwv h GLU 443 CO -0.40 1.10 0.21 0.82 -1.16 0.00 0.00 179.01 179.59 1bwv h ILE 444 N 0.35 1.12 -0.38 3.13 2.04 -0.25 0.28 117.51 123.79 1bwv h ILE 444 Ca -0.05 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 1bwv h ILE 444 Cb 1.42 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1bwv h ILE 444 CO 0.15 0.12 0.15 -0.07 0.00 0.00 0.00 178.15 178.50 1bwv h LEU 445 N 0.46 0.52 -1.04 1.44 3.38 -1.23 -1.28 115.31 117.55 1bwv h LEU 445 Ca 0.13 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1bwv h LEU 445 Cb 0.01 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1bwv h LEU 445 CO -0.02 0.55 0.61 -0.09 0.09 0.00 0.00 178.44 179.58 1bwv h ARG 446 N 0.47 1.26 -0.26 1.13 2.43 -0.92 0.74 114.38 119.24 1bwv h ARG 446 Ca 0.13 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1bwv h ARG 446 Cb 0.19 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1bwv h ARG 446 CO -0.01 0.85 -0.03 1.49 -1.51 0.00 0.00 179.97 180.76 1bwv h GLU 447 N 1.30 0.48 -0.27 0.20 4.57 -0.65 -2.73 114.58 117.47 1bwv h GLU 447 Ca 0.35 -0.17 -0.07 0.00 -1.18 0.00 0.00 59.36 58.29 1bwv h GLU 447 Cb -0.12 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.42 1bwv h GLU 447 CO -0.07 0.67 -0.13 0.00 -1.18 0.00 0.00 179.01 178.30 1bwv h ALA 448 N 0.79 1.28 0.00 2.92 0.00 -0.80 -2.72 119.26 120.72 1bwv h ALA 448 Ca 0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1bwv h ALA 448 Cb 0.48 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1bwv h ALA 448 CO 0.02 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.65 1bwv h ALA 449 N 1.44 1.76 -0.42 0.00 0.00 -0.63 -2.21 119.26 119.21 1bwv h ALA 449 Ca 0.08 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1bwv h ALA 449 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1bwv h ALA 449 CO 0.03 0.12 0.28 0.87 0.00 0.00 0.00 179.25 180.54 1bwv h LYS 450 N 0.00 0.46 0.00 0.00 1.57 -1.19 -2.26 116.57 115.15 1bwv h LYS 450 Ca -0.00 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1bwv h LYS 450 Cb 0.17 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1bwv h LYS 450 CO 0.01 0.31 -1.33 2.41 -0.57 0.00 0.00 179.45 180.27 1bwv n THR 451 N -4.48 0.69 -3.86 -0.16 -1.04 -0.88 -4.78 114.28 99.77 1bwv n THR 451 Ca 0.04 -0.59 -0.30 0.00 -2.04 0.00 0.00 64.05 61.16 1bwv n THR 451 Cb 0.13 -0.39 -0.14 0.00 -1.82 0.00 0.00 70.33 68.11 1bwv n THR 451 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bwv h GLY 453 N 7.42 1.66 0.92 0.00 0.00 -1.87 -0.76 103.07 110.44 1bwv h GLY 453 Ca -0.07 -0.32 0.03 0.00 0.00 0.00 0.00 47.33 46.97 1bwv h GLY 453 CO 0.52 -0.10 0.66 0.00 0.00 0.00 0.00 176.54 177.62 1bwv h ALA 454 N 1.66 1.33 -0.24 3.60 0.00 -1.90 -1.47 119.26 122.24 1bwv h ALA 454 Ca 0.58 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 55.24 1bwv h ALA 454 Cb 1.06 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1bwv h ALA 454 CO -0.37 0.58 -0.63 1.25 0.00 0.00 0.00 179.25 180.08 1bwv h LEU 455 N 1.29 0.97 -0.12 0.00 5.85 -1.45 -2.38 115.31 119.47 1bwv h LEU 455 Ca 0.39 -0.56 0.04 0.00 0.84 0.00 0.00 57.88 58.59 1bwv h LEU 455 Cb -0.04 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.68 1bwv h LEU 455 CO -0.11 1.36 -0.11 -0.09 -0.34 0.00 0.00 178.44 179.15 1bwv h ARG 456 N 0.63 -0.12 -0.76 1.25 2.43 -0.88 0.12 114.38 117.05 1bwv h ARG 456 Ca -0.01 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1bwv h ARG 456 Cb 1.25 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.79 1bwv h ARG 456 CO 0.14 -0.08 0.48 1.15 -1.51 0.00 0.00 179.97 180.15 1bwv h THR 457 N -0.12 1.20 -0.54 0.20 2.02 -1.30 -1.13 112.91 113.25 1bwv h THR 457 Ca 0.08 -0.41 -0.11 0.00 0.77 0.00 0.00 66.41 66.75 1bwv h THR 457 Cb 0.24 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 1bwv h THR 457 CO -0.20 0.20 -0.08 0.00 0.37 0.00 0.00 175.52 175.82 1bwv h ALA 458 N 1.49 0.73 -0.42 6.16 0.00 -0.76 -0.66 119.26 125.81 1bwv h ALA 458 Ca 0.28 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1bwv h ALA 458 Cb -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1bwv h ALA 458 CO -0.06 0.62 0.00 -0.07 0.00 0.00 0.00 179.25 179.75 1bwv h LEU 459 N 0.88 0.73 -0.10 0.00 3.38 -0.60 -2.43 115.31 117.17 1bwv h LEU 459 Ca 0.14 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1bwv h LEU 459 Cb 0.64 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1bwv h LEU 459 CO 0.04 0.86 0.04 0.44 0.09 0.00 0.00 178.44 179.91 1bwv h ASP 460 N 0.58 0.13 -0.02 -0.43 3.32 -1.07 -1.85 116.42 117.09 1bwv h ASP 460 Ca 0.12 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 57.02 1bwv h ASP 460 Cb 0.48 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 1bwv h ASP 460 CO 0.02 0.27 -0.18 0.25 -1.72 0.00 0.00 179.24 177.88 1bwv h LEU 461 N -0.01 -0.52 -3.28 1.55 6.46 -1.05 -3.09 115.31 115.37 1bwv h LEU 461 Ca 0.03 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1bwv h LEU 461 Cb 0.18 0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.33 1bwv h LEU 461 CO -0.00 -0.24 0.00 0.79 -0.62 0.00 0.00 178.44 178.37 1bwv n TRP 462 N -5.31 1.49 -0.31 1.25 8.01 -0.92 -4.73 117.44 116.91 1bwv n TRP 462 Ca -0.05 -0.69 0.03 0.00 -1.31 0.00 0.00 57.50 55.48 1bwv n TRP 462 Cb 0.23 -0.32 0.10 0.00 -2.01 0.00 0.00 31.31 29.31 1bwv n TRP 462 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.69 176.46 1bwv h LYS 463 N 3.46 -0.01 -0.56 -0.99 3.64 -1.24 -1.36 116.57 119.51 1bwv h LYS 463 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1bwv h LYS 463 Cb 1.56 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.38 1bwv h LYS 463 CO 0.29 -0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 177.22 1bwv n ASP 464 N -5.55 3.20 -4.62 4.20 8.00 -1.26 -4.89 116.55 115.62 1bwv n ASP 464 Ca 0.13 -1.98 -0.42 0.00 0.71 0.00 0.00 54.79 53.22 1bwv n ASP 464 Cb 0.43 -0.37 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 1bwv n ASP 464 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1bwv s ILE 465 N -1.25 4.78 0.06 0.53 -1.09 -0.52 -4.98 121.20 118.73 1bwv s ILE 465 Ca 0.40 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 1bwv s ILE 465 Cb 0.21 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1bwv s ILE 465 CO 0.28 -0.21 -0.05 0.28 -1.23 0.00 0.00 174.94 174.01 1bwv s THR 466 N 2.98 0.41 -0.53 2.92 -1.32 -1.26 -5.04 115.64 113.80 1bwv s THR 466 Ca 0.34 -1.70 0.07 0.00 -1.21 0.00 0.00 61.69 59.19 1bwv s THR 466 Cb -0.14 -1.37 0.28 0.00 -1.51 0.00 0.00 72.50 69.75 1bwv s THR 466 CO 0.11 -0.85 0.72 0.49 -2.21 0.00 0.00 174.62 172.88 1bwv n PHE 467 N 0.32 2.21 -2.57 9.09 3.72 -1.26 -5.05 117.46 123.92 1bwv n PHE 467 Ca -0.15 -3.92 -0.41 0.00 -0.05 0.00 0.00 57.45 52.91 1bwv n PHE 467 Cb 0.60 -0.47 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 1bwv n PHE 467 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1bwv s ASN 468 N -2.31 6.30 0.08 4.37 -0.87 -1.26 -4.92 114.94 116.32 1bwv s ASN 468 Ca 0.40 -0.87 0.02 0.00 -1.57 0.00 0.00 52.86 50.85 1bwv s ASN 468 Cb 0.20 -2.56 -0.03 0.00 -0.02 0.00 0.00 41.25 38.84 1bwv s ASN 468 CO -0.07 -1.69 -0.08 -0.31 -2.57 0.00 0.00 177.10 172.38 1bwv s TYR 469 N 5.37 0.83 0.03 2.20 2.02 -1.26 -5.13 117.35 121.42 1bwv s TYR 469 Ca 0.39 -0.71 -0.30 0.00 -0.37 0.00 0.00 57.07 56.07 1bwv s TYR 469 Cb -0.05 -0.48 -0.05 0.00 -0.40 0.00 0.00 41.96 40.97 1bwv s TYR 469 CO 0.05 -0.10 1.27 0.99 -1.57 0.00 0.00 175.55 176.19 1bwv s THR 470 N -2.57 3.90 0.30 -0.71 2.01 -1.26 -4.99 115.64 112.31 1bwv s THR 470 Ca 0.02 1.32 -0.29 0.00 0.31 0.00 0.00 61.69 63.05 1bwv s THR 470 Cb -0.02 -3.85 -0.10 0.00 0.01 0.00 0.00 72.50 68.54 1bwv s THR 470 CO -0.02 0.06 1.17 -0.44 -0.69 0.00 0.00 174.62 174.69 1bwv s SER 471 N 1.35 7.11 -0.14 3.53 0.01 -1.26 -4.97 113.70 119.33 1bwv s SER 471 Ca 0.60 2.41 -0.18 0.00 1.31 0.00 0.00 55.95 60.09 1bwv s SER 471 Cb -0.30 -2.63 -0.25 0.00 0.21 0.00 0.00 66.02 63.05 1bwv s SER 471 CO 0.27 -0.27 0.47 0.71 0.41 0.00 0.00 173.24 174.84 1bwv h THR 472 N 3.08 1.06 -2.67 1.44 1.35 -1.94 -3.43 112.91 111.79 1bwv h THR 472 Ca -0.47 -2.33 -0.67 0.00 -0.55 0.00 0.00 66.41 62.39 1bwv h THR 472 Cb 1.22 2.64 -0.17 0.00 -1.73 0.00 0.00 68.15 70.11 1bwv h THR 472 CO 0.66 0.60 0.51 -0.62 -0.25 0.00 0.00 175.52 176.42 1bwv s ASP 473 N -6.89 6.32 0.32 5.36 2.15 -1.24 -4.41 116.67 118.28 1bwv s ASP 473 Ca -0.22 -1.44 0.10 0.00 0.43 0.00 0.00 52.55 51.42 1bwv s ASP 473 Cb 0.04 -2.38 -0.06 0.00 -0.30 0.00 0.00 42.92 40.22 1bwv s ASP 473 CO 0.71 -1.23 -0.11 -0.89 -0.17 0.00 0.00 175.17 173.47 1bwv s THR 474 N 3.24 2.41 0.58 1.71 2.01 -1.26 -4.51 115.64 119.81 1bwv s THR 474 Ca 0.22 -2.23 -0.17 0.00 0.31 0.00 0.00 61.69 59.82 1bwv s THR 474 Cb -0.15 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 1bwv s THR 474 CO 0.03 -0.27 1.07 -0.55 -0.69 0.00 0.00 174.62 174.21 1bwv s SER 475 N -3.59 5.79 0.00 3.53 0.15 -1.26 -4.98 113.70 113.33 1bwv s SER 475 Ca 0.32 1.91 0.23 0.00 0.70 0.00 0.00 55.95 59.11 1bwv s SER 475 Cb -0.01 -2.55 0.21 0.00 -1.71 0.00 0.00 66.02 61.96 1bwv s SER 475 CO 0.16 -1.16 1.25 0.47 1.20 0.00 0.00 173.24 175.16 1bwv n ASP 476 N -1.79 2.99 -3.10 5.45 8.00 -1.26 -4.65 116.55 122.19 1bwv n ASP 476 Ca 0.09 -1.97 -0.23 0.00 0.71 0.00 0.00 54.79 53.39 1bwv n ASP 476 Cb 0.52 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.56 1bwv n ASP 476 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1bwv n PHE 477 N 1.32 2.12 -0.61 1.24 3.01 -1.26 -4.69 117.46 118.59 1bwv n PHE 477 Ca 0.14 -3.91 0.00 0.00 1.01 0.00 0.00 57.45 54.69 1bwv n PHE 477 Cb 0.58 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1bwv n PHE 477 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10