#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 0.64 -0.01 7.83 4.22 -1.26 -5.11 114.94 121.25 2wv0 s ASN 2 Ca 0.00 -0.08 0.03 0.00 -2.14 0.00 0.00 52.86 50.66 2wv0 s ASN 2 Cb 0.00 -0.24 -0.03 0.00 1.28 0.00 0.00 41.25 42.26 2wv0 s ASN 2 CO 0.00 -0.03 -0.05 -0.63 -2.04 0.00 0.00 177.10 174.35 2wv0 s ILE 3 N 0.57 3.76 -0.38 0.54 1.01 -1.26 -5.05 121.20 120.39 2wv0 s ILE 3 Ca -0.06 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 2wv0 s ILE 3 Cb -0.10 -2.63 0.10 0.00 0.01 0.00 0.00 42.46 39.84 2wv0 s ILE 3 CO -0.00 0.42 0.14 0.20 0.00 0.00 0.00 174.94 175.70 2wv0 s ASN 4 N -1.37 5.13 0.53 3.58 0.01 -1.26 -4.97 114.94 116.59 2wv0 s ASN 4 Ca 0.17 -1.89 0.32 0.00 -0.71 0.00 0.00 52.86 50.74 2wv0 s ASN 4 Cb -0.11 -1.78 1.32 0.00 0.41 0.00 0.00 41.25 41.09 2wv0 s ASN 4 CO 0.07 -0.47 1.97 0.07 -1.51 0.00 0.00 177.10 177.24 2wv0 h LYS 5 N 7.98 0.00 -0.00 -0.60 2.10 -1.99 -2.89 116.57 121.17 2wv0 h LYS 5 Ca -0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2wv0 h LYS 5 Cb 1.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.38 2wv0 h LYS 5 CO 0.64 0.05 -0.28 1.04 -2.00 0.00 0.00 179.45 178.91 2wv0 n GLN 6 N -3.18 0.26 -2.27 0.07 1.13 -1.26 -4.92 117.38 107.20 2wv0 n GLN 6 Ca 0.00 -0.12 -0.39 0.00 -1.94 0.00 0.00 57.00 54.55 2wv0 n GLN 6 Cb 0.32 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.15 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 -2.82 6.69 0.62 1.08 0.15 -1.09 -4.93 113.70 113.39 2wv0 s SER 7 Ca 0.17 2.42 0.39 0.00 0.70 0.00 0.00 55.95 59.64 2wv0 s SER 7 Cb 0.19 -2.62 2.14 0.00 -1.71 0.00 0.00 66.02 64.01 2wv0 s SER 7 CO 0.59 -0.57 2.20 1.55 1.20 0.00 0.00 173.24 178.22 2wv0 h PRO 8 N 2.99 0.00 -6.25 5.44 0.13 -1.91 -3.43 132.00 128.98 2wv0 h PRO 8 Ca -0.48 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.09 2wv0 h PRO 8 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 2wv0 h PRO 8 CO 0.64 0.00 0.75 0.42 -0.23 0.00 0.00 178.00 179.58 2wv0 s ILE 9 N -4.05 4.34 0.45 -3.56 1.01 -1.26 -4.98 121.20 113.15 2wv0 s ILE 9 Ca -0.04 1.64 -0.22 0.00 0.00 0.00 0.00 60.65 62.03 2wv0 s ILE 9 Cb 0.11 -4.06 -0.12 0.00 0.01 0.00 0.00 42.46 38.41 2wv0 s ILE 9 CO 0.36 -0.05 0.54 -2.65 0.00 0.00 0.00 174.94 173.14 2wv0 n PRO 10 N 5.65 0.58 0.02 2.79 -0.02 -1.26 -4.77 135.00 137.98 2wv0 n PRO 10 Ca 0.12 0.21 -0.10 0.00 -2.02 0.00 0.00 63.50 61.71 2wv0 n PRO 10 Cb 0.46 -1.55 -0.04 0.00 -0.02 0.00 0.00 33.50 32.35 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 0.72 0.79 -0.16 4.25 1.08 -1.92 -2.45 117.51 119.82 2wv0 h ILE 11 Ca -0.41 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.10 2wv0 h ILE 11 Cb 1.40 0.79 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 2wv0 h ILE 11 CO 0.51 0.00 0.12 0.10 -0.69 0.00 0.00 178.15 178.19 2wv0 h TYR 12 N -0.09 0.00 -0.15 1.37 -0.00 -1.91 -1.35 116.97 114.84 2wv0 h TYR 12 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.59 2wv0 h TYR 12 Cb 0.17 0.00 0.01 0.00 0.00 0.00 0.00 36.73 36.91 2wv0 h TYR 12 CO -0.18 0.00 -0.68 -0.92 -0.00 0.00 0.00 178.16 176.38 2wv0 h TYR 13 N 0.00 0.98 -0.61 0.10 3.20 -1.84 -1.79 116.97 117.01 2wv0 h TYR 13 Ca 0.08 -0.43 -0.02 0.00 3.14 0.00 0.00 58.73 61.50 2wv0 h TYR 13 Cb 0.32 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 2wv0 h TYR 13 CO 0.00 1.25 0.31 1.96 -1.64 0.00 0.00 178.16 180.04 2wv0 h GLN 14 N 0.44 0.87 0.10 1.82 4.20 -0.82 -1.96 115.11 119.77 2wv0 h GLN 14 Ca -0.04 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2wv0 h GLN 14 Cb 1.32 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 2wv0 h GLN 14 CO 0.14 0.68 -0.10 0.82 -0.67 0.00 0.00 178.83 179.70 2wv0 h ILE 15 N 0.84 0.76 -0.33 2.54 2.04 -1.30 -2.46 117.51 119.60 2wv0 h ILE 15 Ca 0.21 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.15 2wv0 h ILE 15 Cb 0.08 0.76 -0.08 0.00 -0.74 0.00 0.00 36.82 36.84 2wv0 h ILE 15 CO -0.03 0.00 -0.29 0.24 0.00 0.00 0.00 178.15 178.07 2wv0 h MET 16 N -0.23 -0.25 -0.52 2.37 2.86 -1.19 -1.24 114.93 116.73 2wv0 h MET 16 Ca 0.01 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2wv0 h MET 16 Cb 0.22 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 2wv0 h MET 16 CO -0.03 -0.17 0.26 1.49 1.06 0.00 0.00 176.91 179.53 2wv0 h GLU 17 N -0.26 0.73 0.23 1.72 4.57 -1.24 -2.06 114.58 118.26 2wv0 h GLU 17 Ca 0.16 -0.08 -0.33 0.00 -1.18 0.00 0.00 59.36 57.93 2wv0 h GLU 17 Cb 0.51 -0.14 0.03 0.00 -0.16 0.00 0.00 28.75 28.99 2wv0 h GLU 17 CO -0.47 0.55 -1.50 1.96 -1.18 0.00 0.00 179.01 178.37 2wv0 h GLN 18 N 0.73 0.48 -0.84 1.92 4.20 -1.07 -2.81 115.11 117.72 2wv0 h GLN 18 Ca 0.18 -0.82 0.10 0.00 0.06 0.00 0.00 58.65 58.17 2wv0 h GLN 18 Cb 0.06 0.31 -0.07 0.00 0.30 0.00 0.00 27.48 28.07 2wv0 h GLN 18 CO -0.03 1.39 0.48 -0.07 -0.67 0.00 0.00 178.83 179.93 2wv0 h LEU 19 N 0.13 0.69 -1.40 1.46 3.38 -1.10 -1.53 115.31 116.94 2wv0 h LEU 19 Ca -0.26 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2wv0 h LEU 19 Cb 2.14 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.77 2wv0 h LEU 19 CO 0.25 0.39 0.41 0.11 0.09 0.00 0.00 178.44 179.69 2wv0 h LYS 20 N 0.80 0.79 -0.22 1.13 1.57 -1.40 -1.98 116.57 117.27 2wv0 h LYS 20 Ca 0.41 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.10 2wv0 h LYS 20 Cb 0.38 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2wv0 h LYS 20 CO -0.25 0.52 -0.01 1.15 -0.57 0.00 0.00 179.45 180.29 2wv0 h THR 21 N 0.81 1.26 -0.53 -0.16 2.02 -1.05 -1.14 112.91 114.13 2wv0 h THR 21 Ca 0.23 -0.91 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 2wv0 h THR 21 Cb -0.05 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 2wv0 h THR 21 CO -0.05 0.28 0.24 1.56 0.37 0.00 0.00 175.52 177.91 2wv0 h GLN 22 N 0.15 0.74 -0.41 6.66 4.20 -1.09 0.43 115.11 125.79 2wv0 h GLN 22 Ca 0.06 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2wv0 h GLN 22 Cb 0.42 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2wv0 h GLN 22 CO 0.01 0.59 -0.08 0.82 -0.67 0.00 0.00 178.83 179.51 2wv0 h ILE 23 N 0.74 1.27 -0.47 2.54 2.04 -1.30 0.28 117.51 122.62 2wv0 h ILE 23 Ca 0.18 -1.15 -0.09 0.00 1.00 0.00 0.00 64.86 64.80 2wv0 h ILE 23 Cb 0.11 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2wv0 h ILE 23 CO -0.02 0.39 -0.08 0.11 0.00 0.00 0.00 178.15 178.54 2wv0 h LYS 24 N 0.59 0.84 0.00 2.37 1.57 -0.36 -3.13 116.57 118.45 2wv0 h LYS 24 Ca 0.11 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 2wv0 h LYS 24 Cb 0.59 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2wv0 h LYS 24 CO 0.04 0.89 -0.46 -2.95 -0.57 0.00 0.00 179.45 176.40 2wv0 h ASN 25 N 0.76 0.00 0.00 0.86 7.08 -0.16 -3.48 115.58 120.64 2wv0 h ASN 25 Ca 0.13 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.35 2wv0 h ASN 25 Cb 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.82 2wv0 h ASN 25 CO 0.04 0.16 0.00 0.61 -2.08 0.00 0.00 177.43 176.16 2wv0 n GLY 26 N 1.17 0.64 0.34 9.14 0.00 -0.16 -4.97 105.19 111.36 2wv0 n GLY 26 Ca 0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.20 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 2.49 0.00 -3.25 1.61 3.07 -0.82 -3.18 114.58 114.50 2wv0 h GLU 27 Ca 0.00 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.22 2wv0 h GLU 27 Cb 0.00 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 27.51 2wv0 h GLU 27 CO 0.00 0.00 -0.51 -0.51 -1.40 0.00 0.00 179.01 176.59 2wv0 s LEU 28 N -8.20 4.81 0.49 1.33 1.02 -0.81 -4.97 118.68 112.35 2wv0 s LEU 28 Ca -0.05 -3.50 -0.23 0.00 0.02 0.00 0.00 54.13 50.37 2wv0 s LEU 28 Cb 0.17 -1.69 -0.06 0.00 0.02 0.00 0.00 46.19 44.62 2wv0 s LEU 28 CO 0.63 -0.17 1.35 0.00 0.02 0.00 0.00 176.35 178.19 2wv0 s GLN 29 N -0.97 3.45 0.61 1.70 -2.07 -1.20 -4.56 119.66 116.62 2wv0 s GLN 29 Ca 0.22 2.24 -0.18 0.00 -1.82 0.00 0.00 55.36 55.82 2wv0 s GLN 29 Cb -0.13 -2.44 -0.06 0.00 -1.09 0.00 0.00 33.01 29.29 2wv0 s GLN 29 CO -0.10 -0.94 0.70 -2.30 -1.32 0.00 0.00 175.29 171.33 2wv0 n PRO 30 N -0.60 0.62 -0.02 9.60 -0.02 -1.26 -2.58 135.00 140.73 2wv0 n PRO 30 Ca 0.08 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2wv0 n PRO 30 Cb 0.44 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 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 -0.18 0.00 -4.81 2.55 8.00 0.53 -4.95 116.55 117.69 2wv0 n ASP 31 Ca 0.12 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.29 2wv0 n ASP 31 Cb 0.48 -1.15 -0.07 0.00 -0.02 0.00 0.00 41.12 40.37 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 -0.03 4.29 0.67 -1.24 -1.94 -1.06 -4.76 119.30 115.24 2wv0 s MET 32 Ca 0.00 1.15 -0.13 0.00 -1.71 0.00 0.00 55.69 55.00 2wv0 s MET 32 Cb 0.00 -2.32 0.00 0.00 2.01 0.00 0.00 34.83 34.52 2wv0 s MET 32 CO 0.00 0.04 1.07 -1.25 -0.01 0.00 0.00 175.02 174.87 2wv0 s PRO 33 N -2.94 2.91 0.43 2.03 0.04 -1.26 -2.72 135.00 133.50 2wv0 s PRO 33 Ca 0.59 1.14 0.05 0.00 0.04 0.00 0.00 61.00 62.82 2wv0 s PRO 33 Cb -0.11 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 2wv0 s PRO 33 CO 0.15 -1.13 0.02 -0.48 0.04 0.00 0.00 177.00 175.60 2wv0 s LEU 34 N -5.18 2.59 0.61 -3.56 0.05 -1.20 -4.94 118.68 107.05 2wv0 s LEU 34 Ca 0.62 -1.47 -0.18 0.00 0.05 0.00 0.00 54.13 53.14 2wv0 s LEU 34 Cb -0.16 -0.76 -0.05 0.00 -2.05 0.00 0.00 46.19 43.17 2wv0 s LEU 34 CO 0.47 -0.61 0.92 -2.65 -0.55 0.00 0.00 176.35 173.94 2wv0 n PRO 35 N -1.03 0.83 -1.29 1.48 -0.02 -1.26 -4.86 135.00 128.85 2wv0 n PRO 35 Ca -0.09 0.33 -0.29 0.00 -2.02 0.00 0.00 63.50 61.42 2wv0 n PRO 35 Cb 0.67 -2.13 0.18 0.00 -0.02 0.00 0.00 33.50 32.20 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 -1.27 2.49 0.19 2.55 1.04 -1.26 -4.78 113.70 112.66 2wv0 s SER 36 Ca 0.76 0.95 -0.13 0.00 0.48 0.00 0.00 55.95 58.01 2wv0 s SER 36 Cb -0.41 -1.47 0.10 0.00 0.10 0.00 0.00 66.02 64.34 2wv0 s SER 36 CO 0.47 -3.19 1.85 -0.08 0.98 0.00 0.00 173.24 173.28 2wv0 h GLU 37 N -1.93 0.80 -0.16 4.02 4.81 -1.96 -0.44 114.58 119.71 2wv0 h GLU 37 Ca -0.51 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 2wv0 h GLU 37 Cb 1.32 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2wv0 h GLU 37 CO 0.53 0.53 0.01 0.00 -0.73 0.00 0.00 179.01 179.35 2wv0 h ARG 38 N 0.82 0.28 -0.85 1.92 3.08 -1.94 -1.62 114.38 116.07 2wv0 h ARG 38 Ca 0.23 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.21 2wv0 h ARG 38 Cb -0.09 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 29.89 2wv0 h ARG 38 CO -0.05 0.48 0.56 1.05 -1.07 0.00 0.00 179.97 180.94 2wv0 h GLU 39 N 0.04 1.08 -0.15 0.04 4.11 -1.87 0.27 114.58 118.10 2wv0 h GLU 39 Ca 0.05 -0.07 -0.10 0.00 0.07 0.00 0.00 59.36 59.31 2wv0 h GLU 39 Cb 0.35 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2wv0 h GLU 39 CO 0.01 0.72 -0.31 1.88 0.07 0.00 0.00 179.01 181.37 2wv0 h TYR 40 N 1.12 0.60 -0.97 2.06 0.05 -1.08 -2.47 116.97 116.27 2wv0 h TYR 40 Ca 0.32 -0.22 0.01 0.00 0.05 0.00 0.00 58.73 58.90 2wv0 h TYR 40 Cb -0.07 -0.11 -0.05 0.00 1.01 0.00 0.00 36.73 37.51 2wv0 h TYR 40 CO -0.00 0.94 0.64 0.00 -1.05 0.00 0.00 178.16 178.69 2wv0 h ALA 41 N 0.55 1.24 -0.34 3.88 0.00 -0.91 -2.31 119.26 121.37 2wv0 h ALA 41 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2wv0 h ALA 41 Cb 0.91 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2wv0 h ALA 41 CO 0.07 0.60 -0.34 1.05 0.00 0.00 0.00 179.25 180.63 2wv0 h GLU 42 N 1.30 0.76 0.31 0.00 -0.00 -0.99 0.16 114.58 116.12 2wv0 h GLU 42 Ca 0.36 -0.36 -0.02 0.00 -0.00 0.00 0.00 59.36 59.34 2wv0 h GLU 42 Cb -0.12 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.63 2wv0 h GLU 42 CO -0.09 0.98 -0.15 -0.56 -0.00 0.00 0.00 179.01 179.20 2wv0 h GLN 43 N 0.63 -0.41 0.00 1.06 3.07 -1.06 -3.16 115.11 115.25 2wv0 h GLN 43 Ca 0.07 0.03 -0.08 0.00 0.09 0.00 0.00 58.65 58.76 2wv0 h GLN 43 Cb 0.87 0.09 -0.01 0.00 0.08 0.00 0.00 27.48 28.52 2wv0 h GLN 43 CO 0.08 -0.17 -0.37 0.74 0.09 0.00 0.00 178.83 179.19 2wv0 h PHE 44 N -0.57 0.00 -1.34 0.06 0.04 -1.51 -3.47 116.94 110.14 2wv0 h PHE 44 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 2wv0 h PHE 44 Cb 0.42 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.57 2wv0 h PHE 44 CO -0.02 0.37 0.00 0.41 -0.60 0.00 0.00 178.31 178.47 2wv0 n GLY 45 N 0.71 0.77 3.53 -1.45 0.00 -0.51 -5.01 105.19 103.23 2wv0 n GLY 45 Ca 0.01 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.97 0.53 0.39 -0.61 -4.36 -0.07 -5.03 121.20 109.07 2wv0 s ILE 46 Ca 0.00 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.13 2wv0 s ILE 46 Cb 0.00 -2.28 -0.09 0.00 1.25 0.00 0.00 42.46 41.35 2wv0 s ILE 46 CO 0.00 0.00 1.18 -0.55 0.24 0.00 0.00 174.94 175.81 2wv0 s SER 47 N -3.64 6.56 0.31 4.36 0.15 -1.26 -4.56 113.70 115.62 2wv0 s SER 47 Ca 0.21 2.37 0.01 0.00 0.70 0.00 0.00 55.95 59.25 2wv0 s SER 47 Cb 0.01 -2.62 0.56 0.00 -1.71 0.00 0.00 66.02 62.26 2wv0 s SER 47 CO 0.15 -0.65 1.93 0.03 1.20 0.00 0.00 173.24 175.90 2wv0 h ARG 48 N 2.72 0.96 -0.12 5.44 3.08 -1.92 -3.05 114.38 121.50 2wv0 h ARG 48 Ca -0.49 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 59.39 2wv0 h ARG 48 Cb 1.23 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 2wv0 h ARG 48 CO 0.63 0.64 -0.45 0.52 -1.07 0.00 0.00 179.97 180.24 2wv0 h MET 49 N 0.99 0.28 -0.53 0.04 2.86 -1.95 -0.69 114.93 115.93 2wv0 h MET 49 Ca 0.36 -0.15 -0.10 0.00 -2.06 0.00 0.00 59.70 57.75 2wv0 h MET 49 Cb 0.14 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 2wv0 h MET 49 CO -0.12 0.68 -0.05 1.15 1.06 0.00 0.00 176.91 179.63 2wv0 h THR 50 N 0.23 1.26 0.69 2.22 2.02 -1.94 -0.54 112.91 116.85 2wv0 h THR 50 Ca 0.02 -1.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.00 2wv0 h THR 50 Cb 0.88 0.90 0.01 0.00 -1.74 0.00 0.00 68.15 68.20 2wv0 h THR 50 CO 0.07 0.41 -0.33 0.58 0.37 0.00 0.00 175.52 176.62 2wv0 h VAL 51 N 0.86 0.26 -0.86 3.16 2.07 -1.44 -2.44 116.25 117.86 2wv0 h VAL 51 Ca 0.15 -0.14 0.25 0.00 0.82 0.00 0.00 66.70 67.78 2wv0 h VAL 51 Cb 0.58 0.31 -0.16 0.00 -1.52 0.00 0.00 31.29 30.49 2wv0 h VAL 51 CO 0.03 0.02 0.06 -1.14 0.02 0.00 0.00 177.57 176.56 2wv0 n ARG 52 N -5.45 -0.07 -0.11 1.57 3.00 -0.30 -0.71 116.66 114.60 2wv0 n ARG 52 Ca -0.13 1.28 -0.09 0.00 -0.00 0.00 0.00 57.85 58.91 2wv0 n ARG 52 Cb 0.38 -2.06 -0.02 0.00 0.00 0.00 0.00 32.46 30.77 2wv0 n ARG 52 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2wv0 h GLN 53 N 0.00 0.49 -0.27 -0.14 4.15 -0.88 -1.45 115.11 117.02 2wv0 h GLN 53 Ca 0.54 -0.08 -0.05 0.00 0.77 0.00 0.00 58.65 59.84 2wv0 h GLN 53 Cb 1.15 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.75 2wv0 h GLN 53 CO -0.80 0.46 -0.02 0.00 -1.93 0.00 0.00 178.83 176.55 2wv0 h ALA 54 N 1.01 0.36 -0.25 3.38 0.00 -0.43 -2.42 119.26 120.90 2wv0 h ALA 54 Ca 0.12 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2wv0 h ALA 54 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wv0 h ALA 54 CO -0.01 0.12 -0.18 -0.07 0.00 0.00 0.00 179.25 179.11 2wv0 h LEU 55 N 0.26 0.59 -0.47 0.00 3.38 -1.11 -2.25 115.31 115.71 2wv0 h LEU 55 Ca 0.07 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.64 2wv0 h LEU 55 Cb 0.45 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 2wv0 h LEU 55 CO 0.02 0.90 0.25 0.28 0.09 0.00 0.00 178.44 179.98 2wv0 h SER 56 N 0.28 0.37 -0.72 -0.43 0.02 -1.32 -0.12 113.55 111.62 2wv0 h SER 56 Ca 0.05 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2wv0 h SER 56 Cb 0.71 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 2wv0 h SER 56 CO 0.05 0.26 0.47 0.78 -1.14 0.00 0.00 176.83 177.25 2wv0 h ASN 57 N 0.49 0.81 -0.62 3.07 2.35 -1.35 0.10 115.58 120.43 2wv0 h ASN 57 Ca 0.20 -0.02 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 2wv0 h ASN 57 Cb 0.09 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 2wv0 h ASN 57 CO -0.13 0.58 0.08 -0.07 -1.65 0.00 0.00 177.43 176.24 2wv0 h LEU 58 N 0.96 1.01 0.18 1.61 3.38 -1.09 -0.04 115.31 121.33 2wv0 h LEU 58 Ca 0.27 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2wv0 h LEU 58 Cb -0.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.36 2wv0 h LEU 58 CO -0.07 1.02 -0.31 0.58 0.09 0.00 0.00 178.44 179.75 2wv0 h VAL 59 N 0.98 0.34 -0.84 1.22 2.07 -0.69 0.46 116.25 119.79 2wv0 h VAL 59 Ca 0.19 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.85 2wv0 h VAL 59 Cb 0.45 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 30.48 2wv0 h VAL 59 CO 0.02 0.00 0.44 0.78 0.02 0.00 0.00 177.57 178.83 2wv0 h ASN 60 N -0.57 0.55 0.23 0.57 -0.26 -0.52 0.42 115.58 116.01 2wv0 h ASN 60 Ca 0.01 0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.83 2wv0 h ASN 60 Cb 0.57 -0.01 -0.00 0.00 -1.06 0.00 0.00 38.32 37.82 2wv0 h ASN 60 CO -0.14 0.25 -0.05 -0.33 -1.06 0.00 0.00 177.43 176.10 2wv0 h GLU 61 N 0.66 0.00 0.00 0.81 5.08 -0.81 -3.46 114.58 116.85 2wv0 h GLU 61 Ca 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 2wv0 h GLU 61 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2wv0 h GLU 61 CO -0.34 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.14 2wv0 n GLY 62 N -0.91 0.84 0.06 -3.84 0.00 0.14 -4.97 105.19 96.51 2wv0 n GLY 62 Ca -0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 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 -9.29 0.99 3.38 -1.12 -3.44 115.31 105.83 2wv0 h LEU 63 Ca 0.00 -0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.47 2wv0 h LEU 63 Cb 0.00 -0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 2wv0 h LEU 63 CO 0.00 0.98 -0.59 -0.76 0.09 0.00 0.00 178.44 178.17 2wv0 s LEU 64 N -6.75 2.14 -0.05 1.67 1.43 -1.08 -1.60 118.68 114.43 2wv0 s LEU 64 Ca 0.01 -1.45 -0.03 0.00 -1.03 0.00 0.00 54.13 51.63 2wv0 s LEU 64 Cb 0.10 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 46.01 2wv0 s LEU 64 CO 0.82 -0.68 0.12 -0.72 0.23 0.00 0.00 176.35 176.12 2wv0 s TYR 65 N -3.27 -0.13 0.00 0.29 -0.85 -0.17 -4.33 117.35 108.89 2wv0 s TYR 65 Ca 0.33 0.36 0.00 0.00 -0.52 0.00 0.00 57.07 57.24 2wv0 s TYR 65 Cb 0.07 -0.02 0.00 0.00 0.38 0.00 0.00 41.96 42.40 2wv0 s TYR 65 CO 0.15 -0.10 0.00 0.54 -1.52 0.00 0.00 175.55 174.62 2wv0 n ARG 66 N 3.51 0.00 -3.99 -3.49 5.12 -1.26 -1.66 116.66 114.89 2wv0 n ARG 66 Ca -0.18 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.65 2wv0 n ARG 66 Cb 0.56 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.76 2wv0 n ARG 66 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2wv0 s THR 72 N 0.00 0.15 0.04 0.55 -4.23 -1.26 -5.09 115.64 105.80 2wv0 s THR 72 Ca 0.00 -1.23 0.03 0.00 -1.18 0.00 0.00 61.69 59.31 2wv0 s THR 72 Cb 0.00 -0.87 -0.02 0.00 1.34 0.00 0.00 72.50 72.95 2wv0 s THR 72 CO 0.00 -0.68 -0.10 -0.36 -0.54 0.00 0.00 174.62 172.94 2wv0 s PHE 73 N -2.61 0.85 -0.02 3.99 0.08 -0.66 -3.23 117.98 116.38 2wv0 s PHE 73 Ca -0.05 -0.41 -0.30 0.00 0.12 0.00 0.00 56.93 56.29 2wv0 s PHE 73 Cb -0.01 -0.50 -0.05 0.00 -0.57 0.00 0.00 43.02 41.88 2wv0 s PHE 73 CO -0.05 -0.02 1.39 0.54 -0.10 0.00 0.00 175.22 176.97 2wv0 s VAL 74 N -1.10 3.79 0.23 -0.44 0.11 -1.10 -1.00 120.40 120.89 2wv0 s VAL 74 Ca -0.05 1.15 -0.30 0.00 -2.93 0.00 0.00 61.98 59.85 2wv0 s VAL 74 Cb -0.09 -3.74 -0.09 0.00 -1.53 0.00 0.00 36.38 30.93 2wv0 s VAL 74 CO 0.01 -0.01 1.32 -0.44 -3.33 0.00 0.00 175.10 172.65 2wv0 s SER 75 N 1.92 6.85 -0.13 3.54 0.01 -0.63 -0.35 113.70 124.92 2wv0 s SER 75 Ca 0.63 2.49 -0.29 0.00 1.31 0.00 0.00 55.95 60.08 2wv0 s SER 75 Cb -0.30 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.27 2wv0 s SER 75 CO 0.25 -0.54 1.52 -1.59 0.41 0.00 0.00 173.24 173.29 2wv0 s LYS 76 N -0.50 4.11 0.22 12.44 0.00 -1.26 -4.73 119.74 130.01 2wv0 s LYS 76 Ca 0.55 1.89 -0.30 0.00 0.00 0.00 0.00 55.97 58.11 2wv0 s LYS 76 Cb -0.38 -3.93 -0.08 0.00 0.00 0.00 0.00 37.83 33.44 2wv0 s LYS 76 CO 0.42 -0.91 0.94 -1.25 0.00 0.00 0.00 175.35 174.55 2wv0 s PRO 77 N 4.01 4.83 -0.31 1.78 0.04 -1.26 -5.00 135.00 139.09 2wv0 s PRO 77 Ca 0.67 1.47 -0.18 0.00 0.04 0.00 0.00 61.00 63.00 2wv0 s PRO 77 Cb -0.27 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 30.96 2wv0 s PRO 77 CO 0.25 0.48 0.52 0.21 0.04 0.00 0.00 177.00 178.49 2wv0 s LYS 78 N -1.00 3.83 0.00 4.56 2.36 -1.26 -4.94 119.74 123.29 2wv0 s LYS 78 Ca 0.42 0.07 0.18 0.00 -2.55 0.00 0.00 55.97 54.08 2wv0 s LYS 78 Cb -0.26 -3.74 -0.19 0.00 -1.05 0.00 0.00 37.83 32.59 2wv0 s LYS 78 CO 0.32 -0.52 0.76 -1.33 1.55 0.00 0.00 175.35 176.13 2wv0 n MET 79 N 5.68 1.11 0.02 4.03 2.81 -1.26 -4.66 117.12 124.85 2wv0 n MET 79 Ca -0.04 -0.01 -0.14 0.00 -1.81 0.00 0.00 57.70 55.71 2wv0 n MET 79 Cb 0.49 -1.34 -0.07 0.00 -0.71 0.00 0.00 33.22 31.59 2wv0 n MET 79 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2wv0 h GLU 80 N 0.02 -0.54 -0.72 0.03 5.08 -1.98 0.16 114.58 116.62 2wv0 h GLU 80 Ca 0.00 0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2wv0 h GLU 80 Cb 0.42 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2wv0 h GLU 80 CO 0.00 -0.36 0.26 0.37 -1.00 0.00 0.00 179.01 178.28 2wv0 h GLN 81 N -0.56 1.10 -0.34 2.33 5.75 -1.93 0.02 115.11 121.49 2wv0 h GLN 81 Ca 0.05 -0.22 -0.10 0.00 -0.15 0.00 0.00 58.65 58.23 2wv0 h GLN 81 Cb 0.66 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.03 2wv0 h GLN 81 CO -0.38 0.93 -0.18 0.00 -2.65 0.00 0.00 178.83 176.54 2wv0 h ALA 82 N 1.12 0.48 0.00 3.38 0.00 -1.71 -0.52 119.26 122.02 2wv0 h ALA 82 Ca 0.24 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2wv0 h ALA 82 Cb 0.26 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2wv0 h ALA 82 CO -0.01 0.41 -1.39 -0.07 0.00 0.00 0.00 179.25 178.19 2wv0 h LEU 83 N 0.50 0.00 -0.17 0.00 3.38 -0.71 -3.41 115.31 114.90 2wv0 h LEU 83 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2wv0 h LEU 83 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2wv0 h LEU 83 CO 0.05 0.63 0.00 0.00 0.09 0.00 0.00 178.44 179.21 2wv0 n GLN 84 N -2.93 3.08 0.00 1.13 6.02 -0.02 -0.88 117.38 123.78 2wv0 n GLN 84 Ca -0.10 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 2wv0 n GLN 84 Cb 0.86 -0.45 0.00 0.00 1.02 0.00 0.00 30.24 31.67 2wv0 n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wv0 n GLY 85 N 0.46 3.32 2.78 1.08 0.00 -0.21 -4.96 105.19 107.66 2wv0 n GLY 85 Ca 0.00 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.31 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 0.19 0.20 0.99 2.96 -1.15 -4.91 118.68 116.96 2wv0 s LEU 86 Ca 0.00 0.21 0.11 0.00 -0.22 0.00 0.00 54.13 54.23 2wv0 s LEU 86 Cb 0.00 0.10 -0.04 0.00 0.50 0.00 0.00 46.19 46.75 2wv0 s LEU 86 CO 0.00 -0.23 -0.20 0.42 -1.32 0.00 0.00 176.35 175.03 2wv0 s THR 87 N 2.02 2.59 0.82 3.68 -4.23 -1.26 -4.92 115.64 114.33 2wv0 s THR 87 Ca 0.01 -1.96 -0.12 0.00 -1.18 0.00 0.00 61.69 58.44 2wv0 s THR 87 Cb -0.12 -2.26 0.08 0.00 1.34 0.00 0.00 72.50 71.54 2wv0 s THR 87 CO -0.04 -0.14 1.11 -0.94 -0.54 0.00 0.00 174.62 174.07 2wv0 s SER 88 N -2.78 4.29 0.21 3.99 1.04 -1.26 -4.83 113.70 114.36 2wv0 s SER 88 Ca 0.23 1.21 -0.11 0.00 0.48 0.00 0.00 55.95 57.75 2wv0 s SER 88 Cb -0.08 -1.90 0.27 0.00 0.10 0.00 0.00 66.02 64.41 2wv0 s SER 88 CO 0.12 -2.08 1.68 0.15 0.98 0.00 0.00 173.24 174.08 2wv0 h PHE 89 N -1.17 0.04 -0.26 5.02 3.04 -2.01 0.13 116.94 121.73 2wv0 h PHE 89 Ca -0.48 0.04 0.06 0.00 3.98 0.00 0.00 57.97 61.57 2wv0 h PHE 89 Cb 1.28 0.07 -0.06 0.00 2.56 0.00 0.00 35.95 39.81 2wv0 h PHE 89 CO 0.42 -0.11 -0.12 1.15 -2.02 0.00 0.00 178.31 177.63 2wv0 h THR 90 N 0.16 0.63 -0.28 4.41 2.02 -1.97 0.02 112.91 117.89 2wv0 h THR 90 Ca 0.30 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.32 2wv0 h THR 90 Cb 0.47 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2wv0 h THR 90 CO -0.46 0.00 -0.48 -0.33 0.37 0.00 0.00 175.52 174.62 2wv0 h GLU 91 N -0.08 0.74 -0.59 6.66 5.08 -1.87 -2.74 114.58 121.79 2wv0 h GLU 91 Ca 0.14 -0.43 0.12 0.00 -1.00 0.00 0.00 59.36 58.18 2wv0 h GLU 91 Cb 0.28 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.48 2wv0 h GLU 91 CO -0.31 1.05 0.07 0.22 -1.00 0.00 0.00 179.01 179.04 2wv0 h ASP 92 N 0.59 -0.11 0.23 1.42 3.58 -0.19 -1.51 116.42 120.42 2wv0 h ASP 92 Ca 0.03 0.13 -0.17 0.00 0.42 0.00 0.00 57.03 57.44 2wv0 h ASP 92 Cb 1.04 0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.29 2wv0 h ASP 92 CO 0.10 -0.04 -0.65 0.24 -2.88 0.00 0.00 179.24 176.00 2wv0 h MET 93 N 0.19 0.40 -0.52 0.28 2.86 -0.95 -3.15 114.93 114.04 2wv0 h MET 93 Ca 0.31 -0.29 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2wv0 h MET 93 Cb 0.48 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 2wv0 h MET 93 CO -0.44 0.92 0.07 0.87 1.06 0.00 0.00 176.91 179.38 2wv0 h LYS 94 N 0.29 0.83 -0.15 1.72 1.57 -1.11 -0.55 116.57 119.18 2wv0 h LYS 94 Ca -0.02 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2wv0 h LYS 94 Cb 1.20 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 2wv0 h LYS 94 CO 0.11 0.79 0.10 0.66 -0.57 0.00 0.00 179.45 180.54 2wv0 h SER 95 N 0.79 0.16 -0.35 0.86 4.64 -1.25 0.10 113.55 118.51 2wv0 h SER 95 Ca 0.16 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2wv0 h SER 95 Cb 0.38 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2wv0 h SER 95 CO 0.01 0.12 0.00 0.54 -0.87 0.00 0.00 176.83 176.63 2wv0 n ARG 96 N -4.52 1.91 -2.32 4.77 1.74 -0.74 -4.89 116.66 112.62 2wv0 n ARG 96 Ca -0.01 -1.29 -0.20 0.00 -0.77 0.00 0.00 57.85 55.58 2wv0 n ARG 96 Cb 0.08 -1.32 -0.02 0.00 -1.02 0.00 0.00 32.46 30.18 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 0.99 -0.26 3.67 -0.13 0.00 0.36 -5.01 105.19 104.82 2wv0 n GLY 97 Ca 0.12 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -4.90 2.43 -0.40 1.61 -1.94 -0.29 -5.00 119.30 110.82 2wv0 s MET 98 Ca 0.00 -1.14 -0.18 0.00 -1.71 0.00 0.00 55.69 52.66 2wv0 s MET 98 Cb 0.00 -2.35 0.01 0.00 2.01 0.00 0.00 34.83 34.50 2wv0 s MET 98 CO 0.00 0.44 0.50 0.99 -0.01 0.00 0.00 175.02 176.94 2wv0 s THR 99 N -1.84 5.02 0.47 2.05 2.01 -1.26 -3.71 115.64 118.38 2wv0 s THR 99 Ca 0.28 -0.05 -0.14 0.00 0.31 0.00 0.00 61.69 62.10 2wv0 s THR 99 Cb -0.09 -4.04 -0.07 0.00 0.01 0.00 0.00 72.50 68.31 2wv0 s THR 99 CO 0.19 -0.39 0.90 -2.16 -0.69 0.00 0.00 174.62 172.47 2wv0 s PRO 100 N 2.34 3.87 0.25 4.92 0.04 -1.26 -0.32 135.00 144.84 2wv0 s PRO 100 Ca 0.16 0.75 -0.21 0.00 0.04 0.00 0.00 61.00 61.74 2wv0 s PRO 100 Cb -0.16 -2.24 0.06 0.00 0.04 0.00 0.00 34.50 32.20 2wv0 s PRO 100 CO 0.15 -0.18 0.90 0.20 0.04 0.00 0.00 177.00 178.11 2wv0 s GLY 101 N -3.12 0.06 0.01 0.56 0.00 -0.54 -4.93 107.32 99.36 2wv0 s GLY 101 Ca 0.56 -0.33 -0.08 0.00 0.00 0.00 0.00 44.72 44.87 2wv0 s GLY 101 CO 0.32 0.64 0.16 -0.56 0.00 0.00 0.00 173.10 173.65 2wv0 s SER 102 N -3.12 0.02 -0.11 1.64 0.01 -1.26 0.40 113.70 111.27 2wv0 s SER 102 Ca 0.16 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.20 2wv0 s SER 102 Cb -0.03 0.23 0.02 0.00 0.21 0.00 0.00 66.02 66.44 2wv0 s SER 102 CO 0.06 -0.41 -0.13 -0.60 0.41 0.00 0.00 173.24 172.57 2wv0 s ARG 103 N -1.62 2.02 0.07 12.44 3.52 -0.49 -4.75 118.95 130.14 2wv0 s ARG 103 Ca -0.13 -0.47 -0.31 0.00 -0.13 0.00 0.00 55.73 54.69 2wv0 s ARG 103 Cb -0.06 -1.82 -0.08 0.00 -1.56 0.00 0.00 34.95 31.44 2wv0 s ARG 103 CO 0.01 -0.14 1.53 -1.17 -0.81 0.00 0.00 175.30 174.71 2wv0 s LEU 104 N 1.24 4.35 -0.25 -0.88 2.96 -1.26 -0.72 118.68 124.13 2wv0 s LEU 104 Ca -0.02 2.38 0.04 0.00 -0.22 0.00 0.00 54.13 56.31 2wv0 s LEU 104 Cb -0.14 -3.57 -0.18 0.00 0.50 0.00 0.00 46.19 42.80 2wv0 s LEU 104 CO -0.05 -0.79 -0.17 -0.38 -1.32 0.00 0.00 176.35 173.64 2wv0 n ILE 105 N 4.46 1.48 -3.64 6.68 2.08 0.10 -4.90 119.36 125.62 2wv0 n ILE 105 Ca 0.14 -0.61 -0.10 0.00 0.56 0.00 0.00 62.75 62.74 2wv0 n ILE 105 Cb 0.41 -1.30 -0.07 0.00 -0.75 0.00 0.00 39.64 37.94 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 -6.39 -0.72 -0.03 4.38 2.15 -0.78 -5.02 116.67 110.27 2wv0 s ASP 106 Ca -0.31 1.28 0.06 0.00 0.43 0.00 0.00 52.55 54.01 2wv0 s ASP 106 Cb 0.09 1.30 -0.01 0.00 -0.30 0.00 0.00 42.92 43.99 2wv0 s ASP 106 CO 0.64 -0.21 -0.21 -0.47 -0.17 0.00 0.00 175.17 174.74 2wv0 s TYR 107 N 0.80 1.93 -0.12 -5.34 6.14 -1.26 -0.59 117.35 118.91 2wv0 s TYR 107 Ca -0.03 -0.42 -0.20 0.00 0.64 0.00 0.00 57.07 57.05 2wv0 s TYR 107 Cb -0.05 -1.25 0.05 0.00 0.42 0.00 0.00 41.96 41.13 2wv0 s TYR 107 CO -0.08 -0.08 0.51 1.14 0.64 0.00 0.00 175.55 177.69 2wv0 s GLN 108 N -0.37 0.73 -0.43 4.97 -2.07 -0.69 -5.03 119.66 116.78 2wv0 s GLN 108 Ca 0.05 0.41 -0.17 0.00 -1.82 0.00 0.00 55.36 53.83 2wv0 s GLN 108 Cb -0.09 0.35 0.03 0.00 -1.09 0.00 0.00 33.01 32.20 2wv0 s GLN 108 CO 0.00 -0.16 0.41 -1.17 -1.32 0.00 0.00 175.29 173.05 2wv0 s LEU 109 N -0.44 5.00 0.22 2.60 2.96 -1.26 -0.02 118.68 127.73 2wv0 s LEU 109 Ca -0.06 -0.80 0.06 0.00 -0.22 0.00 0.00 54.13 53.11 2wv0 s LEU 109 Cb -0.03 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 2wv0 s LEU 109 CO 0.04 -0.57 0.19 0.27 -1.32 0.00 0.00 176.35 174.96 2wv0 s ILE 110 N 2.00 4.56 0.07 6.68 -4.36 0.49 -4.89 121.20 125.74 2wv0 s ILE 110 Ca 0.10 -1.23 -0.31 0.00 -0.26 0.00 0.00 60.65 58.95 2wv0 s ILE 110 Cb -0.18 -3.41 -0.06 0.00 1.25 0.00 0.00 42.46 40.06 2wv0 s ILE 110 CO 0.12 -0.26 1.21 -1.81 0.24 0.00 0.00 174.94 174.44 2wv0 s ASP 111 N -3.58 7.07 0.58 4.36 1.01 -1.26 -1.09 116.67 123.76 2wv0 s ASP 111 Ca 0.32 2.03 -0.20 0.00 0.71 0.00 0.00 52.55 55.42 2wv0 s ASP 111 Cb -0.09 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 2wv0 s ASP 111 CO 0.25 -0.47 1.19 -1.54 0.21 0.00 0.00 175.17 174.80 2wv0 n SER 112 N 3.88 1.81 -4.84 0.27 3.41 -0.15 -4.89 113.62 113.12 2wv0 n SER 112 Ca 0.09 0.90 -0.21 0.00 -0.26 0.00 0.00 58.87 59.38 2wv0 n SER 112 Cb 0.46 -1.49 -0.04 0.00 -0.26 0.00 0.00 64.21 62.88 2wv0 n SER 112 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2wv0 s THR 113 N -1.38 3.53 0.22 6.66 -4.23 -1.26 -4.76 115.64 114.42 2wv0 s THR 113 Ca 0.75 -1.41 -0.09 0.00 -1.18 0.00 0.00 61.69 59.76 2wv0 s THR 113 Cb -0.42 -3.17 0.17 0.00 1.34 0.00 0.00 72.50 70.42 2wv0 s THR 113 CO 0.47 -0.18 1.83 -0.33 -0.54 0.00 0.00 174.62 175.87 2wv0 h GLU 114 N 1.29 1.13 -0.83 3.99 5.08 -1.97 0.18 114.58 123.45 2wv0 h GLU 114 Ca -0.45 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 57.76 2wv0 h GLU 114 Cb 1.25 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 2wv0 h GLU 114 CO 0.59 0.84 0.46 1.49 -1.00 0.00 0.00 179.01 181.39 2wv0 h GLU 115 N 1.13 1.16 -0.15 2.33 4.81 -1.98 0.70 114.58 122.57 2wv0 h GLU 115 Ca 0.29 -0.13 -0.19 0.00 -0.13 0.00 0.00 59.36 59.19 2wv0 h GLU 115 Cb 0.04 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 2wv0 h GLU 115 CO -0.05 0.85 -0.68 -0.07 -0.73 0.00 0.00 179.01 178.34 2wv0 h LEU 116 N 1.16 0.70 -0.45 1.64 3.38 -1.84 -1.71 115.31 118.19 2wv0 h LEU 116 Ca 0.29 -0.43 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2wv0 h LEU 116 Cb 0.02 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2wv0 h LEU 116 CO -0.05 1.18 -0.13 0.00 0.09 0.00 0.00 178.44 179.54 2wv0 h ALA 117 N 0.81 0.62 -0.86 1.53 0.00 -0.53 -0.90 119.26 119.93 2wv0 h ALA 117 Ca -0.02 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.56 2wv0 h ALA 117 Cb 1.26 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2wv0 h ALA 117 CO 0.13 0.53 0.57 0.00 0.00 0.00 0.00 179.25 180.47 2wv0 h ALA 118 N 0.86 1.10 -0.11 0.00 0.00 -0.81 0.64 119.26 120.93 2wv0 h ALA 118 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wv0 h ALA 118 Cb 0.67 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2wv0 h ALA 118 CO 0.05 0.48 0.00 0.82 0.00 0.00 0.00 179.25 180.60 2wv0 h ILE 119 N 1.16 1.25 0.00 0.00 1.08 -1.12 -3.33 117.51 116.54 2wv0 h ILE 119 Ca 0.32 -0.80 -0.02 0.00 -0.39 0.00 0.00 64.86 63.97 2wv0 h ILE 119 Cb -0.12 1.57 -0.00 0.00 -3.07 0.00 0.00 36.82 35.20 2wv0 h ILE 119 CO -0.07 0.23 -0.99 -0.07 -0.69 0.00 0.00 178.15 176.55 2wv0 h LEU 120 N -0.08 0.00 0.21 1.44 -0.00 -1.06 -3.48 115.31 112.35 2wv0 h LEU 120 Ca 0.03 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.82 2wv0 h LEU 120 Cb 0.35 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.98 2wv0 h LEU 120 CO 0.01 0.06 -0.08 0.61 -0.00 0.00 0.00 178.44 179.03 2wv0 n GLY 121 N 1.20 0.69 3.93 0.83 0.00 0.22 -4.16 105.19 107.90 2wv0 n GLY 121 Ca -0.01 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 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 -4.82 1.64 -0.16 0.00 0.00 -1.26 -4.80 107.32 97.93 2wv0 s GLY 123 Ca 0.71 0.08 -0.05 0.00 0.00 0.00 0.00 44.72 45.46 2wv0 s GLY 123 CO 0.51 0.50 0.32 -1.58 0.00 0.00 0.00 173.10 172.85 2wv0 s HIS 124 N -2.94 -0.57 0.60 1.90 2.46 -1.26 -3.99 115.29 111.49 2wv0 s HIS 124 Ca 0.62 1.12 -0.15 0.00 0.47 0.00 0.00 55.06 57.12 2wv0 s HIS 124 Cb -0.17 0.07 -0.03 0.00 -0.13 0.00 0.00 32.58 32.31 2wv0 s HIS 124 CO 0.56 -0.43 1.05 -1.25 -2.47 0.00 0.00 174.74 172.20 2wv0 s PRO 125 N 2.49 3.34 0.29 2.88 0.04 -1.26 -5.14 135.00 137.63 2wv0 s PRO 125 Ca 0.01 1.13 -0.20 0.00 0.04 0.00 0.00 61.00 61.98 2wv0 s PRO 125 Cb -0.12 -2.04 0.05 0.00 0.04 0.00 0.00 34.50 32.43 2wv0 s PRO 125 CO -0.11 -0.79 0.84 -1.54 0.04 0.00 0.00 177.00 175.44 2wv0 s SER 126 N -3.01 -0.10 -0.21 6.66 1.04 -1.26 -5.01 113.70 111.83 2wv0 s SER 126 Ca 0.62 -0.80 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 2wv0 s SER 126 Cb -0.15 0.71 -0.03 0.00 0.10 0.00 0.00 66.02 66.64 2wv0 s SER 126 CO 0.39 -1.36 0.05 -0.44 0.98 0.00 0.00 173.24 172.86 2wv0 s SER 127 N -3.06 5.30 -0.06 7.02 0.01 -1.26 -0.97 113.70 120.67 2wv0 s SER 127 Ca 0.15 -0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.39 2wv0 s SER 127 Cb -0.04 -1.92 -0.01 0.00 0.21 0.00 0.00 66.02 64.26 2wv0 s SER 127 CO 0.08 0.09 -0.23 -0.63 0.41 0.00 0.00 173.24 172.96 2wv0 s ILE 128 N 0.88 1.90 0.08 1.44 1.01 -0.25 -0.39 121.20 125.87 2wv0 s ILE 128 Ca 0.03 -0.97 -0.31 0.00 0.00 0.00 0.00 60.65 59.40 2wv0 s ILE 128 Cb -0.14 -1.62 -0.06 0.00 0.01 0.00 0.00 42.46 40.65 2wv0 s ILE 128 CO 0.02 0.53 1.24 -1.00 0.00 0.00 0.00 174.94 175.73 2wv0 s HIS 129 N -0.02 3.40 -0.34 3.97 3.76 0.12 -0.38 115.29 125.80 2wv0 s HIS 129 Ca -0.07 1.24 -0.00 0.00 -0.15 0.00 0.00 55.06 56.08 2wv0 s HIS 129 Cb -0.14 -3.47 0.08 0.00 1.11 0.00 0.00 32.58 30.16 2wv0 s HIS 129 CO 0.04 -1.49 0.06 0.21 -0.85 0.00 0.00 174.74 172.71 2wv0 s LYS 130 N 0.95 2.09 -0.22 1.40 2.20 0.97 -1.47 119.74 125.65 2wv0 s LYS 130 Ca 0.59 -1.57 -0.04 0.00 -0.36 0.00 0.00 55.97 54.60 2wv0 s LYS 130 Cb -0.31 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2wv0 s LYS 130 CO 0.30 -0.82 -0.04 0.42 -0.36 0.00 0.00 175.35 174.86 2wv0 s ILE 131 N 1.13 3.38 -0.23 5.43 1.01 -0.17 -1.71 121.20 130.04 2wv0 s ILE 131 Ca 0.02 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.14 2wv0 s ILE 131 Cb -0.21 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.74 2wv0 s ILE 131 CO -0.04 0.40 -0.10 -0.89 0.00 0.00 0.00 174.94 174.32 2wv0 s THR 132 N 1.48 2.68 0.10 2.92 2.01 0.24 -0.60 115.64 124.46 2wv0 s THR 132 Ca 0.05 -1.00 0.07 0.00 0.31 0.00 0.00 61.69 61.13 2wv0 s THR 132 Cb -0.14 -2.31 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 2wv0 s THR 132 CO -0.03 0.28 -0.18 -0.13 -0.69 0.00 0.00 174.62 173.87 2wv0 s ARG 133 N 1.31 1.03 -0.07 4.92 0.52 -0.47 0.02 118.95 126.22 2wv0 s ARG 133 Ca 0.01 -1.12 -0.29 0.00 -0.52 0.00 0.00 55.73 53.82 2wv0 s ARG 133 Cb -0.16 -1.18 -0.02 0.00 0.52 0.00 0.00 34.95 34.11 2wv0 s ARG 133 CO -0.06 0.27 0.94 0.08 0.02 0.00 0.00 175.30 176.55 2wv0 s VAL 134 N -1.31 4.86 -0.12 3.52 1.01 0.10 -0.62 120.40 127.84 2wv0 s VAL 134 Ca 0.05 1.94 -0.17 0.00 0.00 0.00 0.00 61.98 63.80 2wv0 s VAL 134 Cb -0.09 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 2wv0 s VAL 134 CO 0.04 0.10 0.43 -0.13 0.00 0.00 0.00 175.10 175.53 2wv0 s ARG 135 N 1.49 4.30 0.12 2.72 1.81 0.15 -1.39 118.95 128.15 2wv0 s ARG 135 Ca 0.48 0.36 0.07 0.00 -1.72 0.00 0.00 55.73 54.92 2wv0 s ARG 135 Cb -0.19 -3.42 -0.04 0.00 -0.45 0.00 0.00 34.95 30.85 2wv0 s ARG 135 CO 0.21 0.20 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.45 2wv0 s LEU 136 N 0.51 3.11 -0.12 2.53 2.01 0.16 -0.54 118.68 126.34 2wv0 s LEU 136 Ca 0.24 -0.39 -0.02 0.00 0.01 0.00 0.00 54.13 53.97 2wv0 s LEU 136 Cb -0.15 -1.87 0.04 0.00 0.01 0.00 0.00 46.19 44.22 2wv0 s LEU 136 CO 0.09 0.16 0.01 0.00 1.01 0.00 0.00 176.35 177.61 2wv0 s ALA 137 N -1.33 0.86 -1.40 4.21 0.00 -0.14 -1.47 121.76 122.49 2wv0 s ALA 137 Ca 0.23 -0.36 -0.05 0.00 0.00 0.00 0.00 51.96 51.78 2wv0 s ALA 137 Cb -0.11 -0.91 0.03 0.00 0.00 0.00 0.00 23.12 22.14 2wv0 s ALA 137 CO 0.15 -0.70 0.79 0.09 0.00 0.00 0.00 175.76 176.09 2wv0 n ASN 138 N 5.10 -2.49 0.00 0.00 3.02 0.56 -1.94 115.26 119.50 2wv0 n ASN 138 Ca -0.08 -0.82 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 2wv0 n ASN 138 Cb 0.49 -3.93 0.00 0.00 -0.61 0.00 0.00 39.78 35.73 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 -2.97 -4.13 -4.58 6.41 8.00 -1.26 -4.98 116.55 113.04 2wv0 n ASP 139 Ca -0.17 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 54.99 2wv0 n ASP 139 Cb 0.62 -2.53 -0.11 0.00 -0.02 0.00 0.00 41.12 39.08 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 -1.37 4.09 0.30 0.53 1.01 -0.82 -5.07 121.20 119.87 2wv0 s ILE 140 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 60.65 60.05 2wv0 s ILE 140 Cb 0.00 -2.77 -0.12 0.00 0.01 0.00 0.00 42.46 39.58 2wv0 s ILE 140 CO 0.00 0.53 1.41 -2.65 0.00 0.00 0.00 174.94 174.23 2wv0 n PRO 141 N 2.98 2.25 0.00 2.79 -0.02 -1.26 -0.97 135.00 140.78 2wv0 n PRO 141 Ca -0.18 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2wv0 n PRO 141 Cb 0.53 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 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 1.42 0.00 -3.81 -0.52 1.56 0.30 -4.84 117.12 111.24 2wv0 n MET 142 Ca 0.08 0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.40 2wv0 n MET 142 Cb 0.35 -0.90 -0.08 0.00 2.15 0.00 0.00 33.22 34.73 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 -1.98 -0.52 -0.16 -5.12 0.00 -1.05 -1.38 121.76 111.55 2wv0 s ALA 143 Ca 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 51.96 51.81 2wv0 s ALA 143 Cb 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 2wv0 s ALA 143 CO 0.00 -0.35 0.02 0.42 0.00 0.00 0.00 175.76 175.85 2wv0 s ILE 144 N -2.29 4.45 -0.06 0.00 1.01 -0.35 0.30 121.20 124.27 2wv0 s ILE 144 Ca -0.07 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.46 2wv0 s ILE 144 Cb -0.02 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.48 2wv0 s ILE 144 CO -0.02 0.49 -0.16 -0.70 0.00 0.00 0.00 174.94 174.55 2wv0 s GLU 145 N 0.24 1.85 -0.23 2.79 2.12 0.21 -1.01 118.70 124.67 2wv0 s GLU 145 Ca 0.01 -0.55 0.02 0.00 0.36 0.00 0.00 54.97 54.82 2wv0 s GLU 145 Cb -0.13 -1.55 0.05 0.00 0.26 0.00 0.00 34.13 32.76 2wv0 s GLU 145 CO 0.01 0.15 -0.14 0.45 -0.54 0.00 0.00 175.26 175.20 2wv0 s SER 146 N 0.31 3.99 -0.05 -1.70 0.15 -0.13 -1.37 113.70 114.90 2wv0 s SER 146 Ca -0.09 -1.14 0.06 0.00 0.70 0.00 0.00 55.95 55.47 2wv0 s SER 146 Cb -0.14 -1.51 -0.01 0.00 -1.71 0.00 0.00 66.02 62.65 2wv0 s SER 146 CO 0.03 -0.13 -0.23 -0.94 1.20 0.00 0.00 173.24 173.17 2wv0 s SER 147 N 1.17 2.84 -0.24 5.45 1.04 0.23 -1.35 113.70 122.85 2wv0 s SER 147 Ca -0.04 -0.47 -0.08 0.00 0.48 0.00 0.00 55.95 55.84 2wv0 s SER 147 Cb -0.18 -0.74 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 2wv0 s SER 147 CO -0.08 0.23 0.09 -1.00 0.98 0.00 0.00 173.24 173.47 2wv0 s HIS 148 N -0.16 3.16 -0.08 5.02 3.76 0.46 -1.00 115.29 126.45 2wv0 s HIS 148 Ca -0.02 -0.16 -0.01 0.00 -0.15 0.00 0.00 55.06 54.71 2wv0 s HIS 148 Cb -0.13 -2.22 0.03 0.00 1.11 0.00 0.00 32.58 31.37 2wv0 s HIS 148 CO 0.03 -0.17 -0.00 0.42 -0.85 0.00 0.00 174.74 174.16 2wv0 s ILE 149 N 1.30 0.44 0.30 0.60 1.01 -0.54 -1.66 121.20 122.63 2wv0 s ILE 149 Ca 0.05 0.07 -0.30 0.00 0.00 0.00 0.00 60.65 60.47 2wv0 s ILE 149 Cb -0.15 -0.59 -0.12 0.00 0.01 0.00 0.00 42.46 41.61 2wv0 s ILE 149 CO 0.04 0.25 1.43 -2.65 0.00 0.00 0.00 174.94 174.01 2wv0 n PRO 150 N 5.13 2.29 -0.16 2.79 -0.02 -1.26 0.12 135.00 143.89 2wv0 n PRO 150 Ca -0.08 0.81 -0.03 0.00 -2.02 0.00 0.00 63.50 62.18 2wv0 n PRO 150 Cb 0.50 -2.48 0.06 0.00 -0.02 0.00 0.00 33.50 31.56 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 3.73 0.29 -0.00 6.00 3.57 -1.07 -2.59 116.94 126.86 2wv0 h PHE 151 Ca -0.46 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2wv0 h PHE 151 Cb 1.26 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.94 2wv0 h PHE 151 CO 0.55 0.09 0.00 1.05 -2.23 0.00 0.00 178.31 177.77 2wv0 h GLU 152 N 0.34 0.00 -0.03 1.11 4.11 -1.91 0.42 114.58 118.62 2wv0 h GLU 152 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.66 2wv0 h GLU 152 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2wv0 h GLU 152 CO -0.25 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.11 2wv0 n LEU 153 N -4.20 0.73 0.00 3.06 4.77 -0.98 -4.44 117.00 115.94 2wv0 n LEU 153 Ca -0.03 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 2wv0 n LEU 153 Cb 0.09 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2wv0 n LEU 153 CO 0.31 0.13 -0.09 0.00 -1.33 0.00 0.00 177.39 176.41 2wv0 n ALA 154 N -0.39 1.21 -0.26 -1.18 0.00 -0.09 -4.81 120.51 114.99 2wv0 n ALA 154 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2wv0 n ALA 154 Cb 0.21 0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.71 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 0.97 -0.77 3.72 0.00 0.00 0.13 -4.80 105.19 104.44 2wv0 n GLY 155 Ca 0.00 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 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 4.38 -0.06 1.61 2.02 -1.26 -4.94 118.70 120.46 2wv0 s GLU 156 Ca 0.00 1.95 0.03 0.00 0.02 0.00 0.00 54.97 56.97 2wv0 s GLU 156 Cb 0.00 -3.27 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 2wv0 s GLU 156 CO 0.00 -0.31 -0.12 -0.51 0.02 0.00 0.00 175.26 174.33 2wv0 s LEU 157 N 0.77 2.85 0.00 1.80 1.43 -1.26 -5.09 118.68 119.17 2wv0 s LEU 157 Ca 0.60 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.57 2wv0 s LEU 157 Cb -0.34 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 2wv0 s LEU 157 CO 0.32 0.35 0.07 -0.46 0.23 0.00 0.00 176.35 176.85 2wv0 n ASN 158 N 2.32 0.81 -0.28 2.29 0.23 -1.26 -5.03 115.26 114.35 2wv0 n ASN 158 Ca -0.17 -1.89 0.10 0.00 -0.53 0.00 0.00 54.58 52.09 2wv0 n ASN 158 Cb 0.52 0.47 0.34 0.00 -2.08 0.00 0.00 39.78 39.03 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 0.75 -0.68 -3.83 4.57 -2.00 -1.50 114.58 111.90 2wv0 h GLU 159 Ca -0.12 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.00 2wv0 h GLU 159 Cb 0.50 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 2wv0 h GLU 159 CO 0.19 0.50 0.37 0.66 -1.18 0.00 0.00 179.01 179.55 2wv0 h SER 160 N 0.78 0.83 -0.14 1.04 4.64 -1.98 -1.37 113.55 117.35 2wv0 h SER 160 Ca 0.44 -0.06 -0.05 0.00 -0.47 0.00 0.00 61.79 61.65 2wv0 h SER 160 Cb 0.59 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2wv0 h SER 160 CO -0.20 0.67 -0.09 0.45 -0.87 0.00 0.00 176.83 176.79 2wv0 h HIS 161 N 0.94 0.36 -0.49 4.77 3.86 -1.68 -3.25 115.15 119.68 2wv0 h HIS 161 Ca 0.24 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 2wv0 h HIS 161 Cb 0.02 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.39 2wv0 h HIS 161 CO 0.01 0.66 0.31 0.74 0.86 0.00 0.00 177.93 180.51 2wv0 h PHE 162 N -0.04 0.62 -0.12 2.45 0.04 -1.04 -2.22 116.94 116.64 2wv0 h PHE 162 Ca 0.03 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.81 2wv0 h PHE 162 Cb 0.58 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.52 2wv0 h PHE 162 CO 0.07 0.40 0.00 1.04 -0.60 0.00 0.00 178.31 179.22 2wv0 n GLN 163 N -4.45 1.65 -0.85 1.51 6.02 -0.54 -4.69 117.38 116.02 2wv0 n GLN 163 Ca 0.04 -0.97 0.00 0.00 -0.01 0.00 0.00 57.00 56.06 2wv0 n GLN 163 Cb 0.06 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 29.91 2wv0 n GLN 163 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2wv0 n SER 164 N 0.19 1.00 -4.65 1.08 3.41 -0.83 -4.41 113.62 109.40 2wv0 n SER 164 Ca 0.17 -0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 57.92 2wv0 n SER 164 Cb 0.31 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 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 0.15 7.03 0.18 4.04 0.15 -1.26 -4.94 113.70 119.05 2wv0 s SER 165 Ca 0.00 1.24 -0.08 0.00 0.70 0.00 0.00 55.95 57.82 2wv0 s SER 165 Cb 0.00 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 61.85 2wv0 s SER 165 CO 0.00 -0.74 1.57 0.40 1.20 0.00 0.00 173.24 175.67 2wv0 h ILE 166 N 5.55 1.27 -0.59 6.45 2.04 -1.94 -2.80 117.51 127.49 2wv0 h ILE 166 Ca -0.20 -1.41 0.12 0.00 1.00 0.00 0.00 64.86 64.38 2wv0 h ILE 166 Cb 1.06 1.21 -0.09 0.00 -0.74 0.00 0.00 36.82 38.26 2wv0 h ILE 166 CO 1.00 0.48 0.06 1.88 0.00 0.00 0.00 178.15 181.56 2wv0 h TYR 167 N 0.76 0.07 -0.47 1.37 0.99 -1.98 -0.84 116.97 116.86 2wv0 h TYR 167 Ca 0.09 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.86 2wv0 h TYR 167 Cb 0.81 0.06 -0.02 0.00 1.00 0.00 0.00 36.73 38.58 2wv0 h TYR 167 CO 0.05 -0.10 0.27 -0.44 -0.00 0.00 0.00 178.16 177.93 2wv0 h ASP 168 N 0.17 0.58 -0.39 3.88 3.45 -1.94 -2.20 116.42 119.98 2wv0 h ASP 168 Ca 0.31 -0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.72 2wv0 h ASP 168 Cb 0.49 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 39.08 2wv0 h ASP 168 CO -0.46 0.49 0.20 -0.74 -1.57 0.00 0.00 179.24 177.16 2wv0 h HIS 169 N 0.63 0.37 0.04 4.55 2.76 -1.20 -1.05 115.15 121.25 2wv0 h HIS 169 Ca 0.17 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.38 2wv0 h HIS 169 Cb 0.03 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 28.84 2wv0 h HIS 169 CO -0.02 0.20 -0.24 0.82 -1.30 0.00 0.00 177.93 177.38 2wv0 h ILE 170 N 0.40 0.46 -0.88 6.26 1.08 -0.94 0.39 117.51 124.28 2wv0 h ILE 170 Ca 0.16 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.67 2wv0 h ILE 170 Cb 0.06 0.46 -0.05 0.00 -3.07 0.00 0.00 36.82 34.22 2wv0 h ILE 170 CO -0.11 0.00 0.57 -0.33 -0.69 0.00 0.00 178.15 177.59 2wv0 h GLU 171 N -0.39 1.05 -0.14 2.37 5.08 -1.27 -1.26 114.58 120.02 2wv0 h GLU 171 Ca 0.05 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2wv0 h GLU 171 Cb 0.46 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2wv0 h GLU 171 CO -0.19 0.70 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.39 2wv0 h ARG 172 N 1.08 0.27 -0.17 2.33 9.65 -0.90 -1.54 114.38 125.09 2wv0 h ARG 172 Ca 0.36 -0.10 -0.10 0.00 -1.10 0.00 0.00 59.98 59.03 2wv0 h ARG 172 Cb 0.04 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 2wv0 h ARG 172 CO -0.13 0.56 -0.34 -0.92 2.80 0.00 0.00 179.97 181.94 2wv0 h TYR 173 N -0.05 0.41 0.00 2.20 5.03 0.12 -3.23 116.97 121.45 2wv0 h TYR 173 Ca 0.03 -0.10 0.00 0.00 2.58 0.00 0.00 58.73 61.24 2wv0 h TYR 173 Cb 0.46 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.65 2wv0 h TYR 173 CO 0.05 0.66 -1.72 0.09 -1.32 0.00 0.00 178.16 175.93 2wv0 n ASN 174 N -4.07 0.27 -3.73 -2.11 3.02 -0.51 -4.99 115.26 103.15 2wv0 n ASN 174 Ca -0.01 -0.22 -0.28 0.00 -0.03 0.00 0.00 54.58 54.03 2wv0 n ASN 174 Cb 0.45 1.70 0.02 0.00 -0.61 0.00 0.00 39.78 41.34 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 -2.09 -4.85 -3.93 6.41 7.64 -0.58 -5.01 113.62 111.20 2wv0 n SER 175 Ca -0.02 -0.66 -0.20 0.00 1.01 0.00 0.00 58.87 59.01 2wv0 n SER 175 Cb 0.51 -3.89 -0.16 0.00 -1.01 0.00 0.00 64.21 59.66 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 -3.22 0.59 0.68 0.44 1.01 -1.22 -5.08 121.20 114.40 2wv0 s ILE 176 Ca 0.59 -0.20 -0.15 0.00 0.00 0.00 0.00 60.65 60.89 2wv0 s ILE 176 Cb -0.29 -0.58 0.01 0.00 0.01 0.00 0.00 42.46 41.61 2wv0 s ILE 176 CO 0.72 0.22 1.13 -2.84 0.00 0.00 0.00 174.94 174.18 2wv0 s PRO 177 N 0.59 2.59 0.42 2.79 0.02 -1.26 -4.41 135.00 135.74 2wv0 s PRO 177 Ca -0.08 1.48 -0.24 0.00 0.02 0.00 0.00 61.00 62.19 2wv0 s PRO 177 Cb -0.12 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 32.40 2wv0 s PRO 177 CO 0.00 -1.43 1.09 0.42 -0.33 0.00 0.00 177.00 176.75 2wv0 s ILE 178 N -2.26 3.51 0.00 2.83 1.01 -1.26 -1.33 121.20 123.70 2wv0 s ILE 178 Ca 0.69 1.14 0.00 0.00 0.00 0.00 0.00 60.65 62.48 2wv0 s ILE 178 Cb -0.23 -3.58 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2wv0 s ILE 178 CO 0.43 -0.00 0.00 -1.20 0.00 0.00 0.00 174.94 174.16 2wv0 n SER 179 N -0.23 1.94 -3.47 3.58 7.64 -0.44 -4.73 113.62 117.91 2wv0 n SER 179 Ca 0.06 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.83 2wv0 n SER 179 Cb 0.49 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.67 2wv0 n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wv0 s ARG 180 N -1.90 1.29 0.03 1.43 1.70 -1.22 -5.00 118.95 115.28 2wv0 s ARG 180 Ca 0.00 -0.51 -0.02 0.00 -0.47 0.00 0.00 55.73 54.74 2wv0 s ARG 180 Cb 0.00 0.57 -0.02 0.00 -0.57 0.00 0.00 34.95 34.93 2wv0 s ARG 180 CO 0.00 -0.57 0.00 0.00 -1.08 0.00 0.00 175.30 173.65 2wv0 s ALA 181 N -3.71 0.13 -0.23 7.88 0.00 -1.26 -0.46 121.76 124.11 2wv0 s ALA 181 Ca 0.02 -0.66 -0.07 0.00 0.00 0.00 0.00 51.96 51.25 2wv0 s ALA 181 Cb -0.01 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 2wv0 s ALA 181 CO -0.11 -0.22 0.06 0.21 0.00 0.00 0.00 175.76 175.70 2wv0 s LYS 182 N -2.06 3.73 -0.04 0.00 2.20 0.11 -4.97 119.74 118.70 2wv0 s LYS 182 Ca -0.10 -0.45 0.06 0.00 -0.36 0.00 0.00 55.97 55.12 2wv0 s LYS 182 Cb -0.05 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.98 2wv0 s LYS 182 CO -0.03 -0.06 -0.23 -1.14 -0.36 0.00 0.00 175.35 173.53 2wv0 s GLN 183 N 1.25 2.19 -0.10 4.03 0.74 -1.26 -1.06 119.66 125.45 2wv0 s GLN 183 Ca 0.05 -0.84 0.04 0.00 0.05 0.00 0.00 55.36 54.66 2wv0 s GLN 183 Cb -0.15 -1.95 -0.00 0.00 1.10 0.00 0.00 33.01 32.02 2wv0 s GLN 183 CO 0.03 0.41 -0.24 -1.21 -0.55 0.00 0.00 175.29 173.73 2wv0 s GLU 184 N -0.28 2.98 -0.03 1.67 2.02 0.31 -4.99 118.70 120.38 2wv0 s GLU 184 Ca 0.01 -0.87 0.06 0.00 0.02 0.00 0.00 54.97 54.19 2wv0 s GLU 184 Cb -0.12 -2.27 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 2wv0 s GLU 184 CO 0.02 0.19 -0.22 -0.51 0.02 0.00 0.00 175.26 174.76 2wv0 s LEU 185 N 0.31 2.31 -0.11 1.80 1.02 -1.26 -0.85 118.68 121.90 2wv0 s LEU 185 Ca -0.18 -0.37 -0.09 0.00 0.02 0.00 0.00 54.13 53.50 2wv0 s LEU 185 Cb -0.18 -1.42 0.03 0.00 0.02 0.00 0.00 46.19 44.65 2wv0 s LEU 185 CO 0.08 0.33 0.30 -0.70 0.02 0.00 0.00 176.35 176.38 2wv0 s GLU 186 N -0.69 0.33 0.40 1.70 2.12 0.23 -4.99 118.70 117.81 2wv0 s GLU 186 Ca 0.11 0.46 -0.17 0.00 0.36 0.00 0.00 54.97 55.72 2wv0 s GLU 186 Cb -0.10 0.11 -0.09 0.00 0.26 0.00 0.00 34.13 34.30 2wv0 s GLU 186 CO -0.00 -0.07 0.87 -1.25 -0.54 0.00 0.00 175.26 174.27 2wv0 s PRO 187 N 0.43 4.07 0.12 4.30 0.04 -1.26 0.43 135.00 143.13 2wv0 s PRO 187 Ca -0.02 0.89 -0.04 0.00 0.04 0.00 0.00 61.00 61.87 2wv0 s PRO 187 Cb -0.04 -2.27 0.01 0.00 0.04 0.00 0.00 34.50 32.24 2wv0 s PRO 187 CO -0.02 -0.00 0.23 0.45 0.04 0.00 0.00 177.00 177.69 2wv0 n SER 188 N -0.74 -0.65 -4.30 6.66 2.88 0.10 -4.85 113.62 112.73 2wv0 n SER 188 Ca 0.05 -1.52 -0.32 0.00 -1.33 0.00 0.00 58.87 55.75 2wv0 n SER 188 Cb 0.54 1.11 -0.16 0.00 -0.75 0.00 0.00 64.21 64.95 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 -1.49 2.26 0.15 -1.46 0.00 -1.26 -1.39 121.76 118.58 2wv0 s ALA 189 Ca 0.06 -1.02 -0.31 0.00 0.00 0.00 0.00 51.96 50.68 2wv0 s ALA 189 Cb -0.01 -0.76 -0.11 0.00 0.00 0.00 0.00 23.12 22.24 2wv0 s ALA 189 CO 0.04 0.41 1.75 0.00 0.00 0.00 0.00 175.76 177.97 2wv0 s ALA 190 N -0.16 3.82 0.88 0.00 0.00 0.23 -4.78 121.76 121.75 2wv0 s ALA 190 Ca -0.03 1.47 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 2wv0 s ALA 190 Cb -0.14 -3.72 0.12 0.00 0.00 0.00 0.00 23.12 19.38 2wv0 s ALA 190 CO 0.04 -1.07 1.10 0.95 0.00 0.00 0.00 175.76 176.78 2wv0 s THR 191 N 2.04 2.69 0.17 0.00 -4.23 -1.26 -0.59 115.64 114.46 2wv0 s THR 191 Ca 0.77 0.22 -0.23 0.00 -1.18 0.00 0.00 61.69 61.27 2wv0 s THR 191 Cb -0.47 -2.54 0.07 0.00 1.34 0.00 0.00 72.50 70.91 2wv0 s THR 191 CO 0.34 -0.29 1.58 0.74 -0.54 0.00 0.00 174.62 176.45 2wv0 h THR 192 N -1.57 0.14 0.00 3.99 2.02 -1.97 -0.61 112.91 114.91 2wv0 h THR 192 Ca -0.46 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 2wv0 h THR 192 Cb 1.26 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 2wv0 h THR 192 CO 0.49 0.00 -0.02 1.05 0.37 0.00 0.00 175.52 177.41 2wv0 h GLU 193 N -0.21 0.00 -0.24 6.66 9.09 -1.99 -1.57 114.58 126.31 2wv0 h GLU 193 Ca 0.20 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.42 2wv0 h GLU 193 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 2wv0 h GLU 193 CO -0.65 0.02 -0.59 0.93 0.05 0.00 0.00 179.01 178.77 2wv0 h GLU 194 N 0.00 0.82 -0.17 1.06 5.08 -1.81 -2.91 114.58 116.65 2wv0 h GLU 194 Ca -0.00 -0.56 -0.01 0.00 -1.00 0.00 0.00 59.36 57.79 2wv0 h GLU 194 Cb 0.97 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2wv0 h GLU 194 CO 0.00 1.19 0.06 0.00 -1.00 0.00 0.00 179.01 179.26 2wv0 h ALA 195 N 0.63 0.22 -0.41 3.43 0.00 -0.90 -1.60 119.26 120.63 2wv0 h ALA 195 Ca -0.01 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2wv0 h ALA 195 Cb 1.20 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 2wv0 h ALA 195 CO 0.13 -0.17 0.10 -0.91 0.00 0.00 0.00 179.25 178.40 2wv0 h ASN 196 N 0.11 0.05 -0.45 0.00 2.35 -1.36 0.20 115.58 116.48 2wv0 h ASN 196 Ca 0.06 0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.76 2wv0 h ASN 196 Cb 0.20 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2wv0 h ASN 196 CO -0.00 0.06 -0.13 0.40 -1.65 0.00 0.00 177.43 176.11 2wv0 h ILE 197 N 0.24 1.27 0.00 2.81 2.04 -1.47 -3.06 117.51 119.34 2wv0 h ILE 197 Ca 0.20 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.80 2wv0 h ILE 197 Cb 0.22 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2wv0 h ILE 197 CO -0.24 0.43 -0.17 0.18 0.00 0.00 0.00 178.15 178.34 2wv0 n LEU 198 N -4.24 0.48 -1.05 1.44 4.77 -0.61 -4.90 117.00 112.89 2wv0 n LEU 198 Ca -0.00 0.41 -0.06 0.00 -0.03 0.00 0.00 56.01 56.33 2wv0 n LEU 198 Cb 0.40 -0.35 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2wv0 n LEU 198 CO 0.44 -0.06 0.02 0.61 -1.33 0.00 0.00 177.39 177.07 2wv0 n GLY 199 N 1.40 0.41 3.56 -0.72 0.00 0.59 -4.67 105.19 105.78 2wv0 n GLY 199 Ca 0.06 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.79 1.72 0.38 -0.61 -4.36 -0.57 -5.04 121.20 109.94 2wv0 s ILE 200 Ca 0.10 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.23 2wv0 s ILE 200 Cb -0.04 -2.93 -0.09 0.00 1.25 0.00 0.00 42.46 40.65 2wv0 s ILE 200 CO 0.12 -0.00 1.14 -1.10 0.24 0.00 0.00 174.94 175.34 2wv0 s GLN 201 N -3.77 4.15 0.16 0.37 -1.52 -1.26 -4.30 119.66 113.48 2wv0 s GLN 201 Ca 0.36 1.79 -0.34 0.00 -1.95 0.00 0.00 55.36 55.21 2wv0 s GLN 201 Cb 0.10 -2.72 -0.15 0.00 -0.22 0.00 0.00 33.01 30.01 2wv0 s GLN 201 CO 0.17 -0.22 1.35 1.17 -0.25 0.00 0.00 175.29 177.51 2wv0 n LYS 202 N 0.20 1.53 -0.79 2.91 4.81 -1.26 -1.89 118.16 123.67 2wv0 n LYS 202 Ca 0.04 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 2wv0 n LYS 202 Cb 0.47 -2.18 0.00 0.00 0.02 0.00 0.00 35.03 33.34 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 2.48 0.77 3.78 3.14 0.00 0.24 -4.93 105.19 110.67 2wv0 n GLY 203 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.92 2.55 0.38 4.61 0.00 -0.79 -4.22 121.76 121.37 2wv0 s ALA 204 Ca 0.00 0.50 -0.27 0.00 0.00 0.00 0.00 51.96 52.19 2wv0 s ALA 204 Cb 0.00 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 2wv0 s ALA 204 CO 0.00 -1.14 1.33 -2.14 0.00 0.00 0.00 175.76 173.81 2wv0 s PRO 205 N -4.09 4.12 -0.19 0.00 0.02 -1.26 -0.60 135.00 133.01 2wv0 s PRO 205 Ca 0.66 2.24 -0.14 0.00 0.02 0.00 0.00 61.00 63.78 2wv0 s PRO 205 Cb -0.19 -2.90 0.05 0.00 0.02 0.00 0.00 34.50 31.48 2wv0 s PRO 205 CO 0.40 -0.39 0.48 0.54 -0.33 0.00 0.00 177.00 177.70 2wv0 s VAL 206 N -1.20 -0.01 -0.25 3.83 0.11 -0.49 -1.31 120.40 121.09 2wv0 s VAL 206 Ca 0.53 0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 59.48 2wv0 s VAL 206 Cb -0.40 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 33.73 2wv0 s VAL 206 CO 0.52 0.01 0.32 -0.76 -3.33 0.00 0.00 175.10 171.86 2wv0 s LEU 207 N 0.78 4.08 -0.30 2.54 1.43 -0.44 0.02 118.68 126.79 2wv0 s LEU 207 Ca -0.04 0.28 -0.23 0.00 -1.03 0.00 0.00 54.13 53.11 2wv0 s LEU 207 Cb -0.05 -2.35 -0.00 0.00 0.03 0.00 0.00 46.19 43.81 2wv0 s LEU 207 CO -0.06 -0.10 0.75 -0.76 0.23 0.00 0.00 176.35 176.42 2wv0 s LEU 208 N 1.66 4.10 -0.20 1.79 1.02 0.17 -0.81 118.68 126.40 2wv0 s LEU 208 Ca 0.14 0.65 0.01 0.00 0.02 0.00 0.00 54.13 54.95 2wv0 s LEU 208 Cb -0.15 -3.02 0.02 0.00 0.02 0.00 0.00 46.19 43.06 2wv0 s LEU 208 CO 0.09 -0.57 -0.16 -0.63 0.02 0.00 0.00 176.35 175.10 2wv0 s ILE 209 N 2.86 2.26 -0.19 -0.59 1.01 -0.79 -0.60 121.20 125.16 2wv0 s ILE 209 Ca 0.31 -1.00 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 2wv0 s ILE 209 Cb -0.14 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 2wv0 s ILE 209 CO 0.12 0.42 -0.02 -0.75 0.00 0.00 0.00 174.94 174.71 2wv0 s LYS 210 N 1.28 3.59 -0.04 2.79 2.20 -0.03 -0.29 119.74 129.25 2wv0 s LYS 210 Ca 0.03 -0.54 0.01 0.00 -0.36 0.00 0.00 55.97 55.11 2wv0 s LYS 210 Cb -0.14 -3.02 0.02 0.00 -1.51 0.00 0.00 37.83 33.18 2wv0 s LYS 210 CO -0.10 0.05 -0.04 0.50 -0.36 0.00 0.00 175.35 175.40 2wv0 s ARG 211 N 0.88 0.76 -0.25 4.03 3.52 0.77 -0.53 118.95 128.13 2wv0 s ARG 211 Ca 0.00 -0.09 -0.04 0.00 -0.13 0.00 0.00 55.73 55.47 2wv0 s ARG 211 Cb -0.14 -0.78 0.01 0.00 -1.56 0.00 0.00 34.95 32.48 2wv0 s ARG 211 CO 0.02 -0.07 -0.02 0.99 -0.81 0.00 0.00 175.30 175.40 2wv0 s THR 212 N 0.86 3.33 0.03 4.11 2.01 -0.23 -0.12 115.64 125.62 2wv0 s THR 212 Ca -0.11 -0.73 0.04 0.00 0.31 0.00 0.00 61.69 61.19 2wv0 s THR 212 Cb -0.14 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 2wv0 s THR 212 CO 0.00 0.26 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.26 2wv0 s THR 213 N 1.43 3.79 0.10 -0.82 2.01 -0.36 -0.71 115.64 121.07 2wv0 s THR 213 Ca 0.03 -0.84 0.08 0.00 0.31 0.00 0.00 61.69 61.28 2wv0 s THR 213 Cb -0.16 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.62 2wv0 s THR 213 CO -0.02 0.31 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.69 2wv0 s TYR 214 N -1.10 1.79 0.80 4.92 2.02 0.40 -1.56 117.35 124.62 2wv0 s TYR 214 Ca 0.20 -0.41 -0.10 0.00 -0.37 0.00 0.00 57.07 56.38 2wv0 s TYR 214 Cb -0.11 -0.99 0.11 0.00 -0.40 0.00 0.00 41.96 40.57 2wv0 s TYR 214 CO 0.11 0.20 1.14 -0.51 -1.57 0.00 0.00 175.55 174.91 2wv0 s LEU 215 N -1.84 2.72 0.41 -1.29 1.43 -0.20 -1.33 118.68 118.57 2wv0 s LEU 215 Ca 0.06 0.41 0.13 0.00 -1.03 0.00 0.00 54.13 53.71 2wv0 s LEU 215 Cb -0.10 -2.83 0.96 0.00 0.03 0.00 0.00 46.19 44.25 2wv0 s LEU 215 CO 0.04 -2.00 1.93 1.56 0.23 0.00 0.00 176.35 178.10 2wv0 h GLN 216 N -0.99 0.50 -0.70 1.70 4.20 -1.49 -2.27 115.11 116.06 2wv0 h GLN 216 Ca -0.44 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2wv0 h GLN 216 Cb 1.29 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.96 2wv0 h GLN 216 CO 0.54 0.33 0.00 0.27 -0.67 0.00 0.00 178.83 179.30 2wv0 n ASN 217 N -4.49 1.09 0.00 1.46 0.23 -1.26 -4.86 115.26 107.43 2wv0 n ASN 217 Ca 0.14 -2.06 0.00 0.00 -0.53 0.00 0.00 54.58 52.13 2wv0 n ASN 217 Cb 0.45 -0.38 0.00 0.00 -2.08 0.00 0.00 39.78 37.77 2wv0 n ASN 217 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wv0 n GLY 218 N 0.21 1.16 3.69 4.83 0.00 -0.85 -4.99 105.19 109.25 2wv0 n GLY 218 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.88 4.52 0.10 2.61 2.01 -1.26 -4.80 115.64 115.94 2wv0 s THR 219 Ca 0.00 1.81 -0.31 0.00 0.31 0.00 0.00 61.69 63.51 2wv0 s THR 219 Cb 0.00 -4.17 -0.07 0.00 0.01 0.00 0.00 72.50 68.28 2wv0 s THR 219 CO 0.00 -0.00 1.23 0.00 -0.69 0.00 0.00 174.62 175.16 2wv0 s ALA 220 N 2.15 3.44 -0.01 7.40 0.00 -1.26 -1.03 121.76 132.45 2wv0 s ALA 220 Ca 0.52 0.93 0.04 0.00 0.00 0.00 0.00 51.96 53.45 2wv0 s ALA 220 Cb -0.21 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 2wv0 s ALA 220 CO 0.20 -0.45 0.09 1.97 0.00 0.00 0.00 175.76 177.56 2wv0 n PHE 221 N 3.57 0.00 -3.80 0.00 -1.74 -0.60 -4.90 117.46 109.99 2wv0 n PHE 221 Ca 0.08 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.83 2wv0 n PHE 221 Cb 0.45 -0.12 -0.15 0.00 1.52 0.00 0.00 39.48 41.18 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 -2.28 -0.01 -0.18 3.97 2.12 -1.21 -4.18 118.70 116.92 2wv0 s GLU 222 Ca -0.02 0.15 -0.02 0.00 0.36 0.00 0.00 54.97 55.45 2wv0 s GLU 222 Cb 0.03 -0.17 -0.00 0.00 0.26 0.00 0.00 34.13 34.25 2wv0 s GLU 222 CO 0.18 -0.12 -0.10 -1.58 -0.54 0.00 0.00 175.26 173.10 2wv0 s HIS 223 N 0.76 2.87 -0.03 5.30 5.65 -0.67 -1.22 115.29 127.96 2wv0 s HIS 223 Ca -0.06 -0.99 0.04 0.00 0.25 0.00 0.00 55.06 54.30 2wv0 s HIS 223 Cb -0.09 -1.98 -0.01 0.00 -1.18 0.00 0.00 32.58 29.32 2wv0 s HIS 223 CO -0.02 -0.49 -0.16 0.00 -0.65 0.00 0.00 174.74 173.42 2wv0 s ALA 224 N 1.07 1.38 -0.16 1.58 0.00 0.83 -0.40 121.76 126.05 2wv0 s ALA 224 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.32 2wv0 s ALA 224 Cb -0.15 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.54 2wv0 s ALA 224 CO -0.02 0.27 -0.15 0.15 0.00 0.00 0.00 175.76 176.01 2wv0 s LYS 225 N -0.06 3.20 0.18 0.00 1.02 -0.46 -0.17 119.74 123.46 2wv0 s LYS 225 Ca -0.01 -0.75 0.07 0.00 0.02 0.00 0.00 55.97 55.30 2wv0 s LYS 225 Cb -0.10 -2.65 -0.05 0.00 -0.52 0.00 0.00 37.83 34.52 2wv0 s LYS 225 CO 0.01 -0.03 -0.13 -1.12 -0.92 0.00 0.00 175.35 173.16 2wv0 s SER 226 N 0.93 2.32 -0.18 2.83 0.01 0.60 -0.95 113.70 119.26 2wv0 s SER 226 Ca -0.03 -1.00 0.00 0.00 1.31 0.00 0.00 55.95 56.23 2wv0 s SER 226 Cb -0.15 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.03 2wv0 s SER 226 CO -0.02 -0.21 -0.07 -0.69 0.41 0.00 0.00 173.24 172.67 2wv0 s VAL 227 N -2.97 1.32 -0.00 3.43 1.01 -0.18 -1.89 120.40 121.12 2wv0 s VAL 227 Ca 0.20 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2wv0 s VAL 227 Cb -0.00 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 2wv0 s VAL 227 CO 0.05 0.12 0.10 -0.31 0.00 0.00 0.00 175.10 175.05 2wv0 s TYR 228 N 1.53 3.34 0.08 5.22 2.02 0.01 -1.21 117.35 128.34 2wv0 s TYR 228 Ca -0.01 0.23 -0.31 0.00 -0.37 0.00 0.00 57.07 56.62 2wv0 s TYR 228 Cb -0.16 -1.75 -0.08 0.00 -0.40 0.00 0.00 41.96 39.57 2wv0 s TYR 228 CO -0.08 0.57 1.47 1.03 -1.57 0.00 0.00 175.55 176.97 2wv0 s ARG 229 N -1.80 4.27 0.12 -0.62 0.52 -0.48 -1.32 118.95 119.65 2wv0 s ARG 229 Ca 0.24 2.13 0.21 0.00 -0.52 0.00 0.00 55.73 57.79 2wv0 s ARG 229 Cb -0.12 -3.40 0.84 0.00 0.52 0.00 0.00 34.95 32.79 2wv0 s ARG 229 CO 0.15 -0.56 1.64 0.41 0.02 0.00 0.00 175.30 176.96 2wv0 n GLY 230 N 3.67 -1.22 0.11 -3.53 0.00 -0.43 -1.69 105.19 102.09 2wv0 n GLY 230 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.25 2wv0 n GLY 230 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wv0 n ASP 231 N -1.87 0.83 -0.00 1.61 5.75 -1.26 -4.42 116.55 117.18 2wv0 n ASP 231 Ca 0.03 0.33 0.03 0.00 -0.01 0.00 0.00 54.79 55.17 2wv0 n ASP 231 Cb 0.23 0.44 -0.04 0.00 -1.03 0.00 0.00 41.12 40.73 2wv0 n ASP 231 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wv0 n ARG 232 N -2.70 2.46 -5.05 0.11 1.74 -1.14 -5.04 116.66 107.04 2wv0 n ARG 232 Ca -0.02 -0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.73 2wv0 n ARG 232 Cb 0.60 -0.96 -0.17 0.00 -1.02 0.00 0.00 32.46 30.91 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 -1.99 2.35 -0.09 -1.55 6.14 -0.68 -5.06 117.35 116.47 2wv0 s TYR 233 Ca -0.00 -0.97 0.02 0.00 0.64 0.00 0.00 57.07 56.76 2wv0 s TYR 233 Cb 0.04 -1.59 0.01 0.00 0.42 0.00 0.00 41.96 40.84 2wv0 s TYR 233 CO 0.23 -0.41 -0.14 0.99 0.64 0.00 0.00 175.55 176.87 2wv0 s THR 234 N 0.44 1.33 -0.14 4.34 2.01 -1.26 -4.72 115.64 117.63 2wv0 s THR 234 Ca -0.17 -0.56 -0.27 0.00 0.31 0.00 0.00 61.69 61.00 2wv0 s THR 234 Cb -0.17 -1.22 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 2wv0 s THR 234 CO 0.07 0.40 0.90 0.12 -0.69 0.00 0.00 174.62 175.43 2wv0 s PHE 235 N 0.87 3.46 -0.07 4.92 2.19 -1.26 -5.05 117.98 123.04 2wv0 s PHE 235 Ca -0.10 1.39 0.02 0.00 0.33 0.00 0.00 56.93 58.57 2wv0 s PHE 235 Cb -0.15 -3.08 0.01 0.00 -1.31 0.00 0.00 43.02 38.49 2wv0 s PHE 235 CO 0.01 -0.23 -0.13 0.08 1.83 0.00 0.00 175.22 176.77 2wv0 s VAL 236 N 2.10 1.22 -0.09 3.12 1.01 -1.26 -5.14 120.40 121.36 2wv0 s VAL 236 Ca 0.42 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2wv0 s VAL 236 Cb -0.17 -1.11 0.07 0.00 0.00 0.00 0.00 36.38 35.17 2wv0 s VAL 236 CO 0.14 0.37 0.69 -2.28 0.00 0.00 0.00 175.10 174.02 2wv0 s HIS 237 N 0.63 -0.68 -0.03 5.22 5.04 -1.26 -4.65 115.29 119.56 2wv0 s HIS 237 Ca -0.15 1.27 -0.15 0.00 -1.54 0.00 0.00 55.06 54.49 2wv0 s HIS 237 Cb -0.16 0.38 -0.05 0.00 0.04 0.00 0.00 32.58 32.79 2wv0 s HIS 237 CO 0.04 -0.57 0.41 0.71 -2.34 0.00 0.00 174.74 173.00 2wv0 s TYR 238 N -0.91 3.67 -0.10 3.88 2.02 -0.06 -5.05 117.35 120.80 2wv0 s TYR 238 Ca -0.09 0.94 0.04 0.00 -0.37 0.00 0.00 57.07 57.59 2wv0 s TYR 238 Cb -0.01 -2.34 0.00 0.00 -0.40 0.00 0.00 41.96 39.21 2wv0 s TYR 238 CO 0.08 0.52 -0.23 -1.64 -1.57 0.00 0.00 175.55 172.71 2wv0 s MET 239 N -0.64 3.00 -0.15 -0.62 -1.94 -1.26 -4.85 119.30 112.85 2wv0 s MET 239 Ca 0.24 -0.86 -0.06 0.00 -1.71 0.00 0.00 55.69 53.30 2wv0 s MET 239 Cb -0.16 -2.27 -0.04 0.00 2.01 0.00 0.00 34.83 34.37 2wv0 s MET 239 CO 0.12 0.17 0.05 -0.51 -0.01 0.00 0.00 175.02 174.84 2wv0 s ASP 240 N 0.37 5.58 0.03 3.03 1.01 -1.26 -5.08 116.67 120.35 2wv0 s ASP 240 Ca -0.18 0.14 -0.30 0.00 0.71 0.00 0.00 52.55 52.92 2wv0 s ASP 240 Cb -0.18 -1.84 -0.04 0.00 1.01 0.00 0.00 42.92 41.87 2wv0 s ASP 240 CO 0.08 0.26 1.13 -0.60 0.21 0.00 0.00 175.17 176.26 2wv0 s ARG 241 N -0.17 4.46 0.00 8.23 3.52 -1.26 -5.35 118.95 128.38 2wv0 s ARG 241 Ca 0.07 1.65 0.25 0.00 -0.13 0.00 0.00 55.73 57.57 2wv0 s ARG 241 Cb -0.12 -3.41 1.51 0.00 -1.56 0.00 0.00 34.95 31.37 2wv0 s ARG 241 CO 0.01 -0.22 1.87 1.28 -0.81 0.00 0.00 175.30 177.43