#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wv0 s ASN 2 N 0.00 2.04 -0.15 6.12 2.47 -1.26 -5.10 114.94 119.07 2wv0 s ASN 2 Ca 0.00 -0.26 -0.06 0.00 0.42 0.00 0.00 52.86 52.96 2wv0 s ASN 2 Cb 0.00 -0.77 -0.04 0.00 -1.45 0.00 0.00 41.25 39.00 2wv0 s ASN 2 CO 0.00 -0.13 0.04 -0.63 -3.72 0.00 0.00 177.10 172.66 2wv0 s ILE 3 N 1.70 4.61 -0.40 -5.21 1.09 -1.26 -4.98 121.20 116.76 2wv0 s ILE 3 Ca 0.04 -0.11 -0.03 0.00 -1.10 0.00 0.00 60.65 59.45 2wv0 s ILE 3 Cb -0.13 -3.04 0.10 0.00 -1.06 0.00 0.00 42.46 38.34 2wv0 s ILE 3 CO -0.07 0.51 0.18 0.20 -0.10 0.00 0.00 174.94 175.66 2wv0 s ASN 4 N -0.01 5.22 0.49 3.58 0.01 -1.26 -4.97 114.94 118.00 2wv0 s ASN 4 Ca 0.05 -1.93 0.27 0.00 -0.71 0.00 0.00 52.86 50.54 2wv0 s ASN 4 Cb -0.12 -1.82 1.19 0.00 0.41 0.00 0.00 41.25 40.91 2wv0 s ASN 4 CO 0.01 -0.51 1.94 0.11 -1.51 0.00 0.00 177.10 177.14 2wv0 h LYS 5 N 8.05 0.00 -0.00 -0.60 1.57 -1.98 -2.85 116.57 120.76 2wv0 h LYS 5 Ca -0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2wv0 h LYS 5 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2wv0 h LYS 5 CO 0.68 0.16 -0.42 1.04 -0.57 0.00 0.00 179.45 180.34 2wv0 n GLN 6 N -3.43 0.43 -2.33 3.15 1.13 -1.26 -4.91 117.38 110.15 2wv0 n GLN 6 Ca -0.01 -0.27 -0.39 0.00 -1.94 0.00 0.00 57.00 54.40 2wv0 n GLN 6 Cb 0.34 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.17 2wv0 n GLN 6 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2wv0 s SER 7 N -2.75 6.69 0.47 1.08 0.15 -1.08 -4.94 113.70 113.31 2wv0 s SER 7 Ca 0.17 2.34 0.22 0.00 0.70 0.00 0.00 55.95 59.38 2wv0 s SER 7 Cb 0.18 -2.62 1.24 0.00 -1.71 0.00 0.00 66.02 63.11 2wv0 s SER 7 CO 0.62 -0.56 1.88 -0.65 1.20 0.00 0.00 173.24 175.74 2wv0 h PRO 8 N 2.88 0.23 -6.35 5.44 0.11 -1.91 -3.42 132.00 129.00 2wv0 h PRO 8 Ca -0.48 -0.01 -0.54 0.00 0.11 0.00 0.00 66.00 65.07 2wv0 h PRO 8 Cb 1.23 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2wv0 h PRO 8 CO 0.63 0.15 0.93 0.42 -0.21 0.00 0.00 178.00 179.93 2wv0 s ILE 9 N -5.25 3.58 0.46 4.15 1.01 -1.26 -4.96 121.20 118.93 2wv0 s ILE 9 Ca -0.07 0.91 -0.24 0.00 0.00 0.00 0.00 60.65 61.25 2wv0 s ILE 9 Cb 0.22 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 39.02 2wv0 s ILE 9 CO 0.77 -0.03 1.22 -2.65 0.00 0.00 0.00 174.94 174.26 2wv0 n PRO 10 N 5.91 1.72 -0.25 2.79 -0.02 -1.26 -4.79 135.00 139.10 2wv0 n PRO 10 Ca 0.15 0.62 0.02 0.00 -2.02 0.00 0.00 63.50 62.27 2wv0 n PRO 10 Cb 0.43 -2.34 0.15 0.00 -0.02 0.00 0.00 33.50 31.71 2wv0 n PRO 10 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2wv0 h ILE 11 N 1.77 0.80 -0.75 4.25 2.04 -1.91 -1.72 117.51 121.99 2wv0 h ILE 11 Ca -0.48 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 2wv0 h ILE 11 Cb 1.31 0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 2wv0 h ILE 11 CO 0.58 0.10 0.41 0.10 0.00 0.00 0.00 178.15 179.35 2wv0 h TYR 12 N 0.57 1.02 -0.35 1.37 -0.00 -1.91 -1.80 116.97 115.87 2wv0 h TYR 12 Ca 0.37 -0.02 -0.14 0.00 0.00 0.00 0.00 58.73 58.93 2wv0 h TYR 12 Cb 0.43 -0.33 -0.01 0.00 0.00 0.00 0.00 36.73 36.83 2wv0 h TYR 12 CO -0.12 0.71 -0.35 -0.92 -0.00 0.00 0.00 178.16 177.48 2wv0 h TYR 13 N 1.05 1.02 -0.85 0.10 3.20 -1.71 -1.39 116.97 118.38 2wv0 h TYR 13 Ca 0.27 -0.31 0.14 0.00 3.14 0.00 0.00 58.73 61.97 2wv0 h TYR 13 Cb 0.02 -0.21 -0.09 0.00 1.54 0.00 0.00 36.73 37.99 2wv0 h TYR 13 CO 0.01 1.11 0.44 1.96 -1.64 0.00 0.00 178.16 180.03 2wv0 h GLN 14 N 0.64 0.62 0.01 1.82 4.20 -0.72 -1.88 115.11 119.79 2wv0 h GLN 14 Ca 0.05 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 2wv0 h GLN 14 Cb 0.94 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.58 2wv0 h GLN 14 CO 0.09 0.41 -0.00 0.82 -0.67 0.00 0.00 178.83 179.47 2wv0 h ILE 15 N 0.64 1.36 -0.41 2.54 2.04 -0.92 -2.74 117.51 120.02 2wv0 h ILE 15 Ca 0.46 -1.12 0.08 0.00 1.00 0.00 0.00 64.86 65.28 2wv0 h ILE 15 Cb 0.63 2.12 -0.08 0.00 -0.74 0.00 0.00 36.82 38.76 2wv0 h ILE 15 CO -0.35 0.29 -0.09 0.24 0.00 0.00 0.00 178.15 178.24 2wv0 h MET 16 N -0.49 0.01 -0.64 2.37 2.86 -1.18 -0.64 114.93 117.22 2wv0 h MET 16 Ca -0.00 -0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2wv0 h MET 16 Cb 0.48 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 2wv0 h MET 16 CO 0.00 0.01 0.31 0.93 1.06 0.00 0.00 176.91 179.21 2wv0 h GLU 17 N 0.01 0.91 0.18 1.72 4.39 -1.36 -0.46 114.58 119.96 2wv0 h GLU 17 Ca 0.20 -0.12 -0.30 0.00 0.34 0.00 0.00 59.36 59.47 2wv0 h GLU 17 Cb 0.30 -0.17 0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2wv0 h GLU 17 CO -0.41 0.70 -1.33 1.96 -1.16 0.00 0.00 179.01 178.77 2wv0 h GLN 18 N 0.90 0.46 -0.55 2.33 4.20 -1.11 -2.48 115.11 118.85 2wv0 h GLN 18 Ca 0.22 -0.73 -0.01 0.00 0.06 0.00 0.00 58.65 58.19 2wv0 h GLN 18 Cb 0.10 0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 2wv0 h GLN 18 CO -0.03 1.34 0.30 -0.07 -0.67 0.00 0.00 178.83 179.71 2wv0 h LEU 19 N 0.15 0.69 -0.98 1.46 3.38 -0.98 -0.22 115.31 118.81 2wv0 h LEU 19 Ca -0.20 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 57.80 2wv0 h LEU 19 Cb 2.03 -0.18 -0.09 0.00 0.09 0.00 0.00 40.66 42.52 2wv0 h LEU 19 CO 0.24 0.59 0.61 0.11 0.09 0.00 0.00 178.44 180.08 2wv0 h LYS 20 N 0.75 0.93 -0.35 1.13 1.57 -1.06 -0.39 116.57 119.15 2wv0 h LYS 20 Ca 0.20 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.83 2wv0 h LYS 20 Cb 0.05 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 2wv0 h LYS 20 CO -0.03 0.62 -0.12 1.15 -0.57 0.00 0.00 179.45 180.49 2wv0 h THR 21 N 0.96 1.28 -0.24 -0.16 2.02 -1.03 -2.81 112.91 112.93 2wv0 h THR 21 Ca 0.49 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 2wv0 h THR 21 Cb 0.50 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 2wv0 h THR 21 CO -0.27 0.40 0.05 1.56 0.37 0.00 0.00 175.52 177.63 2wv0 h GLN 22 N 0.48 0.34 -0.40 6.66 4.20 -0.36 0.62 115.11 126.64 2wv0 h GLN 22 Ca 0.08 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.62 2wv0 h GLN 22 Cb 0.65 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 2wv0 h GLN 22 CO 0.04 0.32 -0.24 0.82 -0.67 0.00 0.00 178.83 179.11 2wv0 h ILE 23 N 0.34 1.28 0.00 2.54 2.04 -1.01 0.24 117.51 122.94 2wv0 h ILE 23 Ca 0.08 -1.39 -0.17 0.00 1.00 0.00 0.00 64.86 64.38 2wv0 h ILE 23 Cb 0.14 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2wv0 h ILE 23 CO -0.00 0.47 -0.83 0.11 0.00 0.00 0.00 178.15 177.90 2wv0 h LYS 24 N 0.69 0.00 -0.97 2.37 1.57 -1.17 -2.97 116.57 116.09 2wv0 h LYS 24 Ca 0.08 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2wv0 h LYS 24 Cb 0.81 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.06 2wv0 h LYS 24 CO 0.07 0.83 0.64 -0.91 -0.57 0.00 0.00 179.45 179.50 2wv0 h ASN 25 N 0.00 1.09 0.00 0.86 2.35 0.27 -3.47 115.58 116.68 2wv0 h ASN 25 Ca -0.01 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2wv0 h ASN 25 Cb 1.52 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.63 2wv0 h ASN 25 CO 0.11 0.77 0.00 0.61 -1.65 0.00 0.00 177.43 177.26 2wv0 n GLY 26 N -1.37 0.74 0.10 2.83 0.00 -0.35 -4.95 105.19 102.21 2wv0 n GLY 26 Ca 0.12 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.56 2wv0 n GLY 26 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wv0 h GLU 27 N 0.00 0.00 -4.76 1.61 5.08 -1.29 -3.39 114.58 111.83 2wv0 h GLU 27 Ca 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 2wv0 h GLU 27 Cb 0.09 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.03 2wv0 h GLU 27 CO 0.00 0.65 -0.67 -0.51 -1.00 0.00 0.00 179.01 177.47 2wv0 s LEU 28 N -6.46 3.92 0.28 1.33 1.43 -0.83 -5.01 118.68 113.35 2wv0 s LEU 28 Ca 0.02 -1.13 -0.10 0.00 -1.03 0.00 0.00 54.13 51.88 2wv0 s LEU 28 Cb 0.09 -1.76 -0.07 0.00 0.03 0.00 0.00 46.19 44.47 2wv0 s LEU 28 CO 0.78 -0.26 0.61 -1.58 0.23 0.00 0.00 176.35 176.14 2wv0 s GLN 29 N 1.33 3.81 0.58 1.70 2.00 -1.26 -4.42 119.66 123.39 2wv0 s GLN 29 Ca -0.03 0.33 -0.20 0.00 -2.00 0.00 0.00 55.36 53.46 2wv0 s GLN 29 Cb -0.19 -2.57 -0.05 0.00 0.80 0.00 0.00 33.01 31.00 2wv0 s GLN 29 CO -0.00 0.22 1.13 -2.30 -0.50 0.00 0.00 175.29 173.84 2wv0 n PRO 30 N -0.46 1.19 -1.36 1.67 -0.02 -1.26 -2.67 135.00 132.09 2wv0 n PRO 30 Ca 0.01 0.45 -0.12 0.00 -2.02 0.00 0.00 63.50 61.82 2wv0 n PRO 30 Cb 0.53 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 2wv0 n PRO 30 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2wv0 n ASP 31 N -0.88 -5.68 -4.51 2.55 8.00 -0.74 -4.94 116.55 110.34 2wv0 n ASP 31 Ca 0.13 0.31 -0.34 0.00 0.71 0.00 0.00 54.79 55.60 2wv0 n ASP 31 Cb 0.46 -4.27 -0.12 0.00 -0.02 0.00 0.00 41.12 37.16 2wv0 n ASP 31 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2wv0 s MET 32 N -3.04 3.18 0.50 -1.24 -1.94 -1.09 -4.89 119.30 110.78 2wv0 s MET 32 Ca 0.00 -0.57 -0.22 0.00 -1.71 0.00 0.00 55.69 53.19 2wv0 s MET 32 Cb 0.00 -2.70 -0.08 0.00 2.01 0.00 0.00 34.83 34.07 2wv0 s MET 32 CO 0.00 0.43 1.09 -0.35 -0.01 0.00 0.00 175.02 176.18 2wv0 n PRO 33 N 2.92 1.35 -3.65 2.03 -0.04 -1.26 -3.49 135.00 132.86 2wv0 n PRO 33 Ca -0.18 0.50 -0.29 0.00 -0.04 0.00 0.00 63.50 63.49 2wv0 n PRO 33 Cb 0.53 -2.23 -0.04 0.00 -0.04 0.00 0.00 33.50 31.73 2wv0 n PRO 33 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2wv0 s LEU 34 N -1.67 4.22 0.61 1.53 1.02 0.08 -4.96 118.68 119.51 2wv0 s LEU 34 Ca 0.68 0.49 -0.18 0.00 0.02 0.00 0.00 54.13 55.15 2wv0 s LEU 34 Cb -0.48 -3.25 -0.10 0.00 0.02 0.00 0.00 46.19 42.38 2wv0 s LEU 34 CO 0.53 -0.03 0.18 -2.65 0.02 0.00 0.00 176.35 174.40 2wv0 n PRO 35 N -0.44 0.23 -1.31 1.29 -0.02 -1.26 -4.68 135.00 128.82 2wv0 n PRO 35 Ca -0.04 0.10 -0.30 0.00 -2.02 0.00 0.00 63.50 61.24 2wv0 n PRO 35 Cb 0.53 -1.41 0.11 0.00 -0.02 0.00 0.00 33.50 32.71 2wv0 n PRO 35 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2wv0 s SER 36 N -1.16 3.98 0.21 2.55 1.04 -1.26 -4.85 113.70 114.21 2wv0 s SER 36 Ca 0.61 1.52 -0.09 0.00 0.48 0.00 0.00 55.95 58.47 2wv0 s SER 36 Cb -0.42 -2.22 0.24 0.00 0.10 0.00 0.00 66.02 63.71 2wv0 s SER 36 CO 0.62 -2.32 1.81 -0.08 0.98 0.00 0.00 173.24 174.25 2wv0 h GLU 37 N -1.33 0.69 -0.40 4.02 4.81 -1.96 -2.04 114.58 118.37 2wv0 h GLU 37 Ca -0.47 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 58.59 2wv0 h GLU 37 Cb 1.27 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 2wv0 h GLU 37 CO 0.55 0.46 -0.25 0.00 -0.73 0.00 0.00 179.01 179.04 2wv0 h ARG 38 N 0.71 0.82 0.01 1.92 3.08 -1.93 -1.17 114.38 117.83 2wv0 h ARG 38 Ca 0.30 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2wv0 h ARG 38 Cb 0.17 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 2wv0 h ARG 38 CO -0.18 0.98 -0.02 0.93 -1.07 0.00 0.00 179.97 180.62 2wv0 h GLU 39 N 0.70 -0.04 -0.34 0.04 5.08 -1.85 0.92 114.58 119.10 2wv0 h GLU 39 Ca 0.09 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 2wv0 h GLU 39 Cb 0.78 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 2wv0 h GLU 39 CO 0.06 -0.02 0.15 1.88 -1.00 0.00 0.00 179.01 180.08 2wv0 h TYR 40 N -0.04 0.27 -0.77 4.33 0.05 -1.36 0.16 116.97 119.61 2wv0 h TYR 40 Ca 0.00 0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.92 2wv0 h TYR 40 Cb 0.04 -0.07 -0.08 0.00 1.01 0.00 0.00 36.73 37.62 2wv0 h TYR 40 CO -0.09 0.14 0.38 0.00 -1.05 0.00 0.00 178.16 177.53 2wv0 h ALA 41 N 1.19 1.10 -0.09 3.88 0.00 -0.86 -2.37 119.26 122.11 2wv0 h ALA 41 Ca 0.15 0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.90 2wv0 h ALA 41 Cb 0.08 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2wv0 h ALA 41 CO -0.12 -0.08 -0.82 1.05 0.00 0.00 0.00 179.25 179.28 2wv0 h GLU 42 N 0.59 0.72 0.00 0.00 -0.00 -0.41 -1.23 114.58 114.25 2wv0 h GLU 42 Ca 0.40 -0.65 -0.02 0.00 -0.00 0.00 0.00 59.36 59.09 2wv0 h GLU 42 Cb 0.50 0.16 -0.00 0.00 -0.00 0.00 0.00 28.75 29.41 2wv0 h GLU 42 CO -0.32 1.25 -0.10 -0.56 -0.00 0.00 0.00 179.01 179.28 2wv0 h GLN 43 N 0.42 0.00 -0.00 1.06 3.07 -0.34 -3.06 115.11 116.26 2wv0 h GLN 43 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.66 2wv0 h GLN 43 Cb 1.47 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.03 2wv0 h GLN 43 CO 0.17 0.10 -0.20 1.19 0.09 0.00 0.00 178.83 180.17 2wv0 n PHE 44 N -3.62 0.00 -3.40 0.06 3.72 -0.92 -5.01 117.46 108.28 2wv0 n PHE 44 Ca -0.02 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.20 2wv0 n PHE 44 Cb 0.22 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.83 2wv0 n PHE 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wv0 n GLY 45 N 0.88 -0.75 3.38 1.37 0.00 -0.67 -5.04 105.19 104.35 2wv0 n GLY 45 Ca 0.03 0.34 -0.19 0.00 0.00 0.00 0.00 46.02 46.20 2wv0 n GLY 45 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wv0 s ILE 46 N -3.42 1.00 0.36 -0.61 -4.36 -0.55 -5.05 121.20 108.56 2wv0 s ILE 46 Ca 0.24 -2.01 -0.28 0.00 -0.26 0.00 0.00 60.65 58.33 2wv0 s ILE 46 Cb -0.04 -2.61 -0.11 0.00 1.25 0.00 0.00 42.46 40.95 2wv0 s ILE 46 CO 0.75 -0.11 1.53 -0.55 0.24 0.00 0.00 174.94 176.80 2wv0 s SER 47 N -3.39 6.32 0.42 4.36 0.15 -1.26 -4.64 113.70 115.66 2wv0 s SER 47 Ca 0.34 3.05 0.14 0.00 0.70 0.00 0.00 55.95 60.19 2wv0 s SER 47 Cb 0.07 -2.66 0.92 0.00 -1.71 0.00 0.00 66.02 62.64 2wv0 s SER 47 CO 0.13 -0.91 1.94 0.08 1.20 0.00 0.00 173.24 175.68 2wv0 h ARG 48 N 3.43 0.00 0.00 5.44 -0.00 -1.91 -2.52 114.38 118.82 2wv0 h ARG 48 Ca -0.50 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.42 2wv0 h ARG 48 Cb 1.24 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.20 2wv0 h ARG 48 CO 0.68 0.24 -0.28 0.52 -0.00 0.00 0.00 179.97 181.13 2wv0 h MET 49 N 0.00 0.00 -0.12 0.08 2.86 -1.95 -0.73 114.93 115.07 2wv0 h MET 49 Ca -0.00 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.42 2wv0 h MET 49 Cb 0.44 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.11 2wv0 h MET 49 CO 0.03 0.28 -0.79 1.15 1.06 0.00 0.00 176.91 178.65 2wv0 h THR 50 N 0.00 1.29 -0.58 2.22 2.02 -1.83 -1.44 112.91 114.58 2wv0 h THR 50 Ca -0.00 -2.00 -0.01 0.00 0.77 0.00 0.00 66.41 65.17 2wv0 h THR 50 Cb 0.59 2.08 -0.03 0.00 -1.74 0.00 0.00 68.15 69.05 2wv0 h THR 50 CO 0.04 0.63 0.32 0.58 0.37 0.00 0.00 175.52 177.46 2wv0 h VAL 51 N 0.46 1.18 -0.61 3.16 2.07 -1.34 -2.18 116.25 118.99 2wv0 h VAL 51 Ca -0.06 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.04 2wv0 h VAL 51 Cb 1.42 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 2wv0 h VAL 51 CO 0.16 0.20 0.36 -0.09 0.02 0.00 0.00 177.57 178.22 2wv0 h ARG 52 N 0.78 0.69 -0.52 1.57 2.43 -1.07 -0.74 114.38 117.51 2wv0 h ARG 52 Ca 0.20 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.36 2wv0 h ARG 52 Cb 0.03 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.39 2wv0 h ARG 52 CO -0.03 0.46 0.30 0.37 -1.51 0.00 0.00 179.97 179.55 2wv0 h GLN 53 N 0.71 0.57 0.18 0.20 4.15 -1.02 0.22 115.11 120.12 2wv0 h GLN 53 Ca 0.25 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.63 2wv0 h GLN 53 Cb 0.06 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2wv0 h GLN 53 CO -0.12 0.38 -0.09 0.00 -1.93 0.00 0.00 178.83 177.07 2wv0 h ALA 54 N 1.24 -0.25 -0.50 3.38 0.00 -0.73 -1.75 119.26 120.66 2wv0 h ALA 54 Ca 0.21 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2wv0 h ALA 54 Cb 0.06 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2wv0 h ALA 54 CO -0.11 -0.57 0.06 -0.07 0.00 0.00 0.00 179.25 178.56 2wv0 h LEU 55 N -0.39 0.81 -0.63 0.00 3.38 -1.01 -2.29 115.31 115.18 2wv0 h LEU 55 Ca -0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2wv0 h LEU 55 Cb 0.30 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2wv0 h LEU 55 CO 0.04 0.88 0.34 -1.28 0.09 0.00 0.00 178.44 178.51 2wv0 h SER 56 N 0.71 0.80 -0.89 -0.43 0.87 -0.61 -1.04 113.55 112.95 2wv0 h SER 56 Ca 0.15 -0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.65 2wv0 h SER 56 Cb 0.43 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 62.13 2wv0 h SER 56 CO 0.01 0.67 0.57 0.78 -0.53 0.00 0.00 176.83 178.33 2wv0 h ASN 57 N 0.86 0.94 0.06 6.23 2.35 -1.00 -0.91 115.58 124.12 2wv0 h ASN 57 Ca 0.22 -0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.82 2wv0 h ASN 57 Cb 0.06 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 2wv0 h ASN 57 CO -0.03 0.64 -0.52 -0.07 -1.65 0.00 0.00 177.43 175.79 2wv0 h LEU 58 N 1.09 0.55 0.23 1.61 3.38 -0.99 -1.77 115.31 119.43 2wv0 h LEU 58 Ca 0.36 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2wv0 h LEU 58 Cb 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2wv0 h LEU 58 CO -0.13 0.97 -0.12 0.58 0.09 0.00 0.00 178.44 179.83 2wv0 h VAL 59 N 0.39 0.76 0.00 1.22 2.07 -1.01 0.10 116.25 119.79 2wv0 h VAL 59 Ca 0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2wv0 h VAL 59 Cb 1.04 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 2wv0 h VAL 59 CO 0.10 0.00 -0.02 0.78 0.02 0.00 0.00 177.57 178.45 2wv0 h ASN 60 N -0.32 0.00 0.69 0.57 2.35 -0.97 0.16 115.58 118.06 2wv0 h ASN 60 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2wv0 h ASN 60 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2wv0 h ASN 60 CO 0.04 0.02 -0.15 -0.62 -1.65 0.00 0.00 177.43 175.07 2wv0 n GLU 61 N -3.90 0.20 -0.79 0.81 1.02 -0.68 -4.94 120.64 112.36 2wv0 n GLU 61 Ca -0.03 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 2wv0 n GLU 61 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 2wv0 n GLU 61 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wv0 n GLY 62 N 1.43 0.75 0.12 0.62 0.00 0.57 -4.92 105.19 103.76 2wv0 n GLY 62 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 2wv0 n GLY 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wv0 h LEU 63 N 0.00 0.00 -8.96 0.99 -0.00 -1.00 -3.44 115.31 102.89 2wv0 h LEU 63 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 57.88 57.42 2wv0 h LEU 63 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 40.52 2wv0 h LEU 63 CO 0.00 0.64 -0.71 -0.76 -0.00 0.00 0.00 178.44 177.61 2wv0 s LEU 64 N -6.71 2.51 0.18 1.67 1.43 -0.98 -2.35 118.68 114.42 2wv0 s LEU 64 Ca 0.02 -1.08 0.04 0.00 -1.03 0.00 0.00 54.13 52.08 2wv0 s LEU 64 Cb 0.09 -0.64 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 2wv0 s LEU 64 CO 0.76 -0.24 -0.07 -0.72 0.23 0.00 0.00 176.35 176.31 2wv0 s TYR 65 N -3.01 1.36 -0.04 0.29 -0.85 0.41 -4.18 117.35 111.33 2wv0 s TYR 65 Ca 0.25 -0.82 0.06 0.00 -0.52 0.00 0.00 57.07 56.04 2wv0 s TYR 65 Cb 0.01 -0.73 -0.01 0.00 0.38 0.00 0.00 41.96 41.61 2wv0 s TYR 65 CO 0.08 0.04 -0.22 0.50 -1.52 0.00 0.00 175.55 174.43 2wv0 s ARG 66 N -3.79 2.06 -0.25 -3.49 3.52 -1.26 0.16 118.95 115.89 2wv0 s ARG 66 Ca 0.21 -0.78 -0.05 0.00 -0.13 0.00 0.00 55.73 54.98 2wv0 s ARG 66 Cb 0.04 -1.83 0.00 0.00 -1.56 0.00 0.00 34.95 31.59 2wv0 s ARG 66 CO 0.03 0.38 0.01 -0.51 -0.81 0.00 0.00 175.30 174.40 2wv0 s LEU 67 N -0.23 3.33 -0.28 -0.88 1.43 -0.73 -5.03 118.68 116.28 2wv0 s LEU 67 Ca 0.01 -0.57 -0.40 0.00 -1.03 0.00 0.00 54.13 52.14 2wv0 s LEU 67 Cb -0.11 -1.79 -0.15 0.00 0.03 0.00 0.00 46.19 44.16 2wv0 s LEU 67 CO 0.02 -0.10 1.77 2.29 0.23 0.00 0.00 176.35 180.55 2wv0 n LYS 68 N 4.81 1.16 -1.13 1.70 -0.00 -1.26 -0.61 118.16 122.82 2wv0 n LYS 68 Ca -0.16 0.42 -0.05 0.00 -0.00 0.00 0.00 58.31 58.52 2wv0 n LYS 68 Cb 0.49 -2.12 -0.02 0.00 -0.00 0.00 0.00 35.03 33.38 2wv0 n LYS 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wv0 n GLY 69 N 4.30 0.73 0.00 2.58 0.00 -1.26 -4.85 105.19 106.69 2wv0 n GLY 69 Ca 0.27 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2wv0 n GLY 69 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wv0 n ARG 70 N -2.62 0.00 0.00 1.61 1.85 0.22 -5.16 116.66 112.56 2wv0 n ARG 70 Ca -0.05 -0.31 0.00 0.00 -1.00 0.00 0.00 57.85 56.49 2wv0 n ARG 70 Cb 0.18 -0.38 0.00 0.00 -1.05 0.00 0.00 32.46 31.22 2wv0 n ARG 70 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wv0 n GLY 71 N 0.00 -1.86 3.52 2.89 0.00 -1.14 -4.82 105.19 103.79 2wv0 n GLY 71 Ca 0.00 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 2wv0 n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wv0 s THR 72 N -0.06 3.24 0.11 2.61 2.01 -1.26 -1.77 115.64 120.52 2wv0 s THR 72 Ca 0.00 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.18 2wv0 s THR 72 Cb 0.00 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.12 2wv0 s THR 72 CO 0.00 0.45 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.94 2wv0 s PHE 73 N -0.89 1.03 0.11 4.92 0.08 0.12 -0.74 117.98 122.62 2wv0 s PHE 73 Ca 0.14 -0.80 -0.30 0.00 0.12 0.00 0.00 56.93 56.10 2wv0 s PHE 73 Cb -0.11 -0.56 -0.06 0.00 -0.57 0.00 0.00 43.02 41.72 2wv0 s PHE 73 CO 0.04 -0.04 1.02 0.08 -0.10 0.00 0.00 175.22 176.22 2wv0 s VAL 74 N -3.20 4.35 0.09 -0.44 1.01 -1.23 -0.44 120.40 120.53 2wv0 s VAL 74 Ca 0.11 1.91 -0.24 0.00 0.00 0.00 0.00 61.98 63.76 2wv0 s VAL 74 Cb 0.02 -4.22 -0.07 0.00 0.00 0.00 0.00 36.38 32.12 2wv0 s VAL 74 CO -0.02 0.27 0.72 -0.44 0.00 0.00 0.00 175.10 175.63 2wv0 s SER 75 N 0.18 7.23 0.23 3.32 0.01 -0.99 -1.80 113.70 121.88 2wv0 s SER 75 Ca 0.49 1.46 -0.30 0.00 1.31 0.00 0.00 55.95 58.91 2wv0 s SER 75 Cb -0.25 -2.45 -0.09 0.00 0.21 0.00 0.00 66.02 63.43 2wv0 s SER 75 CO 0.31 0.15 1.37 -1.59 0.41 0.00 0.00 173.24 173.89 2wv0 s LYS 76 N -0.68 4.33 1.03 12.44 0.00 -1.26 -4.87 119.74 130.72 2wv0 s LYS 76 Ca 0.35 2.18 -0.16 0.00 0.00 0.00 0.00 55.97 58.34 2wv0 s LYS 76 Cb -0.21 -3.15 0.21 0.00 0.00 0.00 0.00 37.83 34.68 2wv0 s LYS 76 CO 0.23 -0.33 1.19 -1.25 0.00 0.00 0.00 175.35 175.19 2wv0 s PRO 77 N -0.32 0.18 -0.25 1.78 0.04 -1.26 -5.04 135.00 130.12 2wv0 s PRO 77 Ca 0.58 -0.08 0.01 0.00 0.04 0.00 0.00 61.00 61.54 2wv0 s PRO 77 Cb -0.39 -1.76 0.04 0.00 0.04 0.00 0.00 34.50 32.43 2wv0 s PRO 77 CO 0.41 -2.78 -0.10 0.21 0.04 0.00 0.00 177.00 174.79 2wv0 s LYS 78 N -5.54 2.53 0.00 4.56 2.20 -1.26 -5.01 119.74 117.22 2wv0 s LYS 78 Ca 0.70 -1.17 0.00 0.00 -0.36 0.00 0.00 55.97 55.14 2wv0 s LYS 78 Cb -0.09 -2.91 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2wv0 s LYS 78 CO 0.54 -0.48 0.00 -1.33 -0.36 0.00 0.00 175.35 173.72 2wv0 n MET 79 N 4.55 5.95 0.01 4.03 2.81 -1.26 -4.73 117.12 128.48 2wv0 n MET 79 Ca -0.16 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.63 2wv0 n MET 79 Cb 0.45 -0.45 -0.04 0.00 -0.71 0.00 0.00 33.22 32.48 2wv0 n MET 79 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 2wv0 h GLU 80 N 0.00 -0.33 -0.41 0.03 4.81 -1.99 -0.97 114.58 115.72 2wv0 h GLU 80 Ca 0.00 0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 2wv0 h GLU 80 Cb 0.00 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2wv0 h GLU 80 CO 0.00 -0.22 -0.12 0.37 -0.73 0.00 0.00 179.01 178.31 2wv0 h GLN 81 N -0.34 0.74 -0.21 1.92 5.75 -1.93 0.43 115.11 121.47 2wv0 h GLN 81 Ca 0.09 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.30 2wv0 h GLN 81 Cb 0.48 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 2wv0 h GLN 81 CO -0.30 0.83 -0.06 0.00 -2.65 0.00 0.00 178.83 176.65 2wv0 h ALA 82 N 1.20 0.29 0.01 3.38 0.00 -1.73 -1.65 119.26 120.76 2wv0 h ALA 82 Ca 0.11 -0.26 -0.33 0.00 0.00 0.00 0.00 54.91 54.43 2wv0 h ALA 82 Cb 0.59 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2wv0 h ALA 82 CO 0.04 0.09 -2.01 1.28 0.00 0.00 0.00 179.25 178.64 2wv0 n LEU 83 N -4.60 0.67 -0.00 0.00 4.77 -0.41 -4.51 117.00 112.92 2wv0 n LEU 83 Ca -0.04 0.23 0.05 0.00 -0.03 0.00 0.00 56.01 56.21 2wv0 n LEU 83 Cb 0.29 0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.53 2wv0 n LEU 83 CO 0.38 0.47 -0.15 0.00 -1.33 0.00 0.00 177.39 176.76 2wv0 n GLN 84 N -2.95 3.02 0.00 3.23 1.13 0.12 -0.98 117.38 120.95 2wv0 n GLN 84 Ca -0.25 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 54.79 2wv0 n GLN 84 Cb 1.09 -1.02 0.00 0.00 0.11 0.00 0.00 30.24 30.42 2wv0 n GLN 84 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2wv0 n GLY 85 N 1.38 3.91 2.77 1.08 0.00 -0.64 -4.96 105.19 108.73 2wv0 n GLY 85 Ca 0.01 -1.15 -0.17 0.00 0.00 0.00 0.00 46.02 44.71 2wv0 n GLY 85 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wv0 s LEU 86 N 0.00 0.34 0.12 0.99 2.96 -1.09 -4.89 118.68 117.11 2wv0 s LEU 86 Ca 0.00 0.17 0.08 0.00 -0.22 0.00 0.00 54.13 54.16 2wv0 s LEU 86 Cb 0.00 0.06 -0.04 0.00 0.50 0.00 0.00 46.19 46.71 2wv0 s LEU 86 CO 0.00 -0.21 -0.11 0.42 -1.32 0.00 0.00 176.35 175.13 2wv0 s THR 87 N 1.86 3.29 0.91 3.68 -4.23 -1.26 -4.92 115.64 114.97 2wv0 s THR 87 Ca -0.00 -1.36 -0.12 0.00 -1.18 0.00 0.00 61.69 59.03 2wv0 s THR 87 Cb -0.12 -2.55 0.14 0.00 1.34 0.00 0.00 72.50 71.30 2wv0 s THR 87 CO -0.04 0.07 1.11 -0.94 -0.54 0.00 0.00 174.62 174.28 2wv0 s SER 88 N -2.32 3.43 0.26 3.99 1.04 -1.26 -4.84 113.70 114.00 2wv0 s SER 88 Ca 0.22 1.19 -0.02 0.00 0.48 0.00 0.00 55.95 57.81 2wv0 s SER 88 Cb -0.11 -1.85 0.46 0.00 0.10 0.00 0.00 66.02 64.63 2wv0 s SER 88 CO 0.14 -2.63 1.80 0.15 0.98 0.00 0.00 173.24 173.68 2wv0 h PHE 89 N -1.55 0.87 -0.07 5.02 3.04 -2.00 -0.47 116.94 121.79 2wv0 h PHE 89 Ca -0.51 0.03 0.01 0.00 3.98 0.00 0.00 57.97 61.48 2wv0 h PHE 89 Cb 1.31 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 39.55 2wv0 h PHE 89 CO 0.35 0.31 0.01 1.15 -2.02 0.00 0.00 178.31 178.11 2wv0 h THR 90 N 0.77 0.96 -0.42 4.41 2.02 -1.97 -1.06 112.91 117.62 2wv0 h THR 90 Ca 0.43 -0.01 -0.13 0.00 0.77 0.00 0.00 66.41 67.47 2wv0 h THR 90 Cb 0.47 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2wv0 h THR 90 CO -0.28 0.01 -0.27 -0.33 0.37 0.00 0.00 175.52 175.02 2wv0 h GLU 91 N 0.03 0.89 -0.10 6.66 5.08 -1.89 -2.89 114.58 122.36 2wv0 h GLU 91 Ca 0.03 -0.40 0.04 0.00 -1.00 0.00 0.00 59.36 58.04 2wv0 h GLU 91 Cb 0.03 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 2wv0 h GLU 91 CO -0.04 1.05 -0.21 0.22 -1.00 0.00 0.00 179.01 179.02 2wv0 h ASP 92 N 0.76 -0.65 -0.63 1.42 3.58 -0.82 0.06 116.42 120.14 2wv0 h ASP 92 Ca 0.09 0.11 0.01 0.00 0.42 0.00 0.00 57.03 57.65 2wv0 h ASP 92 Cb 0.82 0.29 -0.03 0.00 1.72 0.00 0.00 39.33 42.13 2wv0 h ASP 92 CO 0.07 -0.27 0.41 0.24 -2.88 0.00 0.00 179.24 176.82 2wv0 h MET 93 N -0.28 0.82 -0.59 0.28 2.86 -1.19 -2.55 114.93 114.27 2wv0 h MET 93 Ca 0.09 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2wv0 h MET 93 Cb 0.42 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 2wv0 h MET 93 CO -0.27 0.54 0.35 0.87 1.06 0.00 0.00 176.91 179.47 2wv0 h LYS 94 N 0.85 0.80 0.00 1.72 1.57 -1.27 0.78 116.57 121.02 2wv0 h LYS 94 Ca 0.23 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2wv0 h LYS 94 Cb -0.09 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.04 2wv0 h LYS 94 CO -0.05 0.57 -0.07 0.66 -0.57 0.00 0.00 179.45 179.99 2wv0 h SER 95 N 0.82 0.00 -0.23 0.86 4.64 -0.56 -2.21 113.55 116.86 2wv0 h SER 95 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2wv0 h SER 95 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 2wv0 h SER 95 CO -0.04 0.07 0.00 0.54 -0.87 0.00 0.00 176.83 176.53 2wv0 n ARG 96 N -3.74 2.21 -1.72 4.77 1.74 -0.66 -4.83 116.66 114.43 2wv0 n ARG 96 Ca -0.02 -1.81 -0.07 0.00 -0.77 0.00 0.00 57.85 55.18 2wv0 n ARG 96 Cb 0.17 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.12 2wv0 n ARG 96 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wv0 n GLY 97 N 1.35 0.44 3.64 -0.13 0.00 -0.83 -5.00 105.19 104.67 2wv0 n GLY 97 Ca 0.17 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 2wv0 n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wv0 s MET 98 N -3.55 2.33 -0.37 1.61 1.00 0.18 -4.99 119.30 115.50 2wv0 s MET 98 Ca 0.00 -1.04 -0.17 0.00 0.00 0.00 0.00 55.69 54.47 2wv0 s MET 98 Cb 0.00 -2.36 -0.00 0.00 0.00 0.00 0.00 34.83 32.47 2wv0 s MET 98 CO 0.00 0.48 0.45 0.99 0.00 0.00 0.00 175.02 176.95 2wv0 s THR 99 N -1.51 5.07 0.42 2.05 2.01 -1.26 -3.39 115.64 119.03 2wv0 s THR 99 Ca 0.25 0.09 -0.21 0.00 0.31 0.00 0.00 61.69 62.13 2wv0 s THR 99 Cb -0.10 -3.94 -0.11 0.00 0.01 0.00 0.00 72.50 68.36 2wv0 s THR 99 CO 0.17 -0.23 0.95 -2.16 -0.69 0.00 0.00 174.62 172.65 2wv0 s PRO 100 N 2.24 4.26 0.38 4.92 0.04 -1.26 -0.84 135.00 144.74 2wv0 s PRO 100 Ca 0.15 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 62.23 2wv0 s PRO 100 Cb -0.16 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.17 2wv0 s PRO 100 CO 0.13 0.00 0.66 0.20 0.04 0.00 0.00 177.00 178.04 2wv0 s GLY 101 N -2.13 0.93 -0.14 0.56 0.00 -0.58 -4.95 107.32 101.02 2wv0 s GLY 101 Ca 0.61 -1.13 -0.17 0.00 0.00 0.00 0.00 44.72 44.03 2wv0 s GLY 101 CO 0.14 -0.63 0.45 -0.56 0.00 0.00 0.00 173.10 172.50 2wv0 s SER 102 N -3.16 -0.44 -0.06 1.64 0.01 -1.26 -0.68 113.70 109.74 2wv0 s SER 102 Ca 0.22 0.77 0.02 0.00 1.31 0.00 0.00 55.95 58.28 2wv0 s SER 102 Cb -0.03 0.81 0.01 0.00 0.21 0.00 0.00 66.02 67.02 2wv0 s SER 102 CO 0.16 -0.23 -0.12 -0.60 0.41 0.00 0.00 173.24 172.86 2wv0 s ARG 103 N -0.09 1.57 0.11 12.44 3.52 -0.35 -4.63 118.95 131.52 2wv0 s ARG 103 Ca -0.03 -0.39 -0.30 0.00 -0.13 0.00 0.00 55.73 54.88 2wv0 s ARG 103 Cb -0.03 -1.33 -0.06 0.00 -1.56 0.00 0.00 34.95 31.97 2wv0 s ARG 103 CO 0.02 0.04 1.13 -1.17 -0.81 0.00 0.00 175.30 174.51 2wv0 s LEU 104 N 0.60 4.42 -0.24 -0.88 2.96 -1.26 -0.79 118.68 123.49 2wv0 s LEU 104 Ca -0.13 2.01 -0.03 0.00 -0.22 0.00 0.00 54.13 55.76 2wv0 s LEU 104 Cb -0.15 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.81 2wv0 s LEU 104 CO 0.03 -0.34 -0.25 -0.38 -1.32 0.00 0.00 176.35 174.09 2wv0 n ILE 105 N 3.24 1.38 -3.66 6.68 2.08 0.44 -4.89 119.36 124.62 2wv0 n ILE 105 Ca 0.06 -0.47 -0.14 0.00 0.56 0.00 0.00 62.75 62.76 2wv0 n ILE 105 Cb 0.47 -1.51 -0.08 0.00 -0.75 0.00 0.00 39.64 37.77 2wv0 n ILE 105 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2wv0 s ASP 106 N -6.65 -0.65 -0.07 4.38 2.15 -0.79 -5.01 116.67 110.03 2wv0 s ASP 106 Ca -0.33 1.24 0.02 0.00 0.43 0.00 0.00 52.55 53.91 2wv0 s ASP 106 Cb 0.10 1.25 0.01 0.00 -0.30 0.00 0.00 42.92 43.99 2wv0 s ASP 106 CO 0.52 -0.24 -0.13 -0.47 -0.17 0.00 0.00 175.17 174.68 2wv0 s TYR 107 N 0.26 1.52 0.00 -5.34 6.14 -1.26 -0.69 117.35 117.98 2wv0 s TYR 107 Ca -0.01 -0.57 0.01 0.00 0.64 0.00 0.00 57.07 57.14 2wv0 s TYR 107 Cb -0.04 -1.11 -0.01 0.00 0.42 0.00 0.00 41.96 41.23 2wv0 s TYR 107 CO 0.01 -0.29 -0.03 -0.65 0.64 0.00 0.00 175.55 175.24 2wv0 s GLN 108 N 0.67 0.21 -0.38 4.97 -0.21 -0.65 -5.02 119.66 119.24 2wv0 s GLN 108 Ca -0.14 -0.19 -0.11 0.00 0.02 0.00 0.00 55.36 54.93 2wv0 s GLN 108 Cb -0.16 -0.14 0.03 0.00 1.00 0.00 0.00 33.01 33.74 2wv0 s GLN 108 CO 0.04 0.03 0.22 -1.17 -2.12 0.00 0.00 175.29 172.29 2wv0 s LEU 109 N -0.34 4.81 0.28 2.90 2.96 -1.26 0.01 118.68 128.04 2wv0 s LEU 109 Ca -0.02 -1.04 0.08 0.00 -0.22 0.00 0.00 54.13 52.93 2wv0 s LEU 109 Cb -0.03 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 2wv0 s LEU 109 CO -0.00 -0.41 0.14 0.27 -1.32 0.00 0.00 176.35 175.03 2wv0 s ILE 110 N 1.55 3.75 0.25 6.68 -4.36 0.09 -4.90 121.20 124.25 2wv0 s ILE 110 Ca 0.02 -1.61 -0.27 0.00 -0.26 0.00 0.00 60.65 58.53 2wv0 s ILE 110 Cb -0.20 -3.12 -0.09 0.00 1.25 0.00 0.00 42.46 40.30 2wv0 s ILE 110 CO 0.07 -0.30 0.88 -1.81 0.24 0.00 0.00 174.94 174.02 2wv0 s ASP 111 N -3.81 7.44 0.44 4.36 1.01 -1.26 -0.95 116.67 123.90 2wv0 s ASP 111 Ca 0.34 1.80 -0.26 0.00 0.71 0.00 0.00 52.55 55.15 2wv0 s ASP 111 Cb -0.06 -2.56 -0.08 0.00 1.01 0.00 0.00 42.92 41.23 2wv0 s ASP 111 CO 0.23 0.09 1.41 -0.94 0.21 0.00 0.00 175.17 176.17 2wv0 s SER 112 N -1.35 5.97 0.29 0.27 1.04 0.13 -4.85 113.70 115.20 2wv0 s SER 112 Ca 0.43 2.88 0.08 0.00 0.48 0.00 0.00 55.95 59.82 2wv0 s SER 112 Cb -0.22 -2.65 -0.04 0.00 0.10 0.00 0.00 66.02 63.21 2wv0 s SER 112 CO 0.27 -1.10 0.14 0.42 0.98 0.00 0.00 173.24 173.94 2wv0 s THR 113 N -1.21 3.70 0.34 2.02 -4.23 -1.26 -4.75 115.64 110.25 2wv0 s THR 113 Ca 0.60 -1.62 0.05 0.00 -1.18 0.00 0.00 61.69 59.54 2wv0 s THR 113 Cb -0.43 -3.11 0.29 0.00 1.34 0.00 0.00 72.50 70.60 2wv0 s THR 113 CO 0.55 -0.30 1.93 1.05 -0.54 0.00 0.00 174.62 177.31 2wv0 h GLU 114 N 1.59 0.80 -0.11 3.99 9.09 -1.98 0.88 114.58 128.84 2wv0 h GLU 114 Ca -0.46 -0.05 -0.02 0.00 0.05 0.00 0.00 59.36 58.89 2wv0 h GLU 114 Cb 1.25 -0.18 -0.00 0.00 -1.65 0.00 0.00 28.75 28.16 2wv0 h GLU 114 CO 0.61 0.53 -0.02 1.49 0.05 0.00 0.00 179.01 181.67 2wv0 h GLU 115 N 0.82 0.20 -0.48 1.06 4.81 -1.99 -0.22 114.58 118.77 2wv0 h GLU 115 Ca 0.36 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.40 2wv0 h GLU 115 Cb 0.32 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2wv0 h GLU 115 CO -0.13 0.49 -0.15 -0.07 -0.73 0.00 0.00 179.01 178.42 2wv0 h LEU 116 N -0.11 0.97 -0.60 1.64 3.38 -1.93 -2.22 115.31 116.43 2wv0 h LEU 116 Ca 0.03 -0.37 0.09 0.00 0.09 0.00 0.00 57.88 57.71 2wv0 h LEU 116 Cb 0.41 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 2wv0 h LEU 116 CO 0.01 1.12 0.24 0.00 0.09 0.00 0.00 178.44 179.89 2wv0 h ALA 117 N 0.88 0.78 -0.47 1.53 0.00 -0.79 0.15 119.26 121.34 2wv0 h ALA 117 Ca 0.12 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2wv0 h ALA 117 Cb 0.71 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2wv0 h ALA 117 CO 0.05 -0.17 0.27 0.00 0.00 0.00 0.00 179.25 179.40 2wv0 h ALA 118 N 1.40 0.60 -0.22 0.00 0.00 -0.87 0.83 119.26 121.01 2wv0 h ALA 118 Ca 0.30 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2wv0 h ALA 118 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2wv0 h ALA 118 CO -0.29 0.12 -0.02 0.82 0.00 0.00 0.00 179.25 179.88 2wv0 h ILE 119 N 0.63 1.27 0.00 0.00 2.04 -0.96 -3.13 117.51 117.35 2wv0 h ILE 119 Ca 0.17 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2wv0 h ILE 119 Cb 0.03 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2wv0 h ILE 119 CO -0.03 0.29 -0.34 -0.07 0.00 0.00 0.00 178.15 178.00 2wv0 h LEU 120 N 0.15 0.00 2.29 1.44 3.38 -0.94 -3.47 115.31 118.16 2wv0 h LEU 120 Ca 0.06 -0.02 -0.38 0.00 0.09 0.00 0.00 57.88 57.64 2wv0 h LEU 120 Cb 0.44 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2wv0 h LEU 120 CO 0.02 0.01 -0.45 0.61 0.09 0.00 0.00 178.44 178.71 2wv0 n GLY 121 N 1.16 0.08 3.98 0.83 0.00 0.28 -4.21 105.19 107.32 2wv0 n GLY 121 Ca 0.03 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 2wv0 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv0 s GLY 123 N -4.84 2.33 -0.03 0.00 0.00 -1.26 -4.80 107.32 98.72 2wv0 s GLY 123 Ca 0.70 0.52 -0.01 0.00 0.00 0.00 0.00 44.72 45.94 2wv0 s GLY 123 CO 0.48 0.85 0.03 -1.58 0.00 0.00 0.00 173.10 172.88 2wv0 s HIS 124 N -2.19 0.13 0.60 1.90 2.46 -1.26 -3.63 115.29 113.30 2wv0 s HIS 124 Ca 0.66 0.13 -0.15 0.00 0.47 0.00 0.00 55.06 56.17 2wv0 s HIS 124 Cb -0.17 -0.39 -0.03 0.00 -0.13 0.00 0.00 32.58 31.85 2wv0 s HIS 124 CO 0.29 -0.15 1.05 -1.25 -2.47 0.00 0.00 174.74 172.21 2wv0 s PRO 125 N 1.52 3.30 0.31 2.88 0.04 -1.26 -5.16 135.00 136.63 2wv0 s PRO 125 Ca -0.03 1.16 -0.12 0.00 0.04 0.00 0.00 61.00 62.05 2wv0 s PRO 125 Cb -0.13 -2.03 0.05 0.00 0.04 0.00 0.00 34.50 32.43 2wv0 s PRO 125 CO -0.03 -0.82 0.63 -1.13 0.04 0.00 0.00 177.00 175.69 2wv0 n SER 126 N -2.16 -1.82 -4.58 6.66 3.41 -1.24 -4.99 113.62 108.90 2wv0 n SER 126 Ca 0.08 -2.25 -0.34 0.00 -0.26 0.00 0.00 58.87 56.10 2wv0 n SER 126 Cb 0.53 3.03 -0.11 0.00 -0.26 0.00 0.00 64.21 67.40 2wv0 n SER 126 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2wv0 s SER 127 N -2.65 4.94 -0.09 4.04 0.01 -1.26 -0.69 113.70 118.00 2wv0 s SER 127 Ca 0.13 -0.00 0.02 0.00 1.31 0.00 0.00 55.95 57.40 2wv0 s SER 127 Cb -0.04 -1.54 0.01 0.00 0.21 0.00 0.00 66.02 64.66 2wv0 s SER 127 CO 0.09 0.28 -0.14 -0.63 0.41 0.00 0.00 173.24 173.25 2wv0 s ILE 128 N -0.33 1.36 0.29 1.44 1.01 -0.12 -0.94 121.20 123.92 2wv0 s ILE 128 Ca 0.06 -0.59 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 2wv0 s ILE 128 Cb -0.12 -1.24 -0.10 0.00 0.01 0.00 0.00 42.46 41.01 2wv0 s ILE 128 CO 0.02 0.41 1.39 -1.00 0.00 0.00 0.00 174.94 175.76 2wv0 s HIS 129 N 0.77 2.99 -0.30 3.97 3.76 0.14 -0.73 115.29 125.89 2wv0 s HIS 129 Ca -0.12 1.20 0.02 0.00 -0.15 0.00 0.00 55.06 56.02 2wv0 s HIS 129 Cb -0.16 -3.78 0.09 0.00 1.11 0.00 0.00 32.58 29.84 2wv0 s HIS 129 CO 0.02 -2.36 0.02 0.21 -0.85 0.00 0.00 174.74 171.79 2wv0 s LYS 130 N -1.12 1.43 -0.29 1.40 2.20 0.10 -1.57 119.74 121.89 2wv0 s LYS 130 Ca 0.54 -1.45 -0.05 0.00 -0.36 0.00 0.00 55.97 54.65 2wv0 s LYS 130 Cb -0.41 -2.78 0.02 0.00 -1.51 0.00 0.00 37.83 33.15 2wv0 s LYS 130 CO 0.49 -0.83 0.04 0.42 -0.36 0.00 0.00 175.35 175.11 2wv0 s ILE 131 N 1.19 3.65 -0.28 5.43 1.01 0.16 -1.64 121.20 130.71 2wv0 s ILE 131 Ca 0.05 -0.83 -0.07 0.00 0.00 0.00 0.00 60.65 59.80 2wv0 s ILE 131 Cb -0.19 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.39 2wv0 s ILE 131 CO -0.11 0.08 0.07 -0.89 0.00 0.00 0.00 174.94 174.09 2wv0 s THR 132 N 1.44 3.98 0.09 2.92 2.01 0.13 -0.40 115.64 125.81 2wv0 s THR 132 Ca 0.01 -0.60 0.07 0.00 0.31 0.00 0.00 61.69 61.48 2wv0 s THR 132 Cb -0.17 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 2wv0 s THR 132 CO 0.01 0.14 -0.18 -0.13 -0.69 0.00 0.00 174.62 173.77 2wv0 s ARG 133 N 1.52 0.98 -0.17 4.92 0.52 -0.13 -0.42 118.95 126.16 2wv0 s ARG 133 Ca 0.03 -1.06 -0.24 0.00 -0.52 0.00 0.00 55.73 53.95 2wv0 s ARG 133 Cb -0.17 -1.11 -0.02 0.00 0.52 0.00 0.00 34.95 34.17 2wv0 s ARG 133 CO 0.02 0.25 0.75 0.08 0.02 0.00 0.00 175.30 176.43 2wv0 s VAL 134 N -1.21 4.94 -0.16 3.52 1.01 0.03 -0.56 120.40 127.97 2wv0 s VAL 134 Ca 0.02 1.47 -0.17 0.00 0.00 0.00 0.00 61.98 63.30 2wv0 s VAL 134 Cb -0.10 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2wv0 s VAL 134 CO 0.03 0.07 0.43 -0.13 0.00 0.00 0.00 175.10 175.50 2wv0 s ARG 135 N 1.96 4.26 0.12 2.72 1.81 0.26 -1.21 118.95 128.88 2wv0 s ARG 135 Ca 0.35 0.31 0.06 0.00 -1.72 0.00 0.00 55.73 54.73 2wv0 s ARG 135 Cb -0.16 -3.48 -0.04 0.00 -0.45 0.00 0.00 34.95 30.81 2wv0 s ARG 135 CO 0.12 0.07 -0.01 -0.51 -0.68 0.00 0.00 175.30 174.29 2wv0 s LEU 136 N 0.94 3.37 -0.09 2.53 2.01 0.14 -0.24 118.68 127.35 2wv0 s LEU 136 Ca 0.22 -0.28 0.01 0.00 0.01 0.00 0.00 54.13 54.09 2wv0 s LEU 136 Cb -0.15 -2.08 0.02 0.00 0.01 0.00 0.00 46.19 44.00 2wv0 s LEU 136 CO 0.08 0.14 -0.08 0.00 1.01 0.00 0.00 176.35 177.50 2wv0 s ALA 137 N -1.45 1.19 -1.46 4.21 0.00 -0.29 -1.52 121.76 122.43 2wv0 s ALA 137 Ca 0.26 -0.42 -0.09 0.00 0.00 0.00 0.00 51.96 51.71 2wv0 s ALA 137 Cb -0.11 -0.72 0.06 0.00 0.00 0.00 0.00 23.12 22.34 2wv0 s ALA 137 CO 0.18 -0.19 0.92 0.09 0.00 0.00 0.00 175.76 176.76 2wv0 n ASN 138 N 4.46 -3.86 -0.48 0.00 3.02 -0.02 -2.05 115.26 116.33 2wv0 n ASN 138 Ca -0.17 -0.77 -0.06 0.00 -0.03 0.00 0.00 54.58 53.54 2wv0 n ASN 138 Cb 0.51 -4.02 -0.03 0.00 -0.61 0.00 0.00 39.78 35.63 2wv0 n ASN 138 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2wv0 n ASP 139 N -2.91 -4.91 -4.18 6.41 8.00 -1.26 -4.98 116.55 112.71 2wv0 n ASP 139 Ca -0.06 0.16 -0.30 0.00 0.71 0.00 0.00 54.79 55.29 2wv0 n ASP 139 Cb 0.57 -2.97 -0.17 0.00 -0.02 0.00 0.00 41.12 38.54 2wv0 n ASP 139 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wv0 s ILE 140 N -1.85 1.85 0.20 0.53 1.01 -0.87 -5.07 121.20 117.00 2wv0 s ILE 140 Ca 0.00 -0.90 -0.32 0.00 0.00 0.00 0.00 60.65 59.43 2wv0 s ILE 140 Cb 0.00 -1.61 -0.14 0.00 0.01 0.00 0.00 42.46 40.72 2wv0 s ILE 140 CO 0.00 0.51 1.33 -2.65 0.00 0.00 0.00 174.94 174.13 2wv0 n PRO 141 N 3.54 1.69 -0.01 2.79 -0.02 -1.26 -1.14 135.00 140.59 2wv0 n PRO 141 Ca -0.20 0.60 -0.01 0.00 -2.02 0.00 0.00 63.50 61.88 2wv0 n PRO 141 Cb 0.53 -2.21 -0.01 0.00 -0.02 0.00 0.00 33.50 31.79 2wv0 n PRO 141 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2wv0 n MET 142 N 2.06 0.14 -3.74 -0.52 1.56 0.67 -4.80 117.12 112.48 2wv0 n MET 142 Ca 0.14 0.01 -0.11 0.00 -0.27 0.00 0.00 57.70 57.46 2wv0 n MET 142 Cb 0.28 -1.02 -0.07 0.00 2.15 0.00 0.00 33.22 34.56 2wv0 n MET 142 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2wv0 s ALA 143 N -2.02 -0.67 -0.22 -5.12 0.00 -0.97 -1.66 121.76 111.09 2wv0 s ALA 143 Ca -0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 51.96 51.81 2wv0 s ALA 143 Cb 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 2wv0 s ALA 143 CO 0.03 -0.47 0.00 0.42 0.00 0.00 0.00 175.76 175.74 2wv0 s ILE 144 N -2.95 3.82 -0.11 0.00 1.01 -0.57 -0.57 121.20 121.82 2wv0 s ILE 144 Ca -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.31 2wv0 s ILE 144 Cb 0.00 -2.75 0.00 0.00 0.01 0.00 0.00 42.46 39.73 2wv0 s ILE 144 CO -0.06 0.40 -0.22 -0.70 0.00 0.00 0.00 174.94 174.36 2wv0 s GLU 145 N 1.38 3.09 -0.22 2.79 2.12 0.28 -1.60 118.70 126.53 2wv0 s GLU 145 Ca 0.05 -0.85 -0.03 0.00 0.36 0.00 0.00 54.97 54.50 2wv0 s GLU 145 Cb -0.15 -2.38 -0.00 0.00 0.26 0.00 0.00 34.13 31.86 2wv0 s GLU 145 CO 0.00 0.14 -0.07 0.45 -0.54 0.00 0.00 175.26 175.24 2wv0 s SER 146 N 0.46 4.08 -0.08 -1.70 0.15 0.80 -0.95 113.70 116.46 2wv0 s SER 146 Ca -0.15 -0.48 0.03 0.00 0.70 0.00 0.00 55.95 56.05 2wv0 s SER 146 Cb -0.17 -1.69 0.01 0.00 -1.71 0.00 0.00 66.02 62.46 2wv0 s SER 146 CO 0.06 -0.03 -0.18 -0.55 1.20 0.00 0.00 173.24 173.75 2wv0 s SER 147 N 1.43 2.42 -0.18 5.45 0.15 0.46 -0.86 113.70 122.57 2wv0 s SER 147 Ca 0.05 -0.43 -0.04 0.00 0.70 0.00 0.00 55.95 56.24 2wv0 s SER 147 Cb -0.14 -1.11 -0.02 0.00 -1.71 0.00 0.00 66.02 63.04 2wv0 s SER 147 CO -0.05 0.09 -0.04 -1.00 1.20 0.00 0.00 173.24 173.43 2wv0 s HIS 148 N 0.55 2.98 -0.05 3.44 3.76 0.67 -0.66 115.29 125.97 2wv0 s HIS 148 Ca -0.16 -0.54 -0.01 0.00 -0.15 0.00 0.00 55.06 54.21 2wv0 s HIS 148 Cb -0.17 -2.01 0.03 0.00 1.11 0.00 0.00 32.58 31.54 2wv0 s HIS 148 CO 0.06 -0.24 0.01 0.42 -0.85 0.00 0.00 174.74 174.14 2wv0 s ILE 149 N 0.79 0.23 0.01 0.60 1.01 -0.61 -1.61 121.20 121.62 2wv0 s ILE 149 Ca -0.01 0.17 -0.37 0.00 0.00 0.00 0.00 60.65 60.44 2wv0 s ILE 149 Cb -0.15 -0.38 -0.16 0.00 0.01 0.00 0.00 42.46 41.79 2wv0 s ILE 149 CO 0.02 0.21 1.51 -2.65 0.00 0.00 0.00 174.94 174.03 2wv0 n PRO 150 N 4.86 1.41 -0.30 2.79 -0.02 -1.26 0.23 135.00 142.71 2wv0 n PRO 150 Ca -0.12 0.51 0.09 0.00 -2.02 0.00 0.00 63.50 61.96 2wv0 n PRO 150 Cb 0.50 -2.20 0.25 0.00 -0.02 0.00 0.00 33.50 32.03 2wv0 n PRO 150 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2wv0 h PHE 151 N 5.70 0.78 0.00 6.00 3.57 -1.39 -1.32 116.94 130.28 2wv0 h PHE 151 Ca -0.47 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.06 2wv0 h PHE 151 Cb 1.31 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 2wv0 h PHE 151 CO 0.66 0.14 -0.03 0.93 -2.23 0.00 0.00 178.31 177.78 2wv0 h GLU 152 N 0.59 0.00 -0.00 1.11 3.07 -1.89 0.26 114.58 117.72 2wv0 h GLU 152 Ca 0.50 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.36 2wv0 h GLU 152 Cb 0.76 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.67 2wv0 h GLU 152 CO -0.40 0.03 -0.25 1.28 -1.40 0.00 0.00 179.01 178.27 2wv0 n LEU 153 N -3.68 0.65 0.00 1.33 4.77 -0.50 -4.32 117.00 115.25 2wv0 n LEU 153 Ca -0.03 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2wv0 n LEU 153 Cb 0.12 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2wv0 n LEU 153 CO 0.27 0.13 -0.07 0.00 -1.33 0.00 0.00 177.39 176.39 2wv0 n ALA 154 N -1.02 0.30 -0.74 -1.18 0.00 -0.75 -4.72 120.51 112.40 2wv0 n ALA 154 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2wv0 n ALA 154 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 2wv0 n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wv0 n GLY 155 N 0.37 0.45 3.71 0.00 0.00 0.83 -4.70 105.19 105.84 2wv0 n GLY 155 Ca 0.00 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2wv0 n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wv0 s GLU 156 N 0.00 4.41 0.12 1.61 2.02 -1.26 -4.93 118.70 120.67 2wv0 s GLU 156 Ca 0.00 1.75 0.07 0.00 0.02 0.00 0.00 54.97 56.81 2wv0 s GLU 156 Cb 0.00 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 2wv0 s GLU 156 CO 0.00 -0.31 -0.05 -0.51 0.02 0.00 0.00 175.26 174.41 2wv0 s LEU 157 N 1.35 3.22 0.00 1.80 1.43 -1.26 -5.10 118.68 120.12 2wv0 s LEU 157 Ca 0.58 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 2wv0 s LEU 157 Cb -0.28 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 43.99 2wv0 s LEU 157 CO 0.28 0.16 0.44 -0.46 0.23 0.00 0.00 176.35 176.99 2wv0 n ASN 158 N 0.47 -1.25 -0.29 2.29 0.23 -1.26 -5.05 115.26 110.40 2wv0 n ASN 158 Ca -0.12 -2.40 0.25 0.00 -0.53 0.00 0.00 54.58 51.78 2wv0 n ASN 158 Cb 0.53 2.24 0.59 0.00 -2.08 0.00 0.00 39.78 41.05 2wv0 n ASN 158 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2wv0 h GLU 159 N 0.00 0.26 0.00 -3.83 4.57 -2.00 0.24 114.58 113.81 2wv0 h GLU 159 Ca -0.22 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 57.88 2wv0 h GLU 159 Cb 0.93 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.45 2wv0 h GLU 159 CO 0.30 0.17 -0.30 0.66 -1.18 0.00 0.00 179.01 178.66 2wv0 h SER 160 N 0.26 0.00 0.22 1.04 4.64 -1.98 -2.29 113.55 115.44 2wv0 h SER 160 Ca 0.54 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.55 2wv0 h SER 160 Cb 1.62 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.75 2wv0 h SER 160 CO -0.18 0.30 -1.37 0.45 -0.87 0.00 0.00 176.83 175.17 2wv0 h HIS 161 N 0.00 0.98 -0.03 4.77 3.86 -1.34 -3.33 115.15 120.05 2wv0 h HIS 161 Ca -0.00 -0.67 -0.07 0.00 -1.16 0.00 0.00 60.37 58.47 2wv0 h HIS 161 Cb 0.62 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 2wv0 h HIS 161 CO 0.00 1.51 -0.29 0.74 0.86 0.00 0.00 177.93 180.75 2wv0 h PHE 162 N 0.20 0.06 -0.16 2.45 0.04 -1.08 -2.69 116.94 115.77 2wv0 h PHE 162 Ca -0.22 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.54 2wv0 h PHE 162 Cb 2.05 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 40.18 2wv0 h PHE 162 CO 0.12 0.35 0.00 1.04 -0.60 0.00 0.00 178.31 179.22 2wv0 n GLN 163 N -4.17 1.81 0.00 1.51 1.13 -0.90 -4.71 117.38 112.05 2wv0 n GLN 163 Ca -0.02 -1.21 0.00 0.00 -1.94 0.00 0.00 57.00 53.83 2wv0 n GLN 163 Cb 0.35 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.28 2wv0 n GLN 163 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2wv0 n SER 164 N 0.44 0.72 -4.67 1.08 3.41 -1.02 -4.49 113.62 109.09 2wv0 n SER 164 Ca 0.17 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.35 2wv0 n SER 164 Cb 0.37 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 2wv0 n SER 164 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2wv0 s SER 165 N 1.00 7.15 0.16 4.04 0.15 -1.26 -4.94 113.70 120.00 2wv0 s SER 165 Ca 0.00 1.42 -0.07 0.00 0.70 0.00 0.00 55.95 58.00 2wv0 s SER 165 Cb 0.00 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.80 2wv0 s SER 165 CO 0.00 -0.54 1.48 0.40 1.20 0.00 0.00 173.24 175.78 2wv0 h ILE 166 N 5.27 1.29 -0.69 6.45 2.04 -1.94 -3.03 117.51 126.90 2wv0 h ILE 166 Ca -0.25 -1.68 0.11 0.00 1.00 0.00 0.00 64.86 64.04 2wv0 h ILE 166 Cb 1.11 1.59 -0.08 0.00 -0.74 0.00 0.00 36.82 38.70 2wv0 h ILE 166 CO 0.91 0.54 0.30 1.88 0.00 0.00 0.00 178.15 181.78 2wv0 h TYR 167 N 0.60 0.52 -0.51 1.37 0.99 -1.98 -0.24 116.97 117.72 2wv0 h TYR 167 Ca 0.03 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.77 2wv0 h TYR 167 Cb 1.05 -0.13 -0.02 0.00 1.00 0.00 0.00 36.73 38.63 2wv0 h TYR 167 CO 0.06 0.14 0.25 -0.44 -0.00 0.00 0.00 178.16 178.17 2wv0 h ASP 168 N 0.49 0.67 -0.15 3.88 3.32 -1.97 -2.36 116.42 120.31 2wv0 h ASP 168 Ca 0.35 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.31 2wv0 h ASP 168 Cb 0.44 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 2wv0 h ASP 168 CO -0.32 0.60 -0.07 -0.74 -1.72 0.00 0.00 179.24 176.99 2wv0 h HIS 169 N 0.68 -0.17 -0.24 4.55 2.76 -1.32 -2.46 115.15 118.95 2wv0 h HIS 169 Ca 0.18 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.41 2wv0 h HIS 169 Cb 0.11 0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.12 2wv0 h HIS 169 CO -0.01 -0.11 -0.09 0.82 -1.30 0.00 0.00 177.93 177.24 2wv0 h ILE 170 N -0.06 0.68 -0.73 6.26 1.08 -0.84 0.27 117.51 124.18 2wv0 h ILE 170 Ca 0.08 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.54 2wv0 h ILE 170 Cb 0.18 0.68 -0.04 0.00 -3.07 0.00 0.00 36.82 34.57 2wv0 h ILE 170 CO -0.18 0.00 0.41 -0.33 -0.69 0.00 0.00 178.15 177.36 2wv0 h GLU 171 N -0.05 1.00 0.08 2.37 5.08 -1.39 -2.15 114.58 119.52 2wv0 h GLU 171 Ca 0.13 -0.10 -0.28 0.00 -1.00 0.00 0.00 59.36 58.10 2wv0 h GLU 171 Cb 0.24 -0.20 0.03 0.00 0.50 0.00 0.00 28.75 29.31 2wv0 h GLU 171 CO -0.28 0.72 -1.16 0.00 -1.00 0.00 0.00 179.01 177.29 2wv0 h ARG 172 N 1.01 0.64 -0.53 2.33 3.08 -0.87 -0.29 114.38 119.76 2wv0 h ARG 172 Ca 0.26 -0.80 -0.07 0.00 0.07 0.00 0.00 59.98 59.44 2wv0 h ARG 172 Cb 0.00 0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2wv0 h ARG 172 CO -0.04 1.36 0.05 -0.92 -1.07 0.00 0.00 179.97 179.34 2wv0 h TYR 173 N 0.28 0.90 0.00 3.04 5.03 -0.43 -3.19 116.97 122.61 2wv0 h TYR 173 Ca -0.17 -0.12 0.00 0.00 2.58 0.00 0.00 58.73 61.02 2wv0 h TYR 173 Cb 1.83 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 39.86 2wv0 h TYR 173 CO 0.12 0.80 -1.31 0.09 -1.32 0.00 0.00 178.16 176.54 2wv0 n ASN 174 N -4.23 0.61 -4.03 -2.11 3.02 -0.82 -4.99 115.26 102.71 2wv0 n ASN 174 Ca 0.03 -0.53 -0.29 0.00 -0.03 0.00 0.00 54.58 53.76 2wv0 n ASN 174 Cb 0.28 1.27 -0.02 0.00 -0.61 0.00 0.00 39.78 40.70 2wv0 n ASN 174 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2wv0 n SER 175 N -1.82 -1.64 -3.83 6.41 7.64 -0.13 -4.99 113.62 115.25 2wv0 n SER 175 Ca 0.01 -0.99 -0.13 0.00 1.01 0.00 0.00 58.87 58.78 2wv0 n SER 175 Cb 0.42 -3.04 -0.14 0.00 -1.01 0.00 0.00 64.21 60.45 2wv0 n SER 175 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2wv0 s ILE 176 N -3.69 -0.01 0.66 0.44 1.01 -1.19 -5.07 121.20 113.35 2wv0 s ILE 176 Ca 0.29 0.04 -0.16 0.00 0.00 0.00 0.00 60.65 60.82 2wv0 s ILE 176 Cb -0.16 -0.09 -0.00 0.00 0.01 0.00 0.00 42.46 42.22 2wv0 s ILE 176 CO 0.90 0.02 1.18 -2.84 0.00 0.00 0.00 174.94 174.19 2wv0 s PRO 177 N 0.25 2.64 0.16 2.79 0.02 -1.26 -4.47 135.00 135.14 2wv0 s PRO 177 Ca -0.02 1.68 -0.30 0.00 0.02 0.00 0.00 61.00 62.38 2wv0 s PRO 177 Cb -0.03 -1.90 -0.07 0.00 0.02 0.00 0.00 34.50 32.52 2wv0 s PRO 177 CO -0.01 -1.43 1.02 0.42 -0.33 0.00 0.00 177.00 176.68 2wv0 s ILE 178 N -1.94 4.15 -0.03 2.83 1.01 -1.26 -0.81 121.20 125.15 2wv0 s ILE 178 Ca 0.73 1.87 0.01 0.00 0.00 0.00 0.00 60.65 63.26 2wv0 s ILE 178 Cb -0.27 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 37.98 2wv0 s ILE 178 CO 0.39 0.33 -0.02 -1.54 0.00 0.00 0.00 174.94 174.10 2wv0 n SER 179 N 2.40 3.89 -3.66 3.58 3.41 0.23 -4.77 113.62 118.71 2wv0 n SER 179 Ca 0.02 -0.01 -0.08 0.00 -0.26 0.00 0.00 58.87 58.54 2wv0 n SER 179 Cb 0.47 0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.52 2wv0 n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wv0 s ARG 180 N -2.07 1.34 -0.06 4.33 1.70 -1.20 -5.02 118.95 117.97 2wv0 s ARG 180 Ca -0.04 -0.65 -0.08 0.00 -0.47 0.00 0.00 55.73 54.49 2wv0 s ARG 180 Cb 0.01 0.52 0.02 0.00 -0.57 0.00 0.00 34.95 34.92 2wv0 s ARG 180 CO 0.09 -0.61 0.20 0.00 -1.08 0.00 0.00 175.30 173.91 2wv0 s ALA 181 N -3.59 -0.50 -0.08 7.88 0.00 -1.26 0.25 121.76 124.47 2wv0 s ALA 181 Ca 0.08 0.42 -0.16 0.00 0.00 0.00 0.00 51.96 52.30 2wv0 s ALA 181 Cb -0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 2wv0 s ALA 181 CO -0.02 -0.14 0.42 0.21 0.00 0.00 0.00 175.76 176.23 2wv0 s LYS 182 N -0.32 4.16 -0.01 0.00 2.20 -0.05 -4.96 119.74 120.76 2wv0 s LYS 182 Ca -0.04 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.97 2wv0 s LYS 182 Cb -0.03 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.94 2wv0 s LYS 182 CO 0.01 0.39 -0.08 -1.14 -0.36 0.00 0.00 175.35 174.16 2wv0 s GLN 183 N -0.09 0.70 -0.05 4.03 0.74 -1.26 -1.05 119.66 122.67 2wv0 s GLN 183 Ca 0.23 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.39 2wv0 s GLN 183 Cb -0.15 -0.67 -0.00 0.00 1.10 0.00 0.00 33.01 33.28 2wv0 s GLN 183 CO 0.10 0.18 -0.19 -1.21 -0.55 0.00 0.00 175.29 173.62 2wv0 s GLU 184 N -0.19 2.04 -0.10 1.67 2.02 0.12 -4.99 118.70 119.28 2wv0 s GLU 184 Ca 0.03 -0.68 0.03 0.00 0.02 0.00 0.00 54.97 54.37 2wv0 s GLU 184 Cb -0.03 -1.73 -0.01 0.00 0.10 0.00 0.00 34.13 32.45 2wv0 s GLU 184 CO -0.00 0.25 -0.19 -0.51 0.02 0.00 0.00 175.26 174.83 2wv0 s LEU 185 N 0.06 2.41 -0.01 1.80 1.02 -1.26 -1.25 118.68 121.44 2wv0 s LEU 185 Ca -0.06 -0.41 0.01 0.00 0.02 0.00 0.00 54.13 53.69 2wv0 s LEU 185 Cb -0.13 -1.50 0.01 0.00 0.02 0.00 0.00 46.19 44.59 2wv0 s LEU 185 CO 0.03 0.20 -0.04 -0.70 0.02 0.00 0.00 176.35 175.86 2wv0 s GLU 186 N 0.12 0.43 0.44 1.70 2.12 -0.16 -4.99 118.70 118.37 2wv0 s GLU 186 Ca -0.09 -0.11 -0.15 0.00 0.36 0.00 0.00 54.97 54.98 2wv0 s GLU 186 Cb -0.15 -0.46 -0.08 0.00 0.26 0.00 0.00 34.13 33.70 2wv0 s GLU 186 CO 0.06 0.03 0.88 -1.25 -0.54 0.00 0.00 175.26 174.43 2wv0 s PRO 187 N 0.26 3.93 0.33 4.30 0.04 -1.26 -0.46 135.00 142.13 2wv0 s PRO 187 Ca -0.03 0.77 -0.09 0.00 0.04 0.00 0.00 61.00 61.70 2wv0 s PRO 187 Cb -0.06 -2.27 0.03 0.00 0.04 0.00 0.00 34.50 32.25 2wv0 s PRO 187 CO -0.00 -0.11 0.58 0.45 0.04 0.00 0.00 177.00 177.96 2wv0 n SER 188 N -1.21 -1.67 -4.36 6.66 2.88 0.24 -4.89 113.62 111.27 2wv0 n SER 188 Ca 0.05 -2.46 -0.32 0.00 -1.33 0.00 0.00 58.87 54.80 2wv0 n SER 188 Cb 0.54 2.88 -0.15 0.00 -0.75 0.00 0.00 64.21 66.73 2wv0 n SER 188 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wv0 s ALA 189 N -2.18 2.44 0.14 -1.46 0.00 -1.26 -1.72 121.76 117.73 2wv0 s ALA 189 Ca 0.18 -0.98 -0.31 0.00 0.00 0.00 0.00 51.96 50.85 2wv0 s ALA 189 Cb -0.03 -0.92 -0.10 0.00 0.00 0.00 0.00 23.12 22.07 2wv0 s ALA 189 CO 0.13 0.41 1.66 0.00 0.00 0.00 0.00 175.76 177.95 2wv0 s ALA 190 N -0.17 3.79 0.93 0.00 0.00 -0.53 -4.79 121.76 120.98 2wv0 s ALA 190 Ca -0.02 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 2wv0 s ALA 190 Cb -0.14 -3.68 0.15 0.00 0.00 0.00 0.00 23.12 19.46 2wv0 s ALA 190 CO 0.03 -0.95 1.09 0.95 0.00 0.00 0.00 175.76 176.88 2wv0 s THR 191 N 1.75 2.51 0.19 0.00 -4.23 -1.26 -0.54 115.64 114.06 2wv0 s THR 191 Ca 0.74 0.17 -0.14 0.00 -1.18 0.00 0.00 61.69 61.27 2wv0 s THR 191 Cb -0.44 -2.50 0.13 0.00 1.34 0.00 0.00 72.50 71.03 2wv0 s THR 191 CO 0.32 -0.22 1.68 0.74 -0.54 0.00 0.00 174.62 176.60 2wv0 h THR 192 N -1.74 0.59 -0.13 3.99 2.02 -1.96 0.11 112.91 115.79 2wv0 h THR 192 Ca -0.50 -0.03 -0.20 0.00 0.77 0.00 0.00 66.41 66.45 2wv0 h THR 192 Cb 1.28 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2wv0 h THR 192 CO 0.51 0.02 -0.73 1.05 0.37 0.00 0.00 175.52 176.74 2wv0 h GLU 193 N 0.09 0.60 -0.04 6.66 9.09 -2.00 -1.76 114.58 127.22 2wv0 h GLU 193 Ca 0.25 -0.47 -0.00 0.00 0.05 0.00 0.00 59.36 59.19 2wv0 h GLU 193 Cb 0.38 0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 27.57 2wv0 h GLU 193 CO -0.43 1.09 0.02 0.93 0.05 0.00 0.00 179.01 180.67 2wv0 h GLU 194 N 0.41 0.05 -0.59 1.06 5.08 -1.86 -2.75 114.58 115.98 2wv0 h GLU 194 Ca -0.03 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2wv0 h GLU 194 Cb 1.32 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.49 2wv0 h GLU 194 CO 0.14 0.16 0.16 0.00 -1.00 0.00 0.00 179.01 178.47 2wv0 h ALA 195 N 0.89 0.72 -0.59 3.43 0.00 -0.74 -0.60 119.26 122.37 2wv0 h ALA 195 Ca 0.01 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2wv0 h ALA 195 Cb 0.12 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2wv0 h ALA 195 CO -0.00 -0.27 0.20 -0.91 0.00 0.00 0.00 179.25 178.27 2wv0 h ASN 196 N 0.31 0.84 0.23 0.00 2.35 -1.26 0.05 115.58 118.09 2wv0 h ASN 196 Ca 0.31 -0.19 -0.17 0.00 -0.55 0.00 0.00 56.30 55.69 2wv0 h ASN 196 Cb 0.43 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2wv0 h ASN 196 CO -0.36 0.81 -0.65 0.40 -1.65 0.00 0.00 177.43 175.98 2wv0 h ILE 197 N 0.82 1.37 0.00 2.81 2.04 -1.31 -3.32 117.51 119.92 2wv0 h ILE 197 Ca 0.19 -2.02 -0.12 0.00 1.00 0.00 0.00 64.86 63.91 2wv0 h ILE 197 Cb 0.26 2.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 2wv0 h ILE 197 CO -0.01 0.61 -0.71 -0.07 0.00 0.00 0.00 178.15 177.96 2wv0 h LEU 198 N 0.29 0.00 -0.07 1.44 4.07 -0.73 -3.45 115.31 116.86 2wv0 h LEU 198 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2wv0 h LEU 198 Cb 1.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.94 2wv0 h LEU 198 CO 0.11 0.55 0.00 0.61 -1.08 0.00 0.00 178.44 178.63 2wv0 n GLY 199 N 1.27 1.20 3.30 0.83 0.00 -0.04 -4.61 105.19 107.13 2wv0 n GLY 199 Ca -0.00 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.45 2wv0 n GLY 199 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wv0 s ILE 200 N -2.07 0.77 0.57 -0.61 -4.36 -0.91 -5.07 121.20 109.52 2wv0 s ILE 200 Ca 0.00 -2.00 -0.18 0.00 -0.26 0.00 0.00 60.65 58.21 2wv0 s ILE 200 Cb 0.00 -2.38 -0.04 0.00 1.25 0.00 0.00 42.46 41.28 2wv0 s ILE 200 CO 0.00 -0.26 1.11 -1.10 0.24 0.00 0.00 174.94 174.93 2wv0 s GLN 201 N -3.94 3.26 0.17 0.37 -0.21 -1.26 -4.33 119.66 113.73 2wv0 s GLN 201 Ca 0.30 1.49 -0.33 0.00 0.02 0.00 0.00 55.36 56.84 2wv0 s GLN 201 Cb 0.07 -2.00 -0.14 0.00 1.00 0.00 0.00 33.01 31.94 2wv0 s GLN 201 CO 0.09 -0.90 1.58 1.17 -2.12 0.00 0.00 175.29 175.11 2wv0 n LYS 202 N -1.61 2.22 -0.34 2.91 4.81 -1.26 -1.96 118.16 122.93 2wv0 n LYS 202 Ca 0.11 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 2wv0 n LYS 202 Cb 0.52 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.00 2wv0 n LYS 202 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wv0 n GLY 203 N 3.35 1.05 3.75 3.14 0.00 0.30 -4.94 105.19 111.85 2wv0 n GLY 203 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2wv0 n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv0 s ALA 204 N -2.87 2.75 0.23 4.61 0.00 -0.83 -4.24 121.76 121.41 2wv0 s ALA 204 Ca 0.00 1.17 -0.30 0.00 0.00 0.00 0.00 51.96 52.83 2wv0 s ALA 204 Cb 0.00 -3.50 -0.15 0.00 0.00 0.00 0.00 23.12 19.47 2wv0 s ALA 204 CO 0.00 -1.20 1.06 -2.30 0.00 0.00 0.00 175.76 173.32 2wv0 n PRO 205 N -1.12 1.22 -3.75 0.00 -0.02 -1.26 -1.46 135.00 128.61 2wv0 n PRO 205 Ca 0.11 0.43 -0.13 0.00 -2.02 0.00 0.00 63.50 61.89 2wv0 n PRO 205 Cb 0.47 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 32.01 2wv0 n PRO 205 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wv0 s VAL 206 N -0.64 0.03 -0.21 -1.45 1.01 -0.70 -2.02 120.40 116.43 2wv0 s VAL 206 Ca 0.66 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 2wv0 s VAL 206 Cb -0.78 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 2wv0 s VAL 206 CO 0.56 -0.14 0.01 -0.22 0.00 0.00 0.00 175.10 175.31 2wv0 s LEU 207 N -0.65 3.26 -0.27 3.92 0.20 -0.28 -0.59 118.68 124.26 2wv0 s LEU 207 Ca -0.08 -0.21 -0.13 0.00 0.69 0.00 0.00 54.13 54.40 2wv0 s LEU 207 Cb -0.04 -1.83 -0.04 0.00 -0.43 0.00 0.00 46.19 43.84 2wv0 s LEU 207 CO 0.03 0.05 0.27 -0.76 -0.29 0.00 0.00 176.35 175.65 2wv0 s LEU 208 N 1.11 4.03 -0.18 -0.68 1.02 0.39 -0.06 118.68 124.32 2wv0 s LEU 208 Ca 0.03 0.13 0.01 0.00 0.02 0.00 0.00 54.13 54.32 2wv0 s LEU 208 Cb -0.14 -2.26 0.03 0.00 0.02 0.00 0.00 46.19 43.83 2wv0 s LEU 208 CO 0.02 -0.11 -0.15 -0.63 0.02 0.00 0.00 176.35 175.50 2wv0 s ILE 209 N 1.87 1.79 -0.19 -0.59 1.01 -0.49 -0.98 121.20 123.62 2wv0 s ILE 209 Ca 0.11 -0.87 -0.05 0.00 0.00 0.00 0.00 60.65 59.85 2wv0 s ILE 209 Cb -0.16 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 2wv0 s ILE 209 CO 0.10 0.41 -0.01 -0.75 0.00 0.00 0.00 174.94 174.69 2wv0 s LYS 210 N 1.38 3.61 -0.04 2.79 2.20 -0.38 -1.01 119.74 128.28 2wv0 s LYS 210 Ca 0.03 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.11 2wv0 s LYS 210 Cb -0.14 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.17 2wv0 s LYS 210 CO -0.11 0.04 -0.02 0.50 -0.36 0.00 0.00 175.35 175.40 2wv0 s ARG 211 N 0.90 0.64 -0.26 4.03 3.52 -0.04 -0.70 118.95 127.05 2wv0 s ARG 211 Ca 0.01 -0.02 -0.06 0.00 -0.13 0.00 0.00 55.73 55.52 2wv0 s ARG 211 Cb -0.14 -0.75 -0.01 0.00 -1.56 0.00 0.00 34.95 32.48 2wv0 s ARG 211 CO 0.02 -0.13 0.05 0.99 -0.81 0.00 0.00 175.30 175.42 2wv0 s THR 212 N 1.11 4.00 -0.00 4.11 2.01 -0.21 -0.57 115.64 126.07 2wv0 s THR 212 Ca -0.08 -0.42 0.02 0.00 0.31 0.00 0.00 61.69 61.51 2wv0 s THR 212 Cb -0.14 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 2wv0 s THR 212 CO -0.01 0.26 -0.03 -0.89 -0.69 0.00 0.00 174.62 173.26 2wv0 s THR 213 N 1.55 3.93 0.05 -0.82 2.01 -0.50 -0.87 115.64 120.99 2wv0 s THR 213 Ca 0.05 -0.66 0.09 0.00 0.31 0.00 0.00 61.69 61.48 2wv0 s THR 213 Cb -0.16 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 2wv0 s THR 213 CO 0.02 0.40 -0.26 -0.31 -0.69 0.00 0.00 174.62 173.78 2wv0 s TYR 214 N -1.03 2.26 0.63 4.92 2.02 0.14 -1.85 117.35 124.44 2wv0 s TYR 214 Ca 0.18 -0.41 -0.11 0.00 -0.37 0.00 0.00 57.07 56.36 2wv0 s TYR 214 Cb -0.11 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.07 2wv0 s TYR 214 CO 0.08 0.13 1.04 -0.51 -1.57 0.00 0.00 175.55 174.72 2wv0 s LEU 215 N -1.26 3.22 0.54 -1.29 1.02 -0.14 -0.60 118.68 120.17 2wv0 s LEU 215 Ca 0.11 1.46 0.26 0.00 0.02 0.00 0.00 54.13 55.99 2wv0 s LEU 215 Cb -0.10 -4.48 1.44 0.00 0.02 0.00 0.00 46.19 43.07 2wv0 s LEU 215 CO 0.02 -0.98 1.99 -0.61 0.02 0.00 0.00 176.35 176.79 2wv0 h GLN 216 N -0.37 0.00 -1.18 1.70 5.75 -1.27 0.17 115.11 119.91 2wv0 h GLN 216 Ca -0.44 0.00 0.36 0.00 -0.15 0.00 0.00 58.65 58.42 2wv0 h GLN 216 Cb 1.19 0.00 -0.12 0.00 1.07 0.00 0.00 27.48 29.63 2wv0 h GLN 216 CO 0.61 0.00 0.75 -0.91 -2.65 0.00 0.00 178.83 176.63 2wv0 h ASN 217 N 0.00 0.34 0.00 -0.69 -0.26 -1.92 -3.46 115.58 109.59 2wv0 h ASN 217 Ca 0.24 0.12 0.00 0.00 -0.56 0.00 0.00 56.30 56.10 2wv0 h ASN 217 Cb 1.03 0.08 0.00 0.00 -1.06 0.00 0.00 38.32 38.37 2wv0 h ASN 217 CO -0.00 -0.07 0.00 0.61 -1.06 0.00 0.00 177.43 176.90 2wv0 n GLY 218 N -1.48 0.71 3.66 2.83 0.00 0.60 -5.06 105.19 106.45 2wv0 n GLY 218 Ca 0.32 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.93 2wv0 n GLY 218 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wv0 s THR 219 N -2.57 4.91 0.15 2.61 2.01 -1.25 -4.85 115.64 116.65 2wv0 s THR 219 Ca 0.00 1.51 -0.31 0.00 0.31 0.00 0.00 61.69 63.19 2wv0 s THR 219 Cb 0.00 -4.08 -0.10 0.00 0.01 0.00 0.00 72.50 68.33 2wv0 s THR 219 CO 0.00 0.03 1.60 0.00 -0.69 0.00 0.00 174.62 175.56 2wv0 s ALA 220 N 2.22 3.78 -0.21 7.40 0.00 -1.26 -0.97 121.76 132.72 2wv0 s ALA 220 Ca 0.35 1.37 0.07 0.00 0.00 0.00 0.00 51.96 53.75 2wv0 s ALA 220 Cb -0.16 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.23 2wv0 s ALA 220 CO 0.11 -0.85 0.25 1.97 0.00 0.00 0.00 175.76 177.24 2wv0 n PHE 221 N 4.24 0.00 -3.70 0.00 -1.74 -0.77 -4.90 117.46 110.59 2wv0 n PHE 221 Ca 0.14 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.91 2wv0 n PHE 221 Cb 0.38 -0.06 -0.10 0.00 1.52 0.00 0.00 39.48 41.23 2wv0 n PHE 221 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 2wv0 s GLU 222 N -1.99 0.53 -0.16 3.97 2.12 -1.22 -4.11 118.70 117.85 2wv0 s GLU 222 Ca 0.01 0.73 0.02 0.00 0.36 0.00 0.00 54.97 56.09 2wv0 s GLU 222 Cb 0.05 0.20 0.02 0.00 0.26 0.00 0.00 34.13 34.65 2wv0 s GLU 222 CO 0.30 -0.09 -0.20 -1.58 -0.54 0.00 0.00 175.26 173.14 2wv0 s HIS 223 N 0.61 2.67 0.02 5.30 5.65 -0.63 -1.40 115.29 127.51 2wv0 s HIS 223 Ca -0.03 -1.48 0.05 0.00 0.25 0.00 0.00 55.06 53.85 2wv0 s HIS 223 Cb -0.05 -1.84 -0.02 0.00 -1.18 0.00 0.00 32.58 29.49 2wv0 s HIS 223 CO -0.04 -0.71 -0.16 0.00 -0.65 0.00 0.00 174.74 173.18 2wv0 s ALA 224 N 1.10 1.34 -0.10 1.58 0.00 0.26 -0.24 121.76 125.71 2wv0 s ALA 224 Ca -0.00 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.17 2wv0 s ALA 224 Cb -0.14 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.72 2wv0 s ALA 224 CO -0.08 0.29 -0.20 0.15 0.00 0.00 0.00 175.76 175.92 2wv0 s LYS 225 N -0.88 2.60 0.09 0.00 1.02 -0.04 -0.86 119.74 121.68 2wv0 s LYS 225 Ca 0.04 -0.72 0.05 0.00 0.02 0.00 0.00 55.97 55.37 2wv0 s LYS 225 Cb -0.07 -2.05 -0.03 0.00 -0.52 0.00 0.00 37.83 35.16 2wv0 s LYS 225 CO 0.01 0.08 -0.14 -1.12 -0.92 0.00 0.00 175.35 173.26 2wv0 s SER 226 N 0.58 1.78 -0.24 2.83 0.01 -0.18 -0.14 113.70 118.34 2wv0 s SER 226 Ca -0.14 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.43 2wv0 s SER 226 Cb -0.17 -0.05 0.04 0.00 0.21 0.00 0.00 66.02 66.05 2wv0 s SER 226 CO 0.05 -0.11 -0.11 -0.69 0.41 0.00 0.00 173.24 172.80 2wv0 s VAL 227 N -1.61 2.47 -0.10 3.43 1.01 -0.63 -1.40 120.40 123.57 2wv0 s VAL 227 Ca 0.02 -1.22 -0.05 0.00 0.00 0.00 0.00 61.98 60.73 2wv0 s VAL 227 Cb -0.08 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2wv0 s VAL 227 CO 0.02 0.19 0.10 -0.31 0.00 0.00 0.00 175.10 175.10 2wv0 s TYR 228 N 1.24 3.45 0.19 5.22 2.02 0.91 -1.51 117.35 128.87 2wv0 s TYR 228 Ca -0.02 0.40 -0.33 0.00 -0.37 0.00 0.00 57.07 56.75 2wv0 s TYR 228 Cb -0.17 -1.88 -0.13 0.00 -0.40 0.00 0.00 41.96 39.39 2wv0 s TYR 228 CO -0.06 0.64 1.67 0.54 -1.57 0.00 0.00 175.55 176.77 2wv0 n ARG 229 N 1.93 2.53 0.10 -0.62 1.74 -0.66 -1.13 116.66 120.55 2wv0 n ARG 229 Ca -0.19 0.91 -0.05 0.00 -0.77 0.00 0.00 57.85 57.76 2wv0 n ARG 229 Cb 0.54 -2.73 0.12 0.00 -1.02 0.00 0.00 32.46 29.37 2wv0 n ARG 229 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2wv0 h GLY 230 N 6.48 0.19 2.00 -0.13 0.00 -1.69 -2.28 103.07 107.64 2wv0 h GLY 230 Ca -0.44 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.64 2wv0 h GLY 230 CO 0.93 0.22 0.00 1.29 0.00 0.00 0.00 176.54 178.98 2wv0 h ASP 231 N 0.12 0.00 0.00 0.19 3.04 -1.91 -3.32 116.42 114.55 2wv0 h ASP 231 Ca -0.01 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.78 2wv0 h ASP 231 Cb 1.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 2wv0 h ASP 231 CO 0.10 0.00 -0.73 0.54 -2.04 0.00 0.00 179.24 177.10 2wv0 n ARG 232 N -2.71 2.14 -4.73 4.15 1.74 -1.21 -5.04 116.66 110.99 2wv0 n ARG 232 Ca 0.02 -0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.79 2wv0 n ARG 232 Cb 0.29 -0.88 -0.17 0.00 -1.02 0.00 0.00 32.46 30.68 2wv0 n ARG 232 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2wv0 s TYR 233 N -1.77 2.19 0.00 -1.55 6.14 -0.86 -5.06 117.35 116.43 2wv0 s TYR 233 Ca -0.00 -0.98 0.05 0.00 0.64 0.00 0.00 57.07 56.78 2wv0 s TYR 233 Cb 0.01 -1.52 -0.02 0.00 0.42 0.00 0.00 41.96 40.85 2wv0 s TYR 233 CO 0.05 -0.45 -0.17 0.95 0.64 0.00 0.00 175.55 176.57 2wv0 s THR 234 N 0.72 1.31 -0.08 4.34 -4.23 -1.26 -4.73 115.64 111.72 2wv0 s THR 234 Ca -0.11 -0.81 -0.21 0.00 -1.18 0.00 0.00 61.69 59.37 2wv0 s THR 234 Cb -0.16 -1.11 -0.04 0.00 1.34 0.00 0.00 72.50 72.53 2wv0 s THR 234 CO 0.02 0.28 0.59 0.12 -0.54 0.00 0.00 174.62 175.10 2wv0 s PHE 235 N -0.51 3.57 -0.03 3.99 2.19 -1.26 -5.07 117.98 120.86 2wv0 s PHE 235 Ca 0.06 1.10 0.02 0.00 0.33 0.00 0.00 56.93 58.44 2wv0 s PHE 235 Cb -0.07 -2.67 0.00 0.00 -1.31 0.00 0.00 43.02 38.98 2wv0 s PHE 235 CO 0.00 0.16 -0.09 0.08 1.83 0.00 0.00 175.22 177.21 2wv0 s VAL 236 N 0.56 0.78 0.09 3.12 1.01 -1.26 -5.15 120.40 119.54 2wv0 s VAL 236 Ca 0.32 -0.35 -0.26 0.00 0.00 0.00 0.00 61.98 61.69 2wv0 s VAL 236 Cb -0.17 -0.70 0.08 0.00 0.00 0.00 0.00 36.38 35.60 2wv0 s VAL 236 CO 0.15 0.25 0.71 -2.28 0.00 0.00 0.00 175.10 173.93 2wv0 s HIS 237 N 0.25 -0.47 0.20 5.22 5.04 -1.26 -4.70 115.29 119.57 2wv0 s HIS 237 Ca -0.04 0.33 -0.02 0.00 -1.54 0.00 0.00 55.06 53.80 2wv0 s HIS 237 Cb -0.09 0.54 -0.05 0.00 0.04 0.00 0.00 32.58 33.03 2wv0 s HIS 237 CO 0.01 -0.72 0.40 0.71 -2.34 0.00 0.00 174.74 172.80 2wv0 s TYR 238 N -3.35 3.48 -0.02 3.88 2.02 -0.15 -5.04 117.35 118.17 2wv0 s TYR 238 Ca 0.02 0.41 0.02 0.00 -0.37 0.00 0.00 57.07 57.15 2wv0 s TYR 238 Cb -0.01 -1.91 0.00 0.00 -0.40 0.00 0.00 41.96 39.64 2wv0 s TYR 238 CO -0.10 0.37 -0.07 -1.64 -1.57 0.00 0.00 175.55 172.53 2wv0 s MET 239 N -3.21 0.72 -0.08 -0.62 -1.94 -1.26 -4.92 119.30 107.98 2wv0 s MET 239 Ca 0.39 -0.26 0.01 0.00 -1.71 0.00 0.00 55.69 54.13 2wv0 s MET 239 Cb -0.11 -0.70 -0.03 0.00 2.01 0.00 0.00 34.83 36.01 2wv0 s MET 239 CO 0.28 0.12 -0.10 -0.51 -0.01 0.00 0.00 175.02 174.80 2wv0 s ASP 240 N 0.06 4.34 0.05 3.03 1.01 -1.26 -5.09 116.67 118.81 2wv0 s ASP 240 Ca -0.01 -0.15 -0.31 0.00 0.71 0.00 0.00 52.55 52.80 2wv0 s ASP 240 Cb -0.06 -1.22 -0.06 0.00 1.01 0.00 0.00 42.92 42.59 2wv0 s ASP 240 CO -0.00 0.30 1.29 -0.60 0.21 0.00 0.00 175.17 176.36 2wv0 s ARG 241 N -0.42 4.37 0.19 8.23 3.52 -1.26 -5.01 118.95 128.57 2wv0 s ARG 241 Ca 0.06 1.88 -0.23 0.00 -0.13 0.00 0.00 55.73 57.30 2wv0 s ARG 241 Cb -0.12 -3.38 -0.08 0.00 -1.56 0.00 0.00 34.95 29.80 2wv0 s ARG 241 CO 0.02 -0.38 0.76 -0.51 -0.81 0.00 0.00 175.30 174.37 2wv0 s LEU 242 N 1.43 4.48 0.00 -0.88 1.43 -1.26 -5.37 118.68 118.51 2wv0 s LEU 242 Ca 0.61 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 55.26 2wv0 s LEU 242 Cb -0.31 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.48 2wv0 s LEU 242 CO 0.28 0.13 0.00 -1.54 0.23 0.00 0.00 176.35 175.45