#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 -0.65 0.08 6.12 2.47 -1.26 -5.04 114.94 116.66 2wv0 s ASN 2 Ca 0.00 1.19 0.04 0.00 0.42 0.00 0.00 52.86 54.50 2wv0 s ASN 2 Cb 0.00 1.19 -0.04 0.00 -1.45 0.00 0.00 41.25 40.95 2wv0 s ASN 2 CO 0.00 -0.28 0.04 0.27 -3.72 0.00 0.00 177.10 173.42 2wv0 s ILE 3 N 0.11 4.31 -0.34 -5.21 -5.25 -1.26 -5.08 121.20 108.48 2wv0 s ILE 3 Ca -0.02 -0.85 -0.09 0.00 -0.99 0.00 0.00 60.65 58.71 2wv0 s ILE 3 Cb -0.04 -3.06 0.02 0.00 2.95 0.00 0.00 42.46 42.33 2wv0 s ILE 3 CO 0.02 0.13 0.14 0.20 -1.79 0.00 0.00 174.94 173.65 2wv0 s ASN 4 N -2.32 5.47 0.38 4.36 0.01 -1.26 -4.99 114.94 116.58 2wv0 s ASN 4 Ca 0.27 -0.92 0.19 0.00 -0.71 0.00 0.00 52.86 51.70 2wv0 s ASN 4 Cb -0.12 -1.95 0.68 0.00 0.41 0.00 0.00 41.25 40.27 2wv0 s ASN 4 CO 0.20 -0.30 1.73 0.11 -1.51 0.00 0.00 177.10 177.32 2wv0 h LYS 5 N 8.32 0.00 -0.05 -0.60 1.57 -1.99 -3.06 116.57 120.76 2wv0 h LYS 5 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2wv0 h LYS 5 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2wv0 h LYS 5 CO 0.63 0.35 0.00 1.04 -0.57 0.00 0.00 179.45 180.90 2wv0 n GLN 6 N -3.48 1.67 -2.60 3.15 1.13 -1.26 -4.88 117.38 111.11 2wv0 n GLN 6 Ca 0.00 -0.98 -0.41 0.00 -1.94 0.00 0.00 57.00 53.67 2wv0 n GLN 6 Cb 0.51 -1.46 -0.04 0.00 0.11 0.00 0.00 30.24 29.36 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 -1.90 7.37 0.00 1.08 0.15 -1.16 -4.93 113.70 114.32 2wv0 s SER 7 Ca 0.37 1.99 0.07 0.00 0.70 0.00 0.00 55.95 59.08 2wv0 s SER 7 Cb 0.20 -2.60 0.33 0.00 -1.71 0.00 0.00 66.02 62.25 2wv0 s SER 7 CO 0.32 -0.13 1.10 -0.81 1.20 0.00 0.00 173.24 174.91 2wv0 n PRO 8 N 2.38 0.08 -2.82 5.44 -0.04 -1.26 -4.56 135.00 134.21 2wv0 n PRO 8 Ca 0.02 0.25 -0.42 0.00 -0.04 0.00 0.00 63.50 63.31 2wv0 n PRO 8 Cb 0.47 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 2wv0 n PRO 8 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2wv0 s ILE 9 N -2.65 4.82 0.68 0.52 1.01 -1.26 -5.00 121.20 119.32 2wv0 s ILE 9 Ca 0.06 1.74 -0.17 0.00 0.00 0.00 0.00 60.65 62.28 2wv0 s ILE 9 Cb 0.05 -4.18 -0.00 0.00 0.01 0.00 0.00 42.46 38.33 2wv0 s ILE 9 CO 0.11 -0.04 1.15 -2.65 0.00 0.00 0.00 174.94 173.51 2wv0 n PRO 10 N 5.61 0.82 -0.02 2.79 -0.02 -1.26 -4.74 135.00 138.17 2wv0 n PRO 10 Ca 0.07 0.34 -0.11 0.00 -2.02 0.00 0.00 63.50 61.78 2wv0 n PRO 10 Cb 0.48 -2.39 -0.05 0.00 -0.02 0.00 0.00 33.50 31.52 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 0.15 1.05 -1.01 4.25 2.04 -1.91 -1.03 117.51 121.06 2wv0 h ILE 11 Ca -0.49 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.34 2wv0 h ILE 11 Cb 1.34 0.88 -0.07 0.00 -0.74 0.00 0.00 36.82 38.22 2wv0 h ILE 11 CO 0.50 0.05 0.65 0.10 0.00 0.00 0.00 178.15 179.45 2wv0 h TYR 12 N 0.17 1.19 -0.50 1.37 -0.00 -1.91 -0.47 116.97 116.82 2wv0 h TYR 12 Ca 0.05 0.03 -0.08 0.00 0.00 0.00 0.00 58.73 58.73 2wv0 h TYR 12 Cb 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 36.73 36.33 2wv0 h TYR 12 CO -0.06 0.56 -0.02 -0.92 -0.00 0.00 0.00 178.16 177.72 2wv0 h TYR 13 N 1.11 0.91 -0.26 0.10 3.20 -1.72 -1.43 116.97 118.88 2wv0 h TYR 13 Ca 0.46 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 62.11 2wv0 h TYR 13 Cb 0.29 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2wv0 h TYR 13 CO -0.00 0.85 -0.18 1.96 -1.64 0.00 0.00 178.16 179.15 2wv0 h GLN 14 N 0.78 0.47 0.06 1.82 4.20 0.13 -2.70 115.11 119.88 2wv0 h GLN 14 Ca 0.15 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2wv0 h GLN 14 Cb 0.50 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2wv0 h GLN 14 CO 0.03 0.63 -0.03 0.82 -0.67 0.00 0.00 178.83 179.61 2wv0 h ILE 15 N 0.43 1.20 -0.58 2.54 2.04 -0.61 -2.79 117.51 119.74 2wv0 h ILE 15 Ca 0.07 -0.91 0.12 0.00 1.00 0.00 0.00 64.86 65.14 2wv0 h ILE 15 Cb 0.56 1.79 -0.10 0.00 -0.74 0.00 0.00 36.82 38.33 2wv0 h ILE 15 CO 0.04 0.23 -0.07 0.24 0.00 0.00 0.00 178.15 178.58 2wv0 h MET 16 N -0.49 0.05 -0.53 2.37 2.86 -1.18 -1.07 114.93 116.94 2wv0 h MET 16 Ca -0.01 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.57 2wv0 h MET 16 Cb 0.43 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 2wv0 h MET 16 CO 0.01 0.03 0.07 0.93 1.06 0.00 0.00 176.91 179.02 2wv0 h GLU 17 N 0.05 0.84 0.02 1.72 4.39 -1.44 -1.76 114.58 118.39 2wv0 h GLU 17 Ca 0.29 -0.20 -0.20 0.00 0.34 0.00 0.00 59.36 59.59 2wv0 h GLU 17 Cb 0.46 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 2wv0 h GLU 17 CO -0.55 0.79 -0.92 1.96 -1.16 0.00 0.00 179.01 179.13 2wv0 h GLN 18 N 0.79 0.15 -0.44 2.33 4.20 -1.12 -2.33 115.11 118.70 2wv0 h GLN 18 Ca 0.17 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2wv0 h GLN 18 Cb 0.37 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 2wv0 h GLN 18 CO 0.01 0.97 0.16 -0.07 -0.67 0.00 0.00 178.83 179.22 2wv0 h LEU 19 N 0.08 0.63 -1.32 1.46 3.38 -1.02 -1.60 115.31 116.92 2wv0 h LEU 19 Ca -0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 2wv0 h LEU 19 Cb 1.57 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 2wv0 h LEU 19 CO 0.14 0.64 0.07 0.11 0.09 0.00 0.00 178.44 179.49 2wv0 h LYS 20 N 0.57 0.53 -0.42 1.13 1.57 -1.29 0.83 116.57 119.49 2wv0 h LYS 20 Ca 0.15 -0.09 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 2wv0 h LYS 20 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2wv0 h LYS 20 CO -0.01 0.50 -0.22 1.15 -0.57 0.00 0.00 179.45 180.30 2wv0 h THR 21 N 0.52 1.28 -0.68 -0.16 2.02 -1.27 -1.12 112.91 113.50 2wv0 h THR 21 Ca 0.12 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.93 2wv0 h THR 21 Cb 0.22 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2wv0 h THR 21 CO -0.00 0.46 0.43 1.56 0.37 0.00 0.00 175.52 178.34 2wv0 h GLN 22 N 0.72 0.91 -0.52 6.66 4.20 -0.73 0.32 115.11 126.66 2wv0 h GLN 22 Ca 0.09 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 2wv0 h GLN 22 Cb 0.79 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 2wv0 h GLN 22 CO 0.07 0.63 0.29 0.82 -0.67 0.00 0.00 178.83 179.97 2wv0 h ILE 23 N 0.92 1.17 -0.03 2.54 2.04 -0.78 -1.55 117.51 121.83 2wv0 h ILE 23 Ca 0.25 -0.43 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 2wv0 h ILE 23 Cb -0.06 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2wv0 h ILE 23 CO -0.05 0.18 -0.49 0.11 0.00 0.00 0.00 178.15 177.90 2wv0 h LYS 24 N 0.70 0.09 -0.40 2.37 1.57 -0.84 -3.07 116.57 116.99 2wv0 h LYS 24 Ca 0.18 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2wv0 h LYS 24 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2wv0 h LYS 24 CO -0.03 0.56 0.19 -0.91 -0.57 0.00 0.00 179.45 178.70 2wv0 h ASN 25 N 0.07 0.53 0.00 0.86 2.35 -0.18 -3.47 115.58 115.74 2wv0 h ASN 25 Ca 0.00 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 2wv0 h ASN 25 Cb 0.90 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2wv0 h ASN 25 CO 0.07 0.51 0.00 0.61 -1.65 0.00 0.00 177.43 176.97 2wv0 n GLY 26 N -0.88 1.12 0.37 2.83 0.00 -0.74 -4.97 105.19 102.93 2wv0 n GLY 26 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 2.00 0.94 -5.00 1.61 5.08 -1.60 -3.33 114.58 114.28 2wv0 h GLU 27 Ca 0.00 -0.06 -0.64 0.00 -1.00 0.00 0.00 59.36 57.66 2wv0 h GLU 27 Cb 0.00 -0.21 -0.19 0.00 0.50 0.00 0.00 28.75 28.85 2wv0 h GLU 27 CO 0.00 0.62 -0.57 -0.51 -1.00 0.00 0.00 179.01 177.55 2wv0 s LEU 28 N -10.07 3.73 0.03 1.33 1.43 -0.67 -4.98 118.68 109.47 2wv0 s LEU 28 Ca -0.11 -0.08 -0.07 0.00 -1.03 0.00 0.00 54.13 52.84 2wv0 s LEU 28 Cb 0.21 -2.00 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 2wv0 s LEU 28 CO 0.80 0.00 0.29 -1.58 0.23 0.00 0.00 176.35 176.10 2wv0 s GLN 29 N 1.40 3.60 0.15 1.70 2.00 -1.25 -4.42 119.66 122.84 2wv0 s GLN 29 Ca 0.06 -0.06 -0.34 0.00 -2.00 0.00 0.00 55.36 53.02 2wv0 s GLN 29 Cb -0.15 -3.05 -0.15 0.00 0.80 0.00 0.00 33.01 30.46 2wv0 s GLN 29 CO 0.05 0.62 1.42 -2.30 -0.50 0.00 0.00 175.29 174.59 2wv0 n PRO 30 N 0.99 1.68 -1.12 1.67 -0.02 -1.26 -2.12 135.00 134.83 2wv0 n PRO 30 Ca -0.10 0.60 -0.04 0.00 -2.02 0.00 0.00 63.50 61.94 2wv0 n PRO 30 Cb 0.53 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 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 2.73 -4.76 -4.88 2.55 8.00 0.43 -4.94 116.55 115.68 2wv0 n ASP 31 Ca 0.16 0.10 -0.36 0.00 0.71 0.00 0.00 54.79 55.40 2wv0 n ASP 31 Cb 0.26 -2.61 -0.06 0.00 -0.02 0.00 0.00 41.12 38.69 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 -1.81 3.45 0.45 -1.24 -1.94 -0.90 -4.79 119.30 112.52 2wv0 s MET 32 Ca 0.00 -0.16 -0.23 0.00 -1.71 0.00 0.00 55.69 53.58 2wv0 s MET 32 Cb 0.00 -3.17 -0.08 0.00 2.01 0.00 0.00 34.83 33.60 2wv0 s MET 32 CO 0.00 0.75 1.17 -1.25 -0.01 0.00 0.00 175.02 175.69 2wv0 s PRO 33 N -1.24 3.82 0.49 2.03 0.04 -1.26 -2.89 135.00 135.99 2wv0 s PRO 33 Ca 0.18 1.80 -0.04 0.00 0.04 0.00 0.00 61.00 62.98 2wv0 s PRO 33 Cb -0.12 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 2wv0 s PRO 33 CO 0.08 -0.51 0.78 -0.51 0.04 0.00 0.00 177.00 176.88 2wv0 s LEU 34 N -2.90 3.57 0.92 -3.56 1.02 -0.46 -4.97 118.68 112.30 2wv0 s LEU 34 Ca 0.62 0.79 -0.11 0.00 0.02 0.00 0.00 54.13 55.45 2wv0 s LEU 34 Cb -0.29 -3.70 0.11 0.00 0.02 0.00 0.00 46.19 42.33 2wv0 s LEU 34 CO 0.36 -0.68 0.91 -2.65 0.02 0.00 0.00 176.35 174.31 2wv0 n PRO 35 N -2.28 -0.38 -1.55 1.29 -0.02 -1.26 -4.73 135.00 126.07 2wv0 n PRO 35 Ca 0.01 -0.05 -0.30 0.00 -2.02 0.00 0.00 63.50 61.14 2wv0 n PRO 35 Cb 0.56 -2.21 0.18 0.00 -0.02 0.00 0.00 33.50 32.01 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 -2.41 2.62 0.15 2.55 1.04 -1.26 -4.83 113.70 111.55 2wv0 s SER 36 Ca 0.64 0.61 -0.17 0.00 0.48 0.00 0.00 55.95 57.51 2wv0 s SER 36 Cb -0.23 -0.89 -0.01 0.00 0.10 0.00 0.00 66.02 65.00 2wv0 s SER 36 CO 0.61 -3.07 1.81 -0.33 0.98 0.00 0.00 173.24 173.23 2wv0 h GLU 37 N -1.86 0.46 -0.56 4.02 5.08 -1.94 -2.47 114.58 117.31 2wv0 h GLU 37 Ca -0.46 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 57.91 2wv0 h GLU 37 Cb 1.29 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.38 2wv0 h GLU 37 CO 0.45 0.31 0.30 0.00 -1.00 0.00 0.00 179.01 179.07 2wv0 h ARG 38 N 0.48 0.57 0.18 2.33 3.08 -1.94 0.89 114.38 119.96 2wv0 h ARG 38 Ca 0.13 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 2wv0 h ARG 38 Cb -0.06 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.87 2wv0 h ARG 38 CO -0.03 0.37 -0.09 0.93 -1.07 0.00 0.00 179.97 180.09 2wv0 h GLU 39 N 0.58 -0.23 -0.40 0.04 5.08 -1.90 0.20 114.58 117.95 2wv0 h GLU 39 Ca 0.25 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.66 2wv0 h GLU 39 Cb 0.13 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2wv0 h GLU 39 CO -0.15 -0.09 0.19 1.88 -1.00 0.00 0.00 179.01 179.83 2wv0 h TYR 40 N -0.31 0.34 -0.55 4.33 0.05 -1.37 -0.21 116.97 119.25 2wv0 h TYR 40 Ca -0.02 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.83 2wv0 h TYR 40 Cb 0.24 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 37.84 2wv0 h TYR 40 CO -0.04 0.17 0.27 0.00 -1.05 0.00 0.00 178.16 177.50 2wv0 h ALA 41 N 1.22 0.71 -0.39 3.88 0.00 -0.59 -1.16 119.26 122.93 2wv0 h ALA 41 Ca 0.18 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 2wv0 h ALA 41 Cb 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2wv0 h ALA 41 CO -0.14 -0.09 -0.30 1.05 0.00 0.00 0.00 179.25 179.77 2wv0 h GLU 42 N 0.51 0.84 0.55 0.00 -0.00 -0.36 0.30 114.58 116.41 2wv0 h GLU 42 Ca 0.25 -0.38 -0.02 0.00 -0.00 0.00 0.00 59.36 59.21 2wv0 h GLU 42 Cb 0.19 -0.01 -0.02 0.00 -0.00 0.00 0.00 28.75 28.91 2wv0 h GLU 42 CO -0.19 1.02 -0.47 -0.56 -0.00 0.00 0.00 179.01 178.81 2wv0 h GLN 43 N 0.71 -0.96 0.00 1.06 3.07 -0.41 -3.15 115.11 115.43 2wv0 h GLN 43 Ca 0.08 0.07 0.00 0.00 0.09 0.00 0.00 58.65 58.89 2wv0 h GLN 43 Cb 0.85 0.22 0.00 0.00 0.08 0.00 0.00 27.48 28.63 2wv0 h GLN 43 CO 0.07 -0.64 0.00 0.74 0.09 0.00 0.00 178.83 179.09 2wv0 h PHE 44 N -1.00 0.00 -4.20 0.06 0.04 -1.26 -3.48 116.94 107.10 2wv0 h PHE 44 Ca -0.07 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.52 2wv0 h PHE 44 Cb 0.85 0.00 0.10 0.00 2.20 0.00 0.00 35.95 39.10 2wv0 h PHE 44 CO -0.20 0.00 -0.46 0.41 -0.60 0.00 0.00 178.31 177.45 2wv0 n GLY 45 N 0.98 -0.09 3.30 -1.45 0.00 0.98 -5.02 105.19 103.89 2wv0 n GLY 45 Ca 0.04 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.21 1.02 0.44 -0.61 -4.36 -0.83 -5.05 121.20 108.60 2wv0 s ILE 46 Ca 0.06 -2.03 -0.25 0.00 -0.26 0.00 0.00 60.65 58.16 2wv0 s ILE 46 Cb -0.01 -2.20 -0.09 0.00 1.25 0.00 0.00 42.46 41.41 2wv0 s ILE 46 CO 0.43 -0.44 1.30 -1.54 0.24 0.00 0.00 174.94 174.93 2wv0 n SER 47 N -0.35 2.65 -0.17 4.36 3.41 -1.26 -4.61 113.62 117.65 2wv0 n SER 47 Ca -0.06 1.10 0.03 0.00 -0.26 0.00 0.00 58.87 59.67 2wv0 n SER 47 Cb 0.63 -1.52 0.31 0.00 -0.26 0.00 0.00 64.21 63.37 2wv0 n SER 47 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2wv0 h ARG 48 N 2.05 0.83 0.00 4.33 -0.00 -1.94 -2.19 114.38 117.46 2wv0 h ARG 48 Ca -0.49 -0.05 -0.00 0.00 -0.00 0.00 0.00 59.98 59.44 2wv0 h ARG 48 Cb 1.29 -0.19 -0.00 0.00 -0.00 0.00 0.00 29.97 31.07 2wv0 h ARG 48 CO 0.60 0.55 -0.01 0.52 -0.00 0.00 0.00 179.97 181.63 2wv0 h MET 49 N 0.85 0.00 -0.17 0.08 2.86 -1.96 -0.66 114.93 115.93 2wv0 h MET 49 Ca 0.27 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.72 2wv0 h MET 49 Cb 0.01 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 2wv0 h MET 49 CO -0.07 0.01 -0.65 1.15 1.06 0.00 0.00 176.91 178.41 2wv0 h THR 50 N 0.00 1.31 -0.40 2.22 2.02 -1.76 -2.38 112.91 113.93 2wv0 h THR 50 Ca -0.00 -1.91 -0.06 0.00 0.77 0.00 0.00 66.41 65.21 2wv0 h THR 50 Cb 0.02 1.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 2wv0 h THR 50 CO 0.00 0.60 -0.00 0.58 0.37 0.00 0.00 175.52 177.07 2wv0 h VAL 51 N 0.47 1.26 -0.83 3.16 2.07 -1.29 -2.97 116.25 118.12 2wv0 h VAL 51 Ca -0.02 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.53 2wv0 h VAL 51 Cb 1.24 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.08 2wv0 h VAL 51 CO 0.13 0.34 0.53 -0.09 0.02 0.00 0.00 177.57 178.50 2wv0 h ARG 52 N 0.53 0.98 -0.99 1.57 2.43 -1.14 -1.15 114.38 116.62 2wv0 h ARG 52 Ca 0.11 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2wv0 h ARG 52 Cb 0.48 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 2wv0 h ARG 52 CO 0.02 0.65 0.64 0.37 -1.51 0.00 0.00 179.97 180.15 2wv0 h GLN 53 N 1.01 1.20 0.17 0.20 4.15 -1.35 0.22 115.11 120.71 2wv0 h GLN 53 Ca 0.34 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.68 2wv0 h GLN 53 Cb 0.05 -0.27 0.00 0.00 0.21 0.00 0.00 27.48 27.47 2wv0 h GLN 53 CO -0.13 0.79 -0.08 0.00 -1.93 0.00 0.00 178.83 177.48 2wv0 h ALA 54 N 1.41 -0.23 -0.53 3.38 0.00 -1.23 -2.42 119.26 119.64 2wv0 h ALA 54 Ca 0.40 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2wv0 h ALA 54 Cb 0.03 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2wv0 h ALA 54 CO -0.13 -0.41 0.35 -0.07 0.00 0.00 0.00 179.25 178.99 2wv0 h LEU 55 N -0.68 0.60 -0.29 0.00 3.38 -1.09 -2.30 115.31 114.94 2wv0 h LEU 55 Ca -0.02 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wv0 h LEU 55 Cb 0.49 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2wv0 h LEU 55 CO 0.04 0.44 0.16 0.28 0.09 0.00 0.00 178.44 179.44 2wv0 h SER 56 N 0.71 0.24 -0.97 -0.43 0.02 -0.64 -0.97 113.55 111.52 2wv0 h SER 56 Ca 0.20 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 2wv0 h SER 56 Cb -0.08 -0.04 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 2wv0 h SER 56 CO -0.04 0.18 0.63 0.78 -1.14 0.00 0.00 176.83 177.24 2wv0 h ASN 57 N 0.32 1.04 0.24 3.07 2.35 -1.25 -0.82 115.58 120.54 2wv0 h ASN 57 Ca 0.12 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.72 2wv0 h ASN 57 Cb 0.02 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 2wv0 h ASN 57 CO -0.07 0.70 -0.54 -0.07 -1.65 0.00 0.00 177.43 175.80 2wv0 h LEU 58 N 1.20 0.36 -0.14 1.61 3.38 -1.01 -1.80 115.31 118.89 2wv0 h LEU 58 Ca 0.40 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2wv0 h LEU 58 Cb 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2wv0 h LEU 58 CO -0.13 0.83 0.06 0.58 0.09 0.00 0.00 178.44 179.87 2wv0 h VAL 59 N 0.25 1.13 -0.18 1.22 2.07 -0.80 -1.22 116.25 118.72 2wv0 h VAL 59 Ca 0.00 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.17 2wv0 h VAL 59 Cb 1.03 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2wv0 h VAL 59 CO 0.09 0.12 0.12 0.78 0.02 0.00 0.00 177.57 178.70 2wv0 h ASN 60 N 0.09 0.13 1.79 0.57 2.35 -0.94 -1.23 115.58 118.34 2wv0 h ASN 60 Ca 0.05 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2wv0 h ASN 60 Cb 0.13 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2wv0 h ASN 60 CO -0.01 0.09 -0.05 -0.33 -1.65 0.00 0.00 177.43 175.48 2wv0 h GLU 61 N 0.15 0.00 0.00 0.81 5.08 -1.19 -3.47 114.58 115.96 2wv0 h GLU 61 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2wv0 h GLU 61 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2wv0 h GLU 61 CO -0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 2wv0 n GLY 62 N 1.17 0.75 0.07 -3.84 0.00 -0.46 -4.93 105.19 97.94 2wv0 n GLY 62 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 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 0.03 -9.38 0.99 4.07 -1.48 -3.43 115.31 106.10 2wv0 h LEU 63 Ca 0.00 -0.04 -0.60 0.00 0.08 0.00 0.00 57.88 57.32 2wv0 h LEU 63 Cb 0.00 -0.01 -0.13 0.00 1.08 0.00 0.00 40.66 41.60 2wv0 h LEU 63 CO 0.00 1.03 -0.70 -0.76 -1.08 0.00 0.00 178.44 176.93 2wv0 s LEU 64 N -6.68 2.79 0.22 1.67 1.43 -0.71 -1.30 118.68 116.10 2wv0 s LEU 64 Ca 0.00 -1.00 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 2wv0 s LEU 64 Cb 0.10 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 45.05 2wv0 s LEU 64 CO 0.82 -0.07 0.09 -0.72 0.23 0.00 0.00 176.35 176.70 2wv0 s TYR 65 N -2.50 1.32 0.26 0.29 -0.85 -0.25 -4.14 117.35 111.47 2wv0 s TYR 65 Ca 0.32 -1.22 0.08 0.00 -0.52 0.00 0.00 57.07 55.73 2wv0 s TYR 65 Cb -0.03 -0.73 -0.05 0.00 0.38 0.00 0.00 41.96 41.52 2wv0 s TYR 65 CO 0.17 -0.42 -0.09 1.03 -1.52 0.00 0.00 175.55 174.72 2wv0 s ARG 66 N -4.05 1.52 0.00 -3.49 0.52 -1.26 -1.42 118.95 110.77 2wv0 s ARG 66 Ca 0.35 -1.74 0.00 0.00 -0.52 0.00 0.00 55.73 53.81 2wv0 s ARG 66 Cb 0.07 -1.23 0.00 0.00 0.52 0.00 0.00 34.95 34.31 2wv0 s ARG 66 CO 0.11 0.11 0.00 1.28 0.02 0.00 0.00 175.30 176.81 2wv0 n LEU 67 N -0.55 0.00 -0.08 2.53 4.32 -1.26 -5.03 117.00 116.93 2wv0 n LEU 67 Ca -0.06 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.80 2wv0 n LEU 67 Cb 0.62 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.36 2wv0 n LEU 67 CO 0.38 0.00 -1.03 0.29 -1.22 0.00 0.00 177.39 175.82 2wv0 n LYS 68 N -0.16 0.37 -0.32 3.23 4.76 -1.26 -5.06 118.16 119.72 2wv0 n LYS 68 Ca 0.00 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 2wv0 n LYS 68 Cb 0.00 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2wv0 n LYS 68 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wv0 n GLY 69 N 2.49 -0.00 0.00 0.72 0.00 -1.26 -4.92 105.19 102.21 2wv0 n GLY 69 Ca -0.29 -1.83 0.10 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.90 0.36 -2.22 1.61 -4.01 -1.26 -4.90 116.66 105.35 2wv0 n ARG 70 Ca 0.00 0.08 -0.41 0.00 -1.04 0.00 0.00 57.85 56.48 2wv0 n ARG 70 Cb 0.00 -1.50 -0.03 0.00 -3.04 0.00 0.00 32.46 27.89 2wv0 n ARG 70 CO 0.00 0.00 0.00 0.20 -3.04 0.00 0.00 177.63 174.79 2wv0 s GLY 71 N -2.43 2.71 0.24 2.89 0.00 -1.26 -4.96 107.32 104.51 2wv0 s GLY 71 Ca 0.21 1.13 0.08 0.00 0.00 0.00 0.00 44.72 46.14 2wv0 s GLY 71 CO 0.28 1.95 0.11 -0.51 0.00 0.00 0.00 173.10 174.92 2wv0 s THR 72 N -0.47 4.07 0.04 0.90 -4.23 -1.26 -4.19 115.64 110.50 2wv0 s THR 72 Ca 0.53 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 59.51 2wv0 s THR 72 Cb -0.37 -3.17 -0.02 0.00 1.34 0.00 0.00 72.50 70.28 2wv0 s THR 72 CO 0.43 -0.31 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.80 2wv0 s PHE 73 N -2.11 0.47 0.00 3.99 0.08 -0.51 -1.36 117.98 118.54 2wv0 s PHE 73 Ca 0.32 -0.60 -0.30 0.00 0.12 0.00 0.00 56.93 56.47 2wv0 s PHE 73 Cb -0.08 -0.30 -0.05 0.00 -0.57 0.00 0.00 43.02 42.02 2wv0 s PHE 73 CO 0.23 -0.17 1.30 0.08 -0.10 0.00 0.00 175.22 176.55 2wv0 s VAL 74 N -1.81 3.91 0.22 -0.44 1.01 -1.14 -1.09 120.40 121.06 2wv0 s VAL 74 Ca -0.10 1.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 2wv0 s VAL 74 Cb -0.07 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 2wv0 s VAL 74 CO -0.02 0.03 1.38 -0.44 0.00 0.00 0.00 175.10 176.05 2wv0 s SER 75 N 1.53 6.77 -0.23 3.32 0.01 -0.42 -0.43 113.70 124.26 2wv0 s SER 75 Ca 0.60 2.53 -0.29 0.00 1.31 0.00 0.00 55.95 60.10 2wv0 s SER 75 Cb -0.29 -2.62 -0.00 0.00 0.21 0.00 0.00 66.02 63.32 2wv0 s SER 75 CO 0.26 -0.62 1.24 -1.59 0.41 0.00 0.00 173.24 172.94 2wv0 s LYS 76 N -0.18 4.10 0.36 12.44 -2.85 -1.26 -4.75 119.74 127.60 2wv0 s LYS 76 Ca 0.58 1.44 -0.28 0.00 -1.00 0.00 0.00 55.97 56.71 2wv0 s LYS 76 Cb -0.39 -3.79 -0.10 0.00 -2.06 0.00 0.00 37.83 31.48 2wv0 s LYS 76 CO 0.40 -0.87 1.33 -1.25 0.10 0.00 0.00 175.35 175.07 2wv0 s PRO 77 N 3.74 4.22 -0.26 1.78 0.04 -1.26 -4.96 135.00 138.29 2wv0 s PRO 77 Ca 0.54 2.26 -0.22 0.00 0.04 0.00 0.00 61.00 63.61 2wv0 s PRO 77 Cb -0.19 -2.98 -0.01 0.00 0.04 0.00 0.00 34.50 31.37 2wv0 s PRO 77 CO 0.17 -0.32 0.72 0.15 0.04 0.00 0.00 177.00 177.77 2wv0 s LYS 78 N -1.95 4.09 0.00 4.56 -0.14 -1.26 -4.93 119.74 120.11 2wv0 s LYS 78 Ca 0.51 0.67 0.10 0.00 -1.36 0.00 0.00 55.97 55.89 2wv0 s LYS 78 Cb -0.40 -3.67 0.03 0.00 -1.68 0.00 0.00 37.83 32.11 2wv0 s LYS 78 CO 0.54 -0.51 0.70 -1.33 -0.76 0.00 0.00 175.35 173.99 2wv0 n MET 79 N 5.91 1.31 0.06 1.68 2.81 -1.26 -4.69 117.12 122.93 2wv0 n MET 79 Ca 0.02 -0.81 -0.13 0.00 -1.81 0.00 0.00 57.70 54.97 2wv0 n MET 79 Cb 0.48 -1.12 -0.09 0.00 -0.71 0.00 0.00 33.22 31.79 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 1.44 -0.14 -0.48 0.03 4.39 -1.98 0.11 114.58 117.96 2wv0 h GLU 80 Ca 0.00 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 2wv0 h GLU 80 Cb 0.36 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 2wv0 h GLU 80 CO 0.00 0.18 0.13 0.37 -1.16 0.00 0.00 179.01 178.53 2wv0 h GLN 81 N -0.47 0.71 -0.32 2.33 5.75 -1.94 0.22 115.11 121.39 2wv0 h GLN 81 Ca -0.01 -0.13 -0.16 0.00 -0.15 0.00 0.00 58.65 58.20 2wv0 h GLN 81 Cb 0.38 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.81 2wv0 h GLN 81 CO 0.02 0.64 -0.43 0.00 -2.65 0.00 0.00 178.83 176.41 2wv0 h ALA 82 N 1.45 0.49 0.00 3.38 0.00 -1.76 -1.26 119.26 121.56 2wv0 h ALA 82 Ca 0.16 -0.47 -0.22 0.00 0.00 0.00 0.00 54.91 54.38 2wv0 h ALA 82 Cb 0.24 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2wv0 h ALA 82 CO -0.01 0.62 -2.02 1.28 0.00 0.00 0.00 179.25 179.13 2wv0 n LEU 83 N -4.09 0.25 -0.01 0.00 4.77 0.37 -4.56 117.00 113.74 2wv0 n LEU 83 Ca -0.04 0.11 0.01 0.00 -0.03 0.00 0.00 56.01 56.07 2wv0 n LEU 83 Cb 0.57 0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.87 2wv0 n LEU 83 CO 0.49 0.28 -0.57 0.00 -1.33 0.00 0.00 177.39 176.25 2wv0 n GLN 84 N -2.67 1.10 0.00 3.23 1.13 0.73 -0.72 117.38 120.18 2wv0 n GLN 84 Ca -0.19 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.84 2wv0 n GLN 84 Cb 0.92 -1.10 0.00 0.00 0.11 0.00 0.00 30.24 30.17 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 2.41 4.76 2.88 1.08 0.00 -0.48 -4.96 105.19 110.88 2wv0 n GLY 85 Ca -0.02 -1.65 -0.27 0.00 0.00 0.00 0.00 46.02 44.08 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 1.18 0.15 0.99 2.96 -1.17 -4.83 118.68 117.96 2wv0 s LEU 86 Ca 0.00 -0.34 0.08 0.00 -0.22 0.00 0.00 54.13 53.65 2wv0 s LEU 86 Cb 0.00 -0.80 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 2wv0 s LEU 86 CO 0.00 -0.14 -0.07 0.42 -1.32 0.00 0.00 176.35 175.24 2wv0 s THR 87 N 1.73 3.43 0.94 3.68 -4.23 -1.26 -4.94 115.64 114.99 2wv0 s THR 87 Ca 0.04 -1.44 -0.15 0.00 -1.18 0.00 0.00 61.69 58.96 2wv0 s THR 87 Cb -0.13 -2.67 0.18 0.00 1.34 0.00 0.00 72.50 71.21 2wv0 s THR 87 CO -0.08 -0.03 1.26 -0.94 -0.54 0.00 0.00 174.62 174.29 2wv0 s SER 88 N -2.64 3.28 0.23 3.99 1.04 -1.26 -4.88 113.70 113.46 2wv0 s SER 88 Ca 0.24 0.46 -0.08 0.00 0.48 0.00 0.00 55.95 57.06 2wv0 s SER 88 Cb -0.10 -0.66 0.23 0.00 0.10 0.00 0.00 66.02 65.60 2wv0 s SER 88 CO 0.16 -2.65 1.88 0.15 0.98 0.00 0.00 173.24 173.76 2wv0 h PHE 89 N -1.58 1.00 -0.49 5.02 3.04 -2.00 -1.30 116.94 120.62 2wv0 h PHE 89 Ca -0.45 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.51 2wv0 h PHE 89 Cb 1.27 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 39.42 2wv0 h PHE 89 CO -0.80 0.58 0.27 1.15 -2.02 0.00 0.00 178.31 177.49 2wv0 h THR 90 N 1.04 1.17 -0.18 4.41 2.02 -1.98 0.37 112.91 119.76 2wv0 h THR 90 Ca 0.32 -0.43 -0.17 0.00 0.77 0.00 0.00 66.41 66.91 2wv0 h THR 90 Cb -0.02 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 66.94 2wv0 h THR 90 CO -0.10 0.18 -0.59 -0.33 0.37 0.00 0.00 175.52 175.05 2wv0 h GLU 91 N 0.66 0.58 0.37 6.66 5.08 -1.92 -2.14 114.58 123.87 2wv0 h GLU 91 Ca 0.17 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2wv0 h GLU 91 Cb 0.04 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2wv0 h GLU 91 CO -0.03 1.00 -0.25 0.22 -1.00 0.00 0.00 179.01 178.95 2wv0 h ASP 92 N 0.44 -0.63 -0.85 1.42 3.58 -0.77 0.27 116.42 119.87 2wv0 h ASP 92 Ca 0.00 0.04 0.03 0.00 0.42 0.00 0.00 57.03 57.52 2wv0 h ASP 92 Cb 1.14 0.20 -0.05 0.00 1.72 0.00 0.00 39.33 42.34 2wv0 h ASP 92 CO 0.11 -0.39 0.55 0.24 -2.88 0.00 0.00 179.24 176.87 2wv0 h MET 93 N -0.60 1.04 -0.68 0.28 2.86 -0.95 -2.79 114.93 114.09 2wv0 h MET 93 Ca -0.04 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 2wv0 h MET 93 Cb 0.51 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 2wv0 h MET 93 CO 0.02 0.69 0.27 0.87 1.06 0.00 0.00 176.91 179.83 2wv0 h LYS 94 N 1.08 1.01 0.00 1.72 1.57 -1.05 -0.18 116.57 120.72 2wv0 h LYS 94 Ca 0.33 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2wv0 h LYS 94 Cb -0.02 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.13 2wv0 h LYS 94 CO -0.11 0.84 0.00 -1.13 -0.57 0.00 0.00 179.45 178.48 2wv0 n SER 95 N -4.39 0.64 -1.11 0.86 3.41 0.05 -0.71 113.62 112.38 2wv0 n SER 95 Ca 0.05 0.71 0.12 0.00 -0.26 0.00 0.00 58.87 59.49 2wv0 n SER 95 Cb 0.17 -0.83 0.22 0.00 -0.26 0.00 0.00 64.21 63.52 2wv0 n SER 95 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2wv0 n ARG 96 N -2.27 2.45 -2.22 4.33 1.74 -0.78 -4.94 116.66 114.98 2wv0 n ARG 96 Ca 0.01 -2.19 -0.10 0.00 -0.77 0.00 0.00 57.85 54.80 2wv0 n ARG 96 Cb 0.15 -1.51 -0.00 0.00 -1.02 0.00 0.00 32.46 30.08 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 1.48 -0.05 3.44 -0.13 0.00 0.11 -5.04 105.19 105.01 2wv0 n GLY 97 Ca 0.19 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 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 -4.54 1.59 -0.41 1.61 -1.94 -0.15 -5.00 119.30 110.46 2wv0 s MET 98 Ca 0.01 -1.62 -0.18 0.00 -1.71 0.00 0.00 55.69 52.19 2wv0 s MET 98 Cb -0.00 -1.82 0.02 0.00 2.01 0.00 0.00 34.83 35.04 2wv0 s MET 98 CO 0.01 0.37 0.47 0.99 -0.01 0.00 0.00 175.02 176.85 2wv0 s THR 99 N -2.02 5.04 0.46 2.05 2.01 -1.26 -3.56 115.64 118.36 2wv0 s THR 99 Ca 0.25 -0.17 -0.21 0.00 0.31 0.00 0.00 61.69 61.86 2wv0 s THR 99 Cb -0.07 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 68.31 2wv0 s THR 99 CO 0.12 -0.41 1.02 -2.16 -0.69 0.00 0.00 174.62 172.50 2wv0 s PRO 100 N 2.27 3.95 0.26 4.92 0.04 -1.26 -0.48 135.00 144.69 2wv0 s PRO 100 Ca 0.14 1.33 -0.05 0.00 0.04 0.00 0.00 61.00 62.47 2wv0 s PRO 100 Cb -0.16 -2.18 0.02 0.00 0.04 0.00 0.00 34.50 32.21 2wv0 s PRO 100 CO 0.14 -0.30 0.42 0.41 0.04 0.00 0.00 177.00 177.71 2wv0 n GLY 101 N -0.23 1.97 3.30 0.56 0.00 -0.76 -4.93 105.19 105.09 2wv0 n GLY 101 Ca 0.08 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 2wv0 n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wv0 s SER 102 N -2.47 -0.24 -0.02 1.61 0.01 -1.26 -0.54 113.70 110.79 2wv0 s SER 102 Ca 0.16 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.36 2wv0 s SER 102 Cb -0.02 0.41 0.02 0.00 0.21 0.00 0.00 66.02 66.64 2wv0 s SER 102 CO 0.12 -0.65 0.01 0.00 0.41 0.00 0.00 173.24 173.12 2wv0 s ARG 103 N -2.53 0.14 0.11 12.44 1.70 -0.21 -4.65 118.95 125.95 2wv0 s ARG 103 Ca -0.05 0.07 -0.31 0.00 -0.47 0.00 0.00 55.73 54.97 2wv0 s ARG 103 Cb -0.01 -0.29 -0.09 0.00 -0.57 0.00 0.00 34.95 33.99 2wv0 s ARG 103 CO -0.03 -0.09 1.63 -1.17 -1.08 0.00 0.00 175.30 174.56 2wv0 s LEU 104 N 0.71 4.37 -0.22 -1.89 2.96 -1.26 -0.93 118.68 122.42 2wv0 s LEU 104 Ca -0.06 2.55 -0.14 0.00 -0.22 0.00 0.00 54.13 56.25 2wv0 s LEU 104 Cb -0.09 -3.58 -0.18 0.00 0.50 0.00 0.00 46.19 42.84 2wv0 s LEU 104 CO -0.02 -0.87 0.04 -0.38 -1.32 0.00 0.00 176.35 173.81 2wv0 n ILE 105 N 4.43 1.58 -3.68 6.68 5.41 0.54 -4.88 119.36 129.43 2wv0 n ILE 105 Ca 0.15 -0.30 -0.13 0.00 1.00 0.00 0.00 62.75 63.47 2wv0 n ILE 105 Cb 0.40 -1.88 -0.09 0.00 -0.71 0.00 0.00 39.64 37.36 2wv0 n ILE 105 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2wv0 s ASP 106 N -7.03 -0.58 -0.06 4.38 2.15 -0.83 -5.01 116.67 109.68 2wv0 s ASP 106 Ca -0.31 1.13 0.03 0.00 0.43 0.00 0.00 52.55 53.83 2wv0 s ASP 106 Cb 0.09 1.14 0.01 0.00 -0.30 0.00 0.00 42.92 43.85 2wv0 s ASP 106 CO 0.60 -0.19 -0.15 -0.47 -0.17 0.00 0.00 175.17 174.78 2wv0 s TYR 107 N 0.31 1.67 0.00 -5.34 6.14 -1.26 -0.84 117.35 118.04 2wv0 s TYR 107 Ca -0.00 -0.58 0.00 0.00 0.64 0.00 0.00 57.07 57.13 2wv0 s TYR 107 Cb -0.04 -1.17 -0.00 0.00 0.42 0.00 0.00 41.96 41.17 2wv0 s TYR 107 CO 0.01 -0.26 -0.01 -0.65 0.64 0.00 0.00 175.55 175.28 2wv0 s GLN 108 N 0.40 0.10 -0.38 4.97 -0.21 -0.67 -5.02 119.66 118.85 2wv0 s GLN 108 Ca -0.11 -0.10 -0.16 0.00 0.02 0.00 0.00 55.36 55.01 2wv0 s GLN 108 Cb -0.14 -0.05 0.01 0.00 1.00 0.00 0.00 33.01 33.82 2wv0 s GLN 108 CO 0.04 0.01 0.36 -1.17 -2.12 0.00 0.00 175.29 172.41 2wv0 s LEU 109 N -0.19 4.74 0.20 2.90 2.96 -1.26 -0.51 118.68 127.52 2wv0 s LEU 109 Ca -0.01 -0.55 0.10 0.00 -0.22 0.00 0.00 54.13 53.44 2wv0 s LEU 109 Cb -0.01 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.34 2wv0 s LEU 109 CO -0.00 -0.44 -0.13 0.27 -1.32 0.00 0.00 176.35 174.74 2wv0 s ILE 110 N 1.96 2.97 0.41 6.68 -4.36 0.33 -4.90 121.20 124.29 2wv0 s ILE 110 Ca 0.10 -1.83 -0.25 0.00 -0.26 0.00 0.00 60.65 58.40 2wv0 s ILE 110 Cb -0.17 -2.49 -0.08 0.00 1.25 0.00 0.00 42.46 40.97 2wv0 s ILE 110 CO 0.12 -0.17 1.26 -1.81 0.24 0.00 0.00 174.94 174.59 2wv0 s ASP 111 N -2.94 6.30 0.47 4.36 -0.00 -1.26 -0.20 116.67 123.39 2wv0 s ASP 111 Ca 0.25 2.56 -0.23 0.00 -0.00 0.00 0.00 52.55 55.13 2wv0 s ASP 111 Cb -0.08 -2.63 -0.07 0.00 -0.00 0.00 0.00 42.92 40.14 2wv0 s ASP 111 CO 0.14 -0.85 1.21 -0.94 -0.00 0.00 0.00 175.17 174.73 2wv0 s SER 112 N -0.88 6.04 0.36 0.27 1.04 0.94 -4.79 113.70 116.68 2wv0 s SER 112 Ca 0.58 2.41 0.08 0.00 0.48 0.00 0.00 55.95 59.50 2wv0 s SER 112 Cb -0.36 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.11 2wv0 s SER 112 CO 0.45 -1.01 0.18 0.42 0.98 0.00 0.00 173.24 174.26 2wv0 s THR 113 N -1.48 2.91 0.20 2.02 -4.23 -1.26 -4.73 115.64 109.08 2wv0 s THR 113 Ca 0.64 -1.65 -0.11 0.00 -1.18 0.00 0.00 61.69 59.39 2wv0 s THR 113 Cb -0.31 -2.99 0.12 0.00 1.34 0.00 0.00 72.50 70.65 2wv0 s THR 113 CO 0.38 -0.14 1.83 1.05 -0.54 0.00 0.00 174.62 177.20 2wv0 h GLU 114 N 1.47 0.74 -0.48 3.99 9.09 -1.99 -1.91 114.58 125.50 2wv0 h GLU 114 Ca -0.43 -0.04 0.01 0.00 0.05 0.00 0.00 59.36 58.94 2wv0 h GLU 114 Cb 1.25 -0.17 -0.02 0.00 -1.65 0.00 0.00 28.75 28.16 2wv0 h GLU 114 CO 0.63 0.49 0.31 1.05 0.05 0.00 0.00 179.01 181.55 2wv0 h GLU 115 N 0.76 0.62 0.00 1.06 9.09 -2.01 -2.70 114.58 121.41 2wv0 h GLU 115 Ca 0.26 -0.04 -0.13 0.00 0.05 0.00 0.00 59.36 59.51 2wv0 h GLU 115 Cb 0.04 -0.14 -0.02 0.00 -1.65 0.00 0.00 28.75 26.98 2wv0 h GLU 115 CO -0.11 0.41 -0.60 -0.07 0.05 0.00 0.00 179.01 178.69 2wv0 h LEU 116 N 0.64 0.00 -0.53 3.06 3.38 -1.94 -3.01 115.31 116.91 2wv0 h LEU 116 Ca 0.18 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 2wv0 h LEU 116 Cb -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2wv0 h LEU 116 CO -0.04 0.60 -0.64 0.00 0.09 0.00 0.00 178.44 178.45 2wv0 h ALA 117 N 1.40 0.72 -0.41 1.53 0.00 -1.21 -2.03 119.26 119.26 2wv0 h ALA 117 Ca -0.01 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.22 2wv0 h ALA 117 Cb 1.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2wv0 h ALA 117 CO 0.08 0.73 -0.25 0.00 0.00 0.00 0.00 179.25 179.82 2wv0 h ALA 118 N 1.05 0.58 -0.50 0.00 0.00 -1.50 0.39 119.26 119.27 2wv0 h ALA 118 Ca -0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2wv0 h ALA 118 Cb 1.18 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2wv0 h ALA 118 CO 0.11 0.58 0.18 0.82 0.00 0.00 0.00 179.25 180.93 2wv0 h ILE 119 N 0.70 1.22 0.00 0.00 2.04 -1.43 -3.21 117.51 116.83 2wv0 h ILE 119 Ca 0.08 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2wv0 h ILE 119 Cb 0.82 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2wv0 h ILE 119 CO 0.07 0.27 -1.13 0.18 0.00 0.00 0.00 178.15 177.54 2wv0 n LEU 120 N -4.53 0.71 -3.20 1.44 4.77 -0.77 -4.98 117.00 110.44 2wv0 n LEU 120 Ca 0.02 -0.27 -0.23 0.00 -0.03 0.00 0.00 56.01 55.50 2wv0 n LEU 120 Cb 0.18 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2wv0 n LEU 120 CO 0.38 0.15 -0.01 0.61 -1.33 0.00 0.00 177.39 177.20 2wv0 n GLY 121 N 1.43 -0.51 0.09 -0.72 0.00 0.13 -4.23 105.19 101.38 2wv0 n GLY 121 Ca 0.02 0.12 0.04 0.00 0.00 0.00 0.00 46.02 46.20 2wv0 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wv0 n GLY 123 N 1.36 0.84 2.87 0.00 0.00 -1.26 -5.02 105.19 103.99 2wv0 n GLY 123 Ca -0.09 -1.44 -0.14 0.00 0.00 0.00 0.00 46.02 44.35 2wv0 n GLY 123 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wv0 s HIS 124 N -1.04 -0.10 0.40 1.61 5.04 -1.26 -3.80 115.29 116.15 2wv0 s HIS 124 Ca 0.00 0.37 -0.25 0.00 -1.54 0.00 0.00 55.06 53.63 2wv0 s HIS 124 Cb 0.00 -0.14 -0.08 0.00 0.04 0.00 0.00 32.58 32.40 2wv0 s HIS 124 CO 0.00 -0.14 1.19 -1.25 -2.34 0.00 0.00 174.74 172.20 2wv0 s PRO 125 N 1.14 4.04 0.34 2.88 0.04 -1.26 -5.11 135.00 137.07 2wv0 s PRO 125 Ca -0.09 1.88 -0.17 0.00 0.04 0.00 0.00 61.00 62.66 2wv0 s PRO 125 Cb -0.12 -2.69 0.05 0.00 0.04 0.00 0.00 34.50 31.79 2wv0 s PRO 125 CO -0.05 -0.34 0.82 -1.54 0.04 0.00 0.00 177.00 175.92 2wv0 s SER 126 N -1.08 -0.03 -0.11 6.66 1.04 -1.25 -4.99 113.70 113.94 2wv0 s SER 126 Ca 0.57 -1.01 -0.05 0.00 0.48 0.00 0.00 55.95 55.94 2wv0 s SER 126 Cb -0.32 0.79 -0.04 0.00 0.10 0.00 0.00 66.02 66.55 2wv0 s SER 126 CO 0.40 -1.55 0.09 -0.44 0.98 0.00 0.00 173.24 172.73 2wv0 s SER 127 N -3.09 6.01 -0.04 7.02 0.01 -1.26 -0.04 113.70 122.31 2wv0 s SER 127 Ca 0.16 0.35 0.01 0.00 1.31 0.00 0.00 55.95 57.78 2wv0 s SER 127 Cb -0.05 -1.88 0.02 0.00 0.21 0.00 0.00 66.02 64.32 2wv0 s SER 127 CO 0.10 0.39 -0.06 -0.63 0.41 0.00 0.00 173.24 173.45 2wv0 s ILE 128 N -0.93 0.59 0.11 1.44 1.01 0.72 -1.49 121.20 122.65 2wv0 s ILE 128 Ca 0.14 -0.18 -0.31 0.00 0.00 0.00 0.00 60.65 60.29 2wv0 s ILE 128 Cb -0.12 -0.59 -0.08 0.00 0.01 0.00 0.00 42.46 41.68 2wv0 s ILE 128 CO 0.03 0.22 1.47 -1.00 0.00 0.00 0.00 174.94 175.67 2wv0 s HIS 129 N 0.69 3.04 -0.31 3.97 3.76 0.22 -0.51 115.29 126.14 2wv0 s HIS 129 Ca -0.10 0.77 -0.01 0.00 -0.15 0.00 0.00 55.06 55.57 2wv0 s HIS 129 Cb -0.13 -3.78 0.06 0.00 1.11 0.00 0.00 32.58 29.84 2wv0 s HIS 129 CO 0.01 -2.86 0.02 0.21 -0.85 0.00 0.00 174.74 171.27 2wv0 s LYS 130 N 1.48 2.32 -0.21 1.40 2.20 0.34 -1.00 119.74 126.27 2wv0 s LYS 130 Ca 0.67 -1.37 -0.01 0.00 -0.36 0.00 0.00 55.97 54.90 2wv0 s LYS 130 Cb -0.38 -3.22 0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2wv0 s LYS 130 CO 0.30 -0.69 -0.12 0.42 -0.36 0.00 0.00 175.35 174.90 2wv0 s ILE 131 N 1.21 2.69 -0.22 5.43 1.01 0.25 -1.67 121.20 129.89 2wv0 s ILE 131 Ca -0.03 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.81 2wv0 s ILE 131 Cb -0.20 -2.21 -0.00 0.00 0.01 0.00 0.00 42.46 40.05 2wv0 s ILE 131 CO -0.02 0.44 -0.04 -0.89 0.00 0.00 0.00 174.94 174.43 2wv0 s THR 132 N 1.37 3.30 0.10 2.92 2.01 -0.02 -0.28 115.64 125.03 2wv0 s THR 132 Ca 0.05 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.53 2wv0 s THR 132 Cb -0.14 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2wv0 s THR 132 CO -0.08 0.39 -0.14 -0.13 -0.69 0.00 0.00 174.62 173.97 2wv0 s ARG 133 N 1.46 0.92 -0.27 4.92 0.52 -0.28 -0.34 118.95 125.88 2wv0 s ARG 133 Ca 0.05 -1.12 -0.23 0.00 -0.52 0.00 0.00 55.73 53.91 2wv0 s ARG 133 Cb -0.15 -0.83 -0.01 0.00 0.52 0.00 0.00 34.95 34.49 2wv0 s ARG 133 CO -0.04 0.17 0.78 0.08 0.02 0.00 0.00 175.30 176.30 2wv0 s VAL 134 N -1.84 4.85 -0.08 3.52 1.01 -0.11 -1.20 120.40 126.54 2wv0 s VAL 134 Ca 0.04 1.34 -0.24 0.00 0.00 0.00 0.00 61.98 63.12 2wv0 s VAL 134 Cb -0.07 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2wv0 s VAL 134 CO 0.02 -0.12 0.75 -0.13 0.00 0.00 0.00 175.10 175.62 2wv0 s ARG 135 N 2.82 4.42 0.12 2.72 1.81 -0.30 -1.04 118.95 129.51 2wv0 s ARG 135 Ca 0.32 0.95 0.06 0.00 -1.72 0.00 0.00 55.73 55.34 2wv0 s ARG 135 Cb -0.15 -3.47 -0.04 0.00 -0.45 0.00 0.00 34.95 30.84 2wv0 s ARG 135 CO 0.09 -0.01 -0.04 -0.51 -0.68 0.00 0.00 175.30 174.15 2wv0 s LEU 136 N 1.05 3.25 -0.14 2.53 1.43 0.30 -0.39 118.68 126.71 2wv0 s LEU 136 Ca 0.39 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.15 2wv0 s LEU 136 Cb -0.18 -1.98 0.04 0.00 0.03 0.00 0.00 46.19 44.10 2wv0 s LEU 136 CO 0.18 0.15 -0.01 0.00 0.23 0.00 0.00 176.35 176.90 2wv0 s ALA 137 N -1.39 1.08 -1.37 4.21 0.00 0.62 -1.83 121.76 123.08 2wv0 s ALA 137 Ca 0.24 -0.53 -0.05 0.00 0.00 0.00 0.00 51.96 51.62 2wv0 s ALA 137 Cb -0.11 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.05 2wv0 s ALA 137 CO 0.17 -0.74 0.85 0.09 0.00 0.00 0.00 175.76 176.13 2wv0 n ASN 138 N 5.02 -2.79 -0.16 0.00 3.02 0.37 -2.33 115.26 118.39 2wv0 n ASN 138 Ca -0.10 -0.77 -0.02 0.00 -0.03 0.00 0.00 54.58 53.66 2wv0 n ASN 138 Cb 0.49 -4.17 -0.01 0.00 -0.61 0.00 0.00 39.78 35.48 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 -2.99 -4.87 -4.33 6.41 8.00 -1.26 -4.99 116.55 112.53 2wv0 n ASP 139 Ca -0.17 0.05 -0.32 0.00 0.71 0.00 0.00 54.79 55.06 2wv0 n ASP 139 Cb 0.62 -2.55 -0.15 0.00 -0.02 0.00 0.00 41.12 39.02 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 -1.54 2.54 0.17 0.53 1.01 -0.98 -5.08 121.20 117.84 2wv0 s ILE 140 Ca 0.00 -0.87 -0.33 0.00 0.00 0.00 0.00 60.65 59.44 2wv0 s ILE 140 Cb 0.00 -1.99 -0.15 0.00 0.01 0.00 0.00 42.46 40.33 2wv0 s ILE 140 CO 0.00 0.56 1.33 -2.65 0.00 0.00 0.00 174.94 174.18 2wv0 n PRO 141 N 3.14 1.53 -0.02 2.79 -0.02 -1.26 -0.28 135.00 140.88 2wv0 n PRO 141 Ca -0.18 0.55 -0.02 0.00 -2.02 0.00 0.00 63.50 61.83 2wv0 n PRO 141 Cb 0.52 -2.16 -0.02 0.00 -0.02 0.00 0.00 33.50 31.83 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 2.26 1.79 -3.59 -0.52 1.56 0.48 -4.77 117.12 114.34 2wv0 n MET 142 Ca 0.15 0.01 -0.13 0.00 -0.27 0.00 0.00 57.70 57.47 2wv0 n MET 142 Cb 0.26 -1.07 -0.05 0.00 2.15 0.00 0.00 33.22 34.51 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 -2.07 -1.19 -0.19 -5.12 0.00 -1.01 -1.66 121.76 110.52 2wv0 s ALA 143 Ca -0.03 0.36 -0.06 0.00 0.00 0.00 0.00 51.96 52.23 2wv0 s ALA 143 Cb 0.01 0.52 -0.03 0.00 0.00 0.00 0.00 23.12 23.62 2wv0 s ALA 143 CO 0.10 -0.56 0.02 0.42 0.00 0.00 0.00 175.76 175.73 2wv0 s ILE 144 N -2.96 4.23 -0.08 0.00 1.01 -0.38 -1.15 121.20 121.87 2wv0 s ILE 144 Ca -0.02 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.43 2wv0 s ILE 144 Cb -0.00 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.57 2wv0 s ILE 144 CO -0.06 0.44 -0.15 -0.70 0.00 0.00 0.00 174.94 174.47 2wv0 s GLU 145 N 0.72 2.08 -0.23 2.79 2.12 -0.35 -1.24 118.70 124.60 2wv0 s GLU 145 Ca 0.01 -0.54 0.00 0.00 0.36 0.00 0.00 54.97 54.80 2wv0 s GLU 145 Cb -0.14 -1.66 0.03 0.00 0.26 0.00 0.00 34.13 32.62 2wv0 s GLU 145 CO 0.02 0.06 -0.12 0.45 -0.54 0.00 0.00 175.26 175.14 2wv0 s SER 146 N 0.59 3.95 -0.09 -1.70 0.15 -0.05 -1.12 113.70 115.43 2wv0 s SER 146 Ca -0.15 -0.88 0.02 0.00 0.70 0.00 0.00 55.95 55.64 2wv0 s SER 146 Cb -0.16 -1.59 0.01 0.00 -1.71 0.00 0.00 66.02 62.57 2wv0 s SER 146 CO 0.05 -0.09 -0.15 -0.55 1.20 0.00 0.00 173.24 173.70 2wv0 s SER 147 N 1.28 2.28 -0.19 5.45 0.15 0.61 -0.94 113.70 122.35 2wv0 s SER 147 Ca 0.00 -0.40 -0.04 0.00 0.70 0.00 0.00 55.95 56.21 2wv0 s SER 147 Cb -0.16 -1.03 -0.02 0.00 -1.71 0.00 0.00 66.02 63.10 2wv0 s SER 147 CO -0.07 0.04 -0.02 -1.00 1.20 0.00 0.00 173.24 173.39 2wv0 s HIS 148 N 0.80 3.02 -0.06 3.44 3.76 0.02 -0.59 115.29 125.68 2wv0 s HIS 148 Ca -0.11 -0.44 -0.01 0.00 -0.15 0.00 0.00 55.06 54.35 2wv0 s HIS 148 Cb -0.16 -2.04 0.03 0.00 1.11 0.00 0.00 32.58 31.52 2wv0 s HIS 148 CO 0.02 -0.19 -0.00 0.42 -0.85 0.00 0.00 174.74 174.13 2wv0 s ILE 149 N 0.81 0.35 0.14 0.60 1.01 -0.17 -1.70 121.20 122.23 2wv0 s ILE 149 Ca -0.00 0.10 -0.35 0.00 0.00 0.00 0.00 60.65 60.40 2wv0 s ILE 149 Cb -0.14 -0.48 -0.15 0.00 0.01 0.00 0.00 42.46 41.69 2wv0 s ILE 149 CO 0.02 0.24 1.43 -2.65 0.00 0.00 0.00 174.94 173.98 2wv0 n PRO 150 N 4.87 1.65 -0.24 2.79 -0.02 -1.26 0.72 135.00 143.51 2wv0 n PRO 150 Ca -0.12 0.59 0.04 0.00 -2.02 0.00 0.00 63.50 62.00 2wv0 n PRO 150 Cb 0.50 -2.28 0.17 0.00 -0.02 0.00 0.00 33.50 31.87 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 5.03 0.43 0.00 6.00 3.57 -1.60 -2.39 116.94 127.98 2wv0 h PHE 151 Ca -0.46 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.08 2wv0 h PHE 151 Cb 1.30 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.95 2wv0 h PHE 151 CO 0.60 0.04 0.00 0.39 -2.23 0.00 0.00 178.31 177.11 2wv0 n GLU 152 N -5.03 0.04 0.00 1.11 -0.58 -1.26 0.01 120.64 114.92 2wv0 n GLU 152 Ca 0.13 0.27 0.10 0.00 -0.42 0.00 0.00 57.16 57.23 2wv0 n GLU 152 Cb 0.39 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.80 2wv0 n GLU 152 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2wv0 n LEU 153 N -1.45 2.29 0.00 -4.62 4.77 -0.90 -4.54 117.00 112.55 2wv0 n LEU 153 Ca 0.04 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 2wv0 n LEU 153 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2wv0 n LEU 153 CO 0.11 0.41 -0.21 0.00 -1.33 0.00 0.00 177.39 176.37 2wv0 n ALA 154 N 0.56 1.11 -0.62 -1.18 0.00 -0.75 -4.69 120.51 114.94 2wv0 n ALA 154 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2wv0 n ALA 154 Cb 0.46 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 1.28 0.08 3.75 0.00 0.00 0.10 -4.75 105.19 105.64 2wv0 n GLY 155 Ca 0.00 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 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 4.42 -0.10 1.61 2.02 -1.26 -4.92 118.70 120.47 2wv0 s GLU 156 Ca 0.00 2.06 0.03 0.00 0.02 0.00 0.00 54.97 57.08 2wv0 s GLU 156 Cb 0.00 -3.16 0.01 0.00 0.10 0.00 0.00 34.13 31.08 2wv0 s GLU 156 CO 0.00 -0.16 -0.20 -0.51 0.02 0.00 0.00 175.26 174.41 2wv0 s LEU 157 N -0.84 1.97 0.00 1.80 1.02 -1.26 -5.09 118.68 116.28 2wv0 s LEU 157 Ca 0.52 -0.50 0.01 0.00 0.02 0.00 0.00 54.13 54.18 2wv0 s LEU 157 Cb -0.37 -1.27 -0.00 0.00 0.02 0.00 0.00 46.19 44.57 2wv0 s LEU 157 CO 0.43 0.11 0.03 -0.46 0.02 0.00 0.00 176.35 176.48 2wv0 n ASN 158 N 3.74 1.55 0.18 2.29 0.23 -1.26 -5.02 115.26 116.97 2wv0 n ASN 158 Ca -0.20 -1.71 0.17 0.00 -0.53 0.00 0.00 54.58 52.31 2wv0 n ASN 158 Cb 0.52 0.26 0.78 0.00 -2.08 0.00 0.00 39.78 39.26 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 0.00 0.00 -3.83 4.57 -2.00 0.29 114.58 113.61 2wv0 h GLU 159 Ca -0.11 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.97 2wv0 h GLU 159 Cb 0.40 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2wv0 h GLU 159 CO 0.19 0.00 -0.47 0.66 -1.18 0.00 0.00 179.01 178.20 2wv0 h SER 160 N 0.00 0.00 -0.10 1.04 4.64 -1.98 -2.47 113.55 114.68 2wv0 h SER 160 Ca 0.10 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.25 2wv0 h SER 160 Cb 0.51 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.61 2wv0 h SER 160 CO -0.00 0.47 -0.61 0.45 -0.87 0.00 0.00 176.83 176.27 2wv0 h HIS 161 N 0.00 0.82 -0.08 4.77 3.86 -1.32 -3.22 115.15 119.97 2wv0 h HIS 161 Ca -0.00 -0.37 -0.07 0.00 -1.16 0.00 0.00 60.37 58.77 2wv0 h HIS 161 Cb 1.22 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 29.56 2wv0 h HIS 161 CO 0.00 1.17 -0.26 0.74 0.86 0.00 0.00 177.93 180.44 2wv0 h PHE 162 N 0.23 0.16 -0.01 2.45 0.04 -1.43 -2.67 116.94 115.71 2wv0 h PHE 162 Ca -0.05 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2wv0 h PHE 162 Cb 1.26 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.37 2wv0 h PHE 162 CO 0.11 0.40 -0.07 1.04 -0.60 0.00 0.00 178.31 179.20 2wv0 n GLN 163 N -4.18 1.38 0.00 1.51 6.02 -0.94 -4.62 117.38 116.56 2wv0 n GLN 163 Ca -0.01 -0.76 0.00 0.00 -0.01 0.00 0.00 57.00 56.21 2wv0 n GLN 163 Cb 0.35 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.13 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 -0.14 0.96 -4.62 1.08 3.41 -1.01 -4.33 113.62 108.97 2wv0 n SER 164 Ca 0.17 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.36 2wv0 n SER 164 Cb 0.34 0.00 -0.04 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 1.00 6.73 0.20 4.04 0.15 -1.26 -4.93 113.70 119.62 2wv0 s SER 165 Ca 0.00 0.78 -0.04 0.00 0.70 0.00 0.00 55.95 57.39 2wv0 s SER 165 Cb 0.00 -2.43 0.13 0.00 -1.71 0.00 0.00 66.02 62.01 2wv0 s SER 165 CO 0.00 -0.64 1.55 0.40 1.20 0.00 0.00 173.24 175.76 2wv0 h ILE 166 N 5.59 1.29 -0.99 6.45 2.04 -1.95 -2.46 117.51 127.48 2wv0 h ILE 166 Ca -0.23 -1.57 0.12 0.00 1.00 0.00 0.00 64.86 64.17 2wv0 h ILE 166 Cb 1.09 1.50 -0.08 0.00 -0.74 0.00 0.00 36.82 38.59 2wv0 h ILE 166 CO 0.90 0.51 0.63 1.88 0.00 0.00 0.00 178.15 182.07 2wv0 h TYR 167 N 0.56 1.13 -0.28 1.37 0.99 -1.98 -1.28 116.97 117.48 2wv0 h TYR 167 Ca 0.05 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.74 2wv0 h TYR 167 Cb 0.93 -0.36 -0.01 0.00 1.00 0.00 0.00 36.73 38.29 2wv0 h TYR 167 CO 0.04 0.46 -0.08 0.22 -0.00 0.00 0.00 178.16 178.81 2wv0 h ASP 168 N 0.99 0.56 -0.40 3.88 3.58 -1.88 -2.68 116.42 120.48 2wv0 h ASP 168 Ca 0.49 -0.37 0.00 0.00 0.42 0.00 0.00 57.03 57.57 2wv0 h ASP 168 Cb 0.47 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.35 2wv0 h ASP 168 CO -0.25 0.80 0.26 -0.74 -2.88 0.00 0.00 179.24 176.43 2wv0 h HIS 169 N 0.31 0.51 -0.80 0.28 2.76 -1.00 -2.15 115.15 115.05 2wv0 h HIS 169 Ca 0.07 0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.34 2wv0 h HIS 169 Cb 0.56 -0.17 -0.07 0.00 1.55 0.00 0.00 27.41 29.28 2wv0 h HIS 169 CO 0.05 0.33 0.45 0.82 -1.30 0.00 0.00 177.93 178.29 2wv0 h ILE 170 N 0.54 0.91 -0.20 6.26 1.08 -1.10 0.48 117.51 125.49 2wv0 h ILE 170 Ca 0.15 -0.26 -0.17 0.00 -0.39 0.00 0.00 64.86 64.18 2wv0 h ILE 170 Cb -0.04 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 33.78 2wv0 h ILE 170 CO -0.03 0.14 -0.54 -0.33 -0.69 0.00 0.00 178.15 176.70 2wv0 h GLU 171 N 0.77 0.72 -0.35 2.37 5.08 -1.31 -1.65 114.58 120.21 2wv0 h GLU 171 Ca 0.39 -0.51 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2wv0 h GLU 171 Cb 0.35 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2wv0 h GLU 171 CO -0.24 1.13 0.11 0.00 -1.00 0.00 0.00 179.01 179.01 2wv0 h ARG 172 N 0.44 0.54 -0.23 2.33 3.08 -1.03 0.02 114.38 119.53 2wv0 h ARG 172 Ca -0.01 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.88 2wv0 h ARG 172 Cb 1.16 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 2wv0 h ARG 172 CO 0.12 0.56 -0.05 -0.92 -1.07 0.00 0.00 179.97 178.60 2wv0 h TYR 173 N 0.41 0.49 0.00 3.04 5.03 -0.04 -3.22 116.97 122.68 2wv0 h TYR 173 Ca 0.11 -0.10 0.00 0.00 2.58 0.00 0.00 58.73 61.32 2wv0 h TYR 173 Cb 0.24 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 38.40 2wv0 h TYR 173 CO 0.01 0.66 -0.54 -0.91 -1.32 0.00 0.00 178.16 176.06 2wv0 h ASN 174 N 0.17 0.00 -1.69 -2.11 2.35 -1.36 -3.48 115.58 109.46 2wv0 h ASN 174 Ca 0.06 -0.04 -0.41 0.00 -0.55 0.00 0.00 56.30 55.36 2wv0 h ASN 174 Cb 0.50 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.75 2wv0 h ASN 174 CO 0.02 0.02 -0.42 -1.20 -1.65 0.00 0.00 177.43 174.20 2wv0 n SER 175 N -2.66 -5.44 -4.17 5.81 7.64 -0.01 -5.00 113.62 109.79 2wv0 n SER 175 Ca 0.02 0.34 -0.28 0.00 1.01 0.00 0.00 58.87 59.96 2wv0 n SER 175 Cb 0.51 -4.72 -0.16 0.00 -1.01 0.00 0.00 64.21 58.82 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 -2.80 1.65 0.46 0.44 1.01 -1.23 -5.05 121.20 115.68 2wv0 s ILE 176 Ca 0.00 -0.83 -0.23 0.00 0.00 0.00 0.00 60.65 59.59 2wv0 s ILE 176 Cb 0.00 -1.42 -0.07 0.00 0.01 0.00 0.00 42.46 40.98 2wv0 s ILE 176 CO 0.00 0.47 1.19 -2.84 0.00 0.00 0.00 174.94 173.76 2wv0 s PRO 177 N 0.06 3.75 0.32 2.79 0.02 -1.26 -4.46 135.00 136.22 2wv0 s PRO 177 Ca -0.06 1.84 -0.29 0.00 0.02 0.00 0.00 61.00 62.51 2wv0 s PRO 177 Cb -0.13 -2.44 -0.10 0.00 0.02 0.00 0.00 34.50 31.84 2wv0 s PRO 177 CO 0.03 -0.58 1.27 0.42 -0.33 0.00 0.00 177.00 177.82 2wv0 s ILE 178 N -1.50 2.87 0.00 2.83 1.01 -1.26 -0.48 121.20 124.68 2wv0 s ILE 178 Ca 0.63 0.88 0.00 0.00 0.00 0.00 0.00 60.65 62.16 2wv0 s ILE 178 Cb -0.30 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.61 2wv0 s ILE 178 CO 0.37 0.21 0.00 -1.54 0.00 0.00 0.00 174.94 173.98 2wv0 n SER 179 N 0.94 1.60 -3.71 3.58 3.41 0.30 -4.71 113.62 115.03 2wv0 n SER 179 Ca -0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 2wv0 n SER 179 Cb 0.42 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 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 -1.96 1.84 0.02 4.33 1.70 -1.18 -4.99 118.95 118.70 2wv0 s ARG 180 Ca 0.00 -1.12 0.01 0.00 -0.47 0.00 0.00 55.73 54.15 2wv0 s ARG 180 Cb 0.00 0.59 -0.01 0.00 -0.57 0.00 0.00 34.95 34.96 2wv0 s ARG 180 CO 0.00 -0.83 -0.04 0.00 -1.08 0.00 0.00 175.30 173.35 2wv0 s ALA 181 N -3.64 0.28 -0.14 7.88 0.00 -1.26 0.18 121.76 125.07 2wv0 s ALA 181 Ca 0.14 -0.41 -0.06 0.00 0.00 0.00 0.00 51.96 51.62 2wv0 s ALA 181 Cb -0.05 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 2wv0 s ALA 181 CO 0.08 -0.02 0.08 0.21 0.00 0.00 0.00 175.76 176.11 2wv0 s LYS 182 N -0.84 3.58 -0.02 0.00 2.20 0.34 -4.98 119.74 120.01 2wv0 s LYS 182 Ca -0.06 -0.28 -0.02 0.00 -0.36 0.00 0.00 55.97 55.25 2wv0 s LYS 182 Cb -0.06 -3.12 0.01 0.00 -1.51 0.00 0.00 37.83 33.15 2wv0 s LYS 182 CO -0.00 0.55 0.06 -1.14 -0.36 0.00 0.00 175.35 174.46 2wv0 s GLN 183 N -0.40 0.07 -0.05 4.03 0.74 -1.26 -1.25 119.66 121.53 2wv0 s GLN 183 Ca 0.10 0.09 0.02 0.00 0.05 0.00 0.00 55.36 55.62 2wv0 s GLN 183 Cb -0.12 0.02 0.01 0.00 1.10 0.00 0.00 33.01 34.03 2wv0 s GLN 183 CO 0.02 -0.01 -0.10 -1.21 -0.55 0.00 0.00 175.29 173.43 2wv0 s GLU 184 N 0.08 1.30 -0.06 1.67 2.02 -0.01 -4.99 118.70 118.70 2wv0 s GLU 184 Ca -0.00 -0.33 0.04 0.00 0.02 0.00 0.00 54.97 54.70 2wv0 s GLU 184 Cb -0.01 -1.14 -0.00 0.00 0.10 0.00 0.00 34.13 33.08 2wv0 s GLU 184 CO -0.00 0.05 -0.18 -0.51 0.02 0.00 0.00 175.26 174.63 2wv0 s LEU 185 N 0.53 1.91 -0.09 1.80 1.02 -1.26 -0.88 118.68 121.70 2wv0 s LEU 185 Ca -0.10 -0.39 -0.06 0.00 0.02 0.00 0.00 54.13 53.60 2wv0 s LEU 185 Cb -0.13 -1.05 0.04 0.00 0.02 0.00 0.00 46.19 45.06 2wv0 s LEU 185 CO 0.02 0.14 0.23 -0.70 0.02 0.00 0.00 176.35 176.06 2wv0 s GLU 186 N 0.17 0.22 0.16 1.70 2.12 -0.54 -4.99 118.70 117.54 2wv0 s GLU 186 Ca -0.08 0.42 -0.27 0.00 0.36 0.00 0.00 54.97 55.40 2wv0 s GLU 186 Cb -0.13 -0.02 -0.08 0.00 0.26 0.00 0.00 34.13 34.16 2wv0 s GLU 186 CO 0.04 -0.11 0.85 -1.25 -0.54 0.00 0.00 175.26 174.25 2wv0 s PRO 187 N 0.76 4.67 0.00 4.30 0.04 -1.26 -0.57 135.00 142.94 2wv0 s PRO 187 Ca -0.05 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.28 2wv0 s PRO 187 Cb -0.07 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 2wv0 s PRO 187 CO -0.05 0.46 0.00 0.45 0.04 0.00 0.00 177.00 177.91 2wv0 n SER 188 N 1.91 0.05 -4.36 6.66 2.88 -0.25 -4.92 113.62 115.59 2wv0 n SER 188 Ca -0.03 -1.00 -0.31 0.00 -1.33 0.00 0.00 58.87 56.20 2wv0 n SER 188 Cb 0.48 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.80 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 -2.00 2.32 0.24 -1.46 0.00 -1.26 -1.53 121.76 118.07 2wv0 s ALA 189 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 51.96 50.48 2wv0 s ALA 189 Cb 0.00 -0.59 -0.10 0.00 0.00 0.00 0.00 23.12 22.43 2wv0 s ALA 189 CO 0.00 0.54 1.49 0.00 0.00 0.00 0.00 175.76 177.80 2wv0 s ALA 190 N -0.75 3.68 0.83 0.00 0.00 0.08 -4.78 121.76 120.81 2wv0 s ALA 190 Ca 0.12 1.39 -0.12 0.00 0.00 0.00 0.00 51.96 53.35 2wv0 s ALA 190 Cb -0.10 -3.59 0.09 0.00 0.00 0.00 0.00 23.12 19.52 2wv0 s ALA 190 CO 0.01 -0.80 1.11 0.95 0.00 0.00 0.00 175.76 177.03 2wv0 s THR 191 N 0.18 2.77 0.16 0.00 -4.23 -1.26 -0.40 115.64 112.86 2wv0 s THR 191 Ca 0.62 0.25 -0.21 0.00 -1.18 0.00 0.00 61.69 61.17 2wv0 s THR 191 Cb -0.43 -3.01 0.06 0.00 1.34 0.00 0.00 72.50 70.46 2wv0 s THR 191 CO 0.42 -0.33 1.62 0.74 -0.54 0.00 0.00 174.62 176.54 2wv0 h THR 192 N -1.19 0.37 -0.02 3.99 2.02 -1.96 0.08 112.91 116.20 2wv0 h THR 192 Ca -0.48 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 66.56 2wv0 h THR 192 Cb 1.29 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 2wv0 h THR 192 CO 0.60 0.00 -0.65 1.05 0.37 0.00 0.00 175.52 176.89 2wv0 h GLU 193 N -0.21 0.07 -0.43 6.66 9.09 -1.99 -1.96 114.58 125.80 2wv0 h GLU 193 Ca 0.17 -0.05 -0.10 0.00 0.05 0.00 0.00 59.36 59.42 2wv0 h GLU 193 Cb 0.47 0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.56 2wv0 h GLU 193 CO -0.45 0.69 -0.13 0.93 0.05 0.00 0.00 179.01 180.10 2wv0 h GLU 194 N 0.05 0.85 -0.69 1.06 5.08 -1.83 -2.26 114.58 116.84 2wv0 h GLU 194 Ca -0.01 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 2wv0 h GLU 194 Cb 1.16 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 2wv0 h GLU 194 CO 0.09 0.98 0.37 0.00 -1.00 0.00 0.00 179.01 179.44 2wv0 h ALA 195 N 0.85 0.89 -0.17 3.43 0.00 -0.85 0.49 119.26 123.90 2wv0 h ALA 195 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2wv0 h ALA 195 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2wv0 h ALA 195 CO 0.05 0.41 0.08 -0.91 0.00 0.00 0.00 179.25 178.88 2wv0 h ASN 196 N 0.95 0.22 -0.33 0.00 2.35 -1.28 0.90 115.58 118.39 2wv0 h ASN 196 Ca 0.24 -0.12 -0.16 0.00 -0.55 0.00 0.00 56.30 55.71 2wv0 h ASN 196 Cb 0.06 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 2wv0 h ASN 196 CO -0.04 0.28 -0.41 0.40 -1.65 0.00 0.00 177.43 176.01 2wv0 h ILE 197 N 0.15 1.28 0.00 2.81 2.04 -1.30 -3.17 117.51 119.31 2wv0 h ILE 197 Ca 0.06 -1.59 0.00 0.00 1.00 0.00 0.00 64.86 64.33 2wv0 h ILE 197 Cb 0.12 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2wv0 h ILE 197 CO -0.01 0.52 0.00 0.18 0.00 0.00 0.00 178.15 178.85 2wv0 n LEU 198 N -4.09 0.56 -0.10 1.44 4.77 0.15 -4.84 117.00 114.89 2wv0 n LEU 198 Ca -0.03 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2wv0 n LEU 198 Cb 0.55 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2wv0 n LEU 198 CO 0.48 -0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 2wv0 n GLY 199 N 0.89 0.52 3.45 -0.72 0.00 -0.12 -4.67 105.19 104.54 2wv0 n GLY 199 Ca 0.05 -0.83 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.19 0.95 0.31 -0.61 -4.36 0.12 -5.05 121.20 110.37 2wv0 s ILE 200 Ca 0.00 -2.00 -0.28 0.00 -0.26 0.00 0.00 60.65 58.11 2wv0 s ILE 200 Cb 0.00 -2.66 -0.09 0.00 1.25 0.00 0.00 42.46 40.96 2wv0 s ILE 200 CO 0.00 0.00 1.11 -1.10 0.24 0.00 0.00 174.94 175.19 2wv0 s GLN 201 N -3.87 4.51 0.03 0.37 -0.21 -1.26 -4.21 119.66 115.02 2wv0 s GLN 201 Ca 0.33 1.79 -0.36 0.00 0.02 0.00 0.00 55.36 57.15 2wv0 s GLN 201 Cb 0.07 -3.05 -0.15 0.00 1.00 0.00 0.00 33.01 30.88 2wv0 s GLN 201 CO 0.15 0.09 1.55 1.17 -2.12 0.00 0.00 175.29 176.13 2wv0 n LYS 202 N 0.90 1.61 -0.76 2.91 4.81 -1.26 -1.52 118.16 124.85 2wv0 n LYS 202 Ca 0.00 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 2wv0 n LYS 202 Cb 0.45 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.20 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 3.31 0.81 3.76 3.14 0.00 0.46 -4.91 105.19 111.76 2wv0 n GLY 203 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.11 2.49 0.23 4.61 0.00 -0.58 -4.21 121.76 121.20 2wv0 s ALA 204 Ca 0.00 0.84 -0.32 0.00 0.00 0.00 0.00 51.96 52.49 2wv0 s ALA 204 Cb 0.00 -3.40 -0.13 0.00 0.00 0.00 0.00 23.12 19.58 2wv0 s ALA 204 CO 0.00 -1.22 1.42 -2.30 0.00 0.00 0.00 175.76 173.66 2wv0 n PRO 205 N -1.89 2.02 -3.93 0.00 -0.02 -1.26 -0.74 135.00 129.18 2wv0 n PRO 205 Ca 0.12 0.72 -0.10 0.00 -2.02 0.00 0.00 63.50 62.22 2wv0 n PRO 205 Cb 0.51 -2.38 -0.11 0.00 -0.02 0.00 0.00 33.50 31.49 2wv0 n PRO 205 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wv0 s VAL 206 N 0.02 0.09 -0.23 -1.45 0.11 -0.58 -1.48 120.40 116.87 2wv0 s VAL 206 Ca 0.69 -0.73 -0.05 0.00 -2.93 0.00 0.00 61.98 58.97 2wv0 s VAL 206 Cb -0.66 -0.29 -0.01 0.00 -1.53 0.00 0.00 36.38 33.89 2wv0 s VAL 206 CO 0.49 -0.40 -0.01 -0.22 -3.33 0.00 0.00 175.10 171.63 2wv0 s LEU 207 N -1.25 3.09 -0.38 2.54 2.96 0.51 -1.09 118.68 125.06 2wv0 s LEU 207 Ca -0.14 -0.37 -0.22 0.00 -0.22 0.00 0.00 54.13 53.18 2wv0 s LEU 207 Cb -0.08 -1.79 0.01 0.00 0.50 0.00 0.00 46.19 44.83 2wv0 s LEU 207 CO -0.00 -0.03 0.74 -0.76 -1.32 0.00 0.00 176.35 174.97 2wv0 s LEU 208 N 1.51 4.20 -0.22 -0.68 1.02 0.26 -0.48 118.68 124.29 2wv0 s LEU 208 Ca 0.06 0.20 -0.01 0.00 0.02 0.00 0.00 54.13 54.39 2wv0 s LEU 208 Cb -0.15 -2.94 0.02 0.00 0.02 0.00 0.00 46.19 43.14 2wv0 s LEU 208 CO -0.01 -0.73 -0.10 -0.63 0.02 0.00 0.00 176.35 174.89 2wv0 s ILE 209 N 3.02 2.71 -0.23 -0.59 1.01 -0.22 -1.47 121.20 125.43 2wv0 s ILE 209 Ca 0.29 -0.87 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 2wv0 s ILE 209 Cb -0.13 -2.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 2wv0 s ILE 209 CO 0.17 0.36 0.06 -0.75 0.00 0.00 0.00 174.94 174.79 2wv0 s LYS 210 N 1.35 3.69 -0.04 2.79 2.20 -0.06 -0.58 119.74 129.09 2wv0 s LYS 210 Ca 0.03 -0.47 0.01 0.00 -0.36 0.00 0.00 55.97 55.18 2wv0 s LYS 210 Cb -0.15 -3.28 0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2wv0 s LYS 210 CO -0.07 -0.10 -0.01 0.50 -0.36 0.00 0.00 175.35 175.31 2wv0 s ARG 211 N 1.36 0.50 -0.23 4.03 3.52 -0.03 -0.83 118.95 127.27 2wv0 s ARG 211 Ca 0.05 0.02 -0.06 0.00 -0.13 0.00 0.00 55.73 55.60 2wv0 s ARG 211 Cb -0.15 -0.64 -0.02 0.00 -1.56 0.00 0.00 34.95 32.58 2wv0 s ARG 211 CO 0.03 -0.13 0.04 0.99 -0.81 0.00 0.00 175.30 175.42 2wv0 s THR 212 N 1.05 4.10 0.07 4.11 2.01 -0.38 -0.49 115.64 126.10 2wv0 s THR 212 Ca -0.09 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 61.72 2wv0 s THR 212 Cb -0.14 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2wv0 s THR 212 CO -0.01 0.38 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.29 2wv0 s THR 213 N 1.40 3.26 0.05 -0.82 2.01 -0.66 -0.50 115.64 120.38 2wv0 s THR 213 Ca 0.05 -1.17 0.05 0.00 0.31 0.00 0.00 61.69 60.93 2wv0 s THR 213 Cb -0.15 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.87 2wv0 s THR 213 CO 0.02 0.22 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.72 2wv0 s TYR 214 N -1.10 1.22 0.63 4.92 2.02 0.13 -2.03 117.35 123.13 2wv0 s TYR 214 Ca 0.19 -0.39 -0.09 0.00 -0.37 0.00 0.00 57.07 56.41 2wv0 s TYR 214 Cb -0.11 -0.71 -0.00 0.00 -0.40 0.00 0.00 41.96 40.74 2wv0 s TYR 214 CO 0.10 0.04 0.98 -0.51 -1.57 0.00 0.00 175.55 174.60 2wv0 s LEU 215 N -1.37 3.16 0.53 -1.29 1.43 0.69 -0.54 118.68 121.29 2wv0 s LEU 215 Ca 0.00 1.02 0.25 0.00 -1.03 0.00 0.00 54.13 54.37 2wv0 s LEU 215 Cb -0.09 -3.89 1.40 0.00 0.03 0.00 0.00 46.19 43.64 2wv0 s LEU 215 CO 0.02 -1.07 2.01 -0.61 0.23 0.00 0.00 176.35 176.92 2wv0 h GLN 216 N -0.33 0.00 0.00 1.70 4.15 -1.06 0.15 115.11 119.72 2wv0 h GLN 216 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.97 2wv0 h GLN 216 Cb 1.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.93 2wv0 h GLN 216 CO 0.62 0.00 0.00 0.27 -1.93 0.00 0.00 178.83 177.79 2wv0 n ASN 217 N -4.34 0.00 0.00 -0.69 0.23 -1.26 -4.90 115.26 104.30 2wv0 n ASN 217 Ca 0.08 -0.92 0.00 0.00 -0.53 0.00 0.00 54.58 53.21 2wv0 n ASN 217 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 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 0.83 0.81 3.71 4.83 0.00 0.54 -5.04 105.19 110.87 2wv0 n GLY 218 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.20 4.43 -0.02 2.61 2.01 -1.25 -4.79 115.64 115.43 2wv0 s THR 219 Ca 0.00 1.74 -0.30 0.00 0.31 0.00 0.00 61.69 63.44 2wv0 s THR 219 Cb 0.00 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 2wv0 s THR 219 CO 0.00 0.12 1.12 0.00 -0.69 0.00 0.00 174.62 175.17 2wv0 s ALA 220 N 1.16 3.38 -0.10 7.40 0.00 -1.26 -0.22 121.76 132.12 2wv0 s ALA 220 Ca 0.55 0.63 0.05 0.00 0.00 0.00 0.00 51.96 53.20 2wv0 s ALA 220 Cb -0.25 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.35 2wv0 s ALA 220 CO 0.28 -0.53 0.16 1.97 0.00 0.00 0.00 175.76 177.63 2wv0 n PHE 221 N 4.54 0.00 -3.77 0.00 -1.74 -0.86 -4.90 117.46 110.73 2wv0 n PHE 221 Ca 0.09 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.85 2wv0 n PHE 221 Cb 0.48 -0.08 -0.13 0.00 1.52 0.00 0.00 39.48 41.27 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 -2.06 0.21 -0.21 3.97 2.12 -1.23 -4.05 118.70 117.45 2wv0 s GLU 222 Ca -0.01 0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.72 2wv0 s GLU 222 Cb 0.04 -0.00 0.04 0.00 0.26 0.00 0.00 34.13 34.47 2wv0 s GLU 222 CO 0.23 -0.09 -0.14 -1.58 -0.54 0.00 0.00 175.26 173.13 2wv0 s HIS 223 N 0.63 2.84 0.06 5.30 5.65 -0.69 -1.66 115.29 127.43 2wv0 s HIS 223 Ca -0.04 -1.86 0.09 0.00 0.25 0.00 0.00 55.06 53.50 2wv0 s HIS 223 Cb -0.06 -1.85 -0.03 0.00 -1.18 0.00 0.00 32.58 29.46 2wv0 s HIS 223 CO -0.03 -0.81 -0.26 0.00 -0.65 0.00 0.00 174.74 172.99 2wv0 s ALA 224 N 1.26 2.31 -0.11 1.58 0.00 0.35 -0.80 121.76 126.35 2wv0 s ALA 224 Ca -0.01 -1.29 0.01 0.00 0.00 0.00 0.00 51.96 50.67 2wv0 s ALA 224 Cb -0.16 -0.49 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2wv0 s ALA 224 CO -0.09 0.54 -0.13 0.15 0.00 0.00 0.00 175.76 176.22 2wv0 s LYS 225 N -1.38 2.06 0.12 0.00 1.02 -0.11 -0.85 119.74 120.60 2wv0 s LYS 225 Ca 0.12 -0.49 0.06 0.00 0.02 0.00 0.00 55.97 55.68 2wv0 s LYS 225 Cb -0.10 -1.83 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 2wv0 s LYS 225 CO 0.03 -0.12 -0.14 -1.12 -0.92 0.00 0.00 175.35 173.08 2wv0 s SER 226 N 1.18 1.99 -0.22 2.83 0.01 0.26 -0.87 113.70 118.88 2wv0 s SER 226 Ca -0.03 -0.81 0.01 0.00 1.31 0.00 0.00 55.95 56.43 2wv0 s SER 226 Cb -0.14 -0.07 0.05 0.00 0.21 0.00 0.00 66.02 66.07 2wv0 s SER 226 CO -0.04 -0.14 -0.09 -0.69 0.41 0.00 0.00 173.24 172.68 2wv0 s VAL 227 N -2.14 1.69 -0.04 3.43 1.01 -0.37 -1.06 120.40 122.91 2wv0 s VAL 227 Ca 0.09 -1.15 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 2wv0 s VAL 227 Cb -0.05 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 2wv0 s VAL 227 CO 0.03 0.07 0.03 -0.31 0.00 0.00 0.00 175.10 174.93 2wv0 s TYR 228 N 1.35 3.20 0.10 5.22 2.02 0.37 -1.25 117.35 128.37 2wv0 s TYR 228 Ca -0.03 0.19 -0.30 0.00 -0.37 0.00 0.00 57.07 56.55 2wv0 s TYR 228 Cb -0.17 -1.76 -0.07 0.00 -0.40 0.00 0.00 41.96 39.56 2wv0 s TYR 228 CO -0.07 0.51 1.21 -0.98 -1.57 0.00 0.00 175.55 174.65 2wv0 s ARG 229 N -1.29 4.44 0.33 -0.62 1.70 -0.66 -0.37 118.95 122.48 2wv0 s ARG 229 Ca 0.18 1.82 0.08 0.00 -0.47 0.00 0.00 55.73 57.34 2wv0 s ARG 229 Cb -0.12 -3.31 0.59 0.00 -0.57 0.00 0.00 34.95 31.55 2wv0 s ARG 229 CO 0.08 -0.21 1.79 0.78 -1.08 0.00 0.00 175.30 176.65 2wv0 h GLY 230 N 6.31 0.25 2.00 3.88 0.00 -1.53 -1.15 103.07 112.83 2wv0 h GLY 230 Ca -0.43 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 46.66 2wv0 h GLY 230 CO 0.80 0.18 -0.23 1.29 0.00 0.00 0.00 176.54 178.58 2wv0 h ASP 231 N 0.20 0.00 0.00 0.19 2.03 -1.92 -3.28 116.42 113.64 2wv0 h ASP 231 Ca 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 2wv0 h ASP 231 Cb 0.64 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 2wv0 h ASP 231 CO 0.05 0.23 -0.43 0.54 -1.03 0.00 0.00 179.24 178.60 2wv0 n ARG 232 N -3.81 4.23 -4.99 4.15 1.74 -1.15 -5.04 116.66 111.79 2wv0 n ARG 232 Ca -0.02 -0.01 -0.28 0.00 -0.77 0.00 0.00 57.85 56.78 2wv0 n ARG 232 Cb 0.33 -0.87 -0.16 0.00 -1.02 0.00 0.00 32.46 30.73 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 -1.76 2.01 -0.03 -1.55 6.14 -0.45 -5.05 117.35 116.67 2wv0 s TYR 233 Ca 0.02 -0.64 0.03 0.00 0.64 0.00 0.00 57.07 57.13 2wv0 s TYR 233 Cb 0.05 -1.35 -0.00 0.00 0.42 0.00 0.00 41.96 41.08 2wv0 s TYR 233 CO 0.30 -0.22 -0.12 0.99 0.64 0.00 0.00 175.55 177.14 2wv0 s THR 234 N 0.07 0.99 -0.20 4.34 2.01 -1.26 -4.65 115.64 116.94 2wv0 s THR 234 Ca -0.07 -0.49 -0.20 0.00 0.31 0.00 0.00 61.69 61.24 2wv0 s THR 234 Cb -0.13 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 2wv0 s THR 234 CO 0.04 0.29 0.62 0.12 -0.69 0.00 0.00 174.62 175.00 2wv0 s PHE 235 N 0.04 3.37 -0.08 4.92 2.19 -1.26 -5.06 117.98 122.09 2wv0 s PHE 235 Ca -0.01 0.90 0.03 0.00 0.33 0.00 0.00 56.93 58.18 2wv0 s PHE 235 Cb -0.08 -2.79 0.01 0.00 -1.31 0.00 0.00 43.02 38.84 2wv0 s PHE 235 CO 0.01 -0.18 -0.18 0.08 1.83 0.00 0.00 175.22 176.78 2wv0 s VAL 236 N 1.94 1.58 -0.15 3.12 1.01 -1.26 -5.13 120.40 121.52 2wv0 s VAL 236 Ca 0.28 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 2wv0 s VAL 236 Cb -0.16 -1.40 0.10 0.00 0.00 0.00 0.00 36.38 34.92 2wv0 s VAL 236 CO 0.10 0.45 0.86 -2.28 0.00 0.00 0.00 175.10 174.23 2wv0 s HIS 237 N 0.53 -0.54 0.26 5.22 5.04 -1.26 -4.70 115.29 119.85 2wv0 s HIS 237 Ca -0.16 1.03 -0.20 0.00 -1.54 0.00 0.00 55.06 54.19 2wv0 s HIS 237 Cb -0.17 0.40 -0.09 0.00 0.04 0.00 0.00 32.58 32.77 2wv0 s HIS 237 CO 0.06 -0.42 0.77 0.71 -2.34 0.00 0.00 174.74 173.51 2wv0 s TYR 238 N -0.77 3.60 -0.08 3.88 2.02 0.10 -5.06 117.35 121.04 2wv0 s TYR 238 Ca -0.04 1.43 0.02 0.00 -0.37 0.00 0.00 57.07 58.11 2wv0 s TYR 238 Cb -0.01 -2.66 0.02 0.00 -0.40 0.00 0.00 41.96 38.90 2wv0 s TYR 238 CO 0.03 0.27 -0.12 -1.64 -1.57 0.00 0.00 175.55 172.52 2wv0 s MET 239 N -2.18 1.77 -0.02 -0.62 -1.94 -1.26 -4.90 119.30 110.16 2wv0 s MET 239 Ca 0.46 -0.41 -0.03 0.00 -1.71 0.00 0.00 55.69 54.00 2wv0 s MET 239 Cb -0.16 -1.53 -0.04 0.00 2.01 0.00 0.00 34.83 35.11 2wv0 s MET 239 CO 0.21 -0.04 0.16 -0.51 -0.01 0.00 0.00 175.02 174.82 2wv0 s ASP 240 N 0.92 6.24 -0.26 3.03 1.11 -1.26 -5.08 116.67 121.37 2wv0 s ASP 240 Ca -0.09 0.32 -0.16 0.00 0.18 0.00 0.00 52.55 52.79 2wv0 s ASP 240 Cb -0.15 -1.94 -0.03 0.00 1.07 0.00 0.00 42.92 41.87 2wv0 s ASP 240 CO 0.01 0.28 0.45 -0.60 1.18 0.00 0.00 175.17 176.48 2wv0 s ARG 241 N -1.80 4.06 0.00 8.23 3.52 -1.26 -5.35 118.95 126.35 2wv0 s ARG 241 Ca 0.25 0.20 0.32 0.00 -0.13 0.00 0.00 55.73 56.37 2wv0 s ARG 241 Cb -0.12 -3.64 1.83 0.00 -1.56 0.00 0.00 34.95 31.46 2wv0 s ARG 241 CO 0.16 -0.28 2.19 1.28 -0.81 0.00 0.00 175.30 177.84