#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i89 s SER 3 N 0.00 6.30 0.20 4.52 0.15 -1.26 -4.96 113.70 118.65 1i89 s SER 3 Ca 0.00 0.35 0.07 0.00 0.70 0.00 0.00 55.95 57.07 1i89 s SER 3 Cb 0.00 -2.22 0.11 0.00 -1.71 0.00 0.00 66.02 62.20 1i89 s SER 3 CO 0.00 -0.16 1.46 0.58 1.20 0.00 0.00 173.24 176.32 1i89 h VAL 4 N 5.30 1.52 -0.31 4.45 2.07 -2.05 -2.37 116.25 124.86 1i89 h VAL 4 Ca -0.32 -2.56 -0.10 0.00 0.82 0.00 0.00 66.70 64.53 1i89 h VAL 4 Cb 1.16 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 33.31 1i89 h VAL 4 CO 0.67 0.74 -0.24 0.77 0.02 0.00 0.00 177.57 179.52 1i89 h SER 5 N 0.05 0.60 -0.65 0.57 4.64 -1.98 0.28 113.55 117.06 1i89 h SER 5 Ca -0.02 -0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1i89 h SER 5 Cb 1.37 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 1i89 h SER 5 CO 0.11 0.83 0.27 -0.33 -0.87 0.00 0.00 176.83 176.85 1i89 h GLU 6 N 0.52 0.96 -0.32 4.77 5.08 -1.96 -1.46 114.58 122.17 1i89 h GLU 6 Ca 0.07 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1i89 h GLU 6 Cb 0.70 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1i89 h GLU 6 CO 0.05 0.79 0.15 0.82 -1.00 0.00 0.00 179.01 179.83 1i89 h ILE 7 N 0.91 1.16 -0.43 3.13 2.04 -0.97 -1.26 117.51 122.08 1i89 h ILE 7 Ca 0.22 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 1i89 h ILE 7 Cb 0.18 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1i89 h ILE 7 CO -0.02 0.16 0.15 -0.09 0.00 0.00 0.00 178.15 178.35 1i89 h ARG 8 N 0.38 0.66 -0.42 2.37 9.65 -0.36 0.40 114.38 127.06 1i89 h ARG 8 Ca 0.11 -0.13 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 1i89 h ARG 8 Cb 0.12 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1i89 h ARG 8 CO -0.01 0.63 -0.05 -0.22 2.80 0.00 0.00 179.97 183.12 1i89 h LYS 9 N 0.56 0.70 0.00 0.20 1.63 -1.18 -2.48 116.57 116.00 1i89 h LYS 9 Ca 0.14 -0.19 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1i89 h LYS 9 Cb 0.24 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.79 1i89 h LYS 9 CO -0.01 0.74 -0.07 0.00 -3.45 0.00 0.00 179.45 176.67 1i89 h ALA 10 N 1.30 0.98 0.00 5.00 0.00 -0.95 -3.31 119.26 122.28 1i89 h ALA 10 Ca 0.12 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 1i89 h ALA 10 Cb 0.47 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1i89 h ALA 10 CO 0.02 0.08 -1.02 0.37 0.00 0.00 0.00 179.25 178.71 1i89 h GLN 11 N 0.00 0.00 -6.47 0.00 4.15 -0.45 -3.46 115.11 108.89 1i89 h GLN 11 Ca -0.00 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.91 1i89 h GLN 11 Cb 0.84 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.52 1i89 h GLN 11 CO 0.01 0.63 -0.18 -0.98 -1.93 0.00 0.00 178.83 176.38 1i89 s ARG 12 N -2.81 3.57 0.82 1.69 1.70 -1.16 -0.33 118.95 122.42 1i89 s ARG 12 Ca 0.00 -0.13 -0.10 0.00 -0.47 0.00 0.00 55.73 55.03 1i89 s ARG 12 Cb 0.09 -2.67 0.12 0.00 -0.57 0.00 0.00 34.95 31.92 1i89 s ARG 12 CO 0.79 0.21 1.15 0.00 -1.08 0.00 0.00 175.30 176.38 1i89 s ALA 13 N -2.13 2.83 -0.21 7.88 0.00 -1.04 -3.95 121.76 125.13 1i89 s ALA 13 Ca 0.42 -1.10 -0.12 0.00 0.00 0.00 0.00 51.96 51.16 1i89 s ALA 13 Cb -0.10 -2.63 -0.09 0.00 0.00 0.00 0.00 23.12 20.29 1i89 s ALA 13 CO 0.32 -1.79 -0.29 -1.91 0.00 0.00 0.00 175.76 172.09 1i89 n GLU 14 N -3.28 0.47 -1.73 0.00 4.07 -1.26 -4.84 120.64 114.07 1i89 n GLU 14 Ca 0.12 0.20 -0.10 0.00 -0.06 0.00 0.00 57.16 57.32 1i89 n GLU 14 Cb 0.60 -1.29 0.04 0.00 -0.06 0.00 0.00 31.44 30.74 1i89 n GLU 14 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1i89 n GLY 15 N 1.64 1.38 3.77 8.31 0.00 -1.26 -5.03 105.19 113.99 1i89 n GLY 15 Ca -0.39 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.14 1i89 n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i89 s PRO 16 N -3.41 4.04 0.19 1.61 0.04 -1.26 -4.59 135.00 131.62 1i89 s PRO 16 Ca 0.29 2.15 -0.32 0.00 0.04 0.00 0.00 61.00 63.17 1i89 s PRO 16 Cb -0.02 -2.81 -0.11 0.00 0.04 0.00 0.00 34.50 31.60 1i89 s PRO 16 CO 0.19 -0.43 1.62 0.00 0.04 0.00 0.00 177.00 178.42 1i89 s ALA 17 N -1.25 3.83 0.02 8.56 0.00 -1.26 -4.37 121.76 127.29 1i89 s ALA 17 Ca 0.55 1.45 0.07 0.00 0.00 0.00 0.00 51.96 54.04 1i89 s ALA 17 Cb -0.38 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.07 1i89 s ALA 17 CO 0.49 -0.83 -0.21 0.99 0.00 0.00 0.00 175.76 176.19 1i89 s THR 18 N 1.08 1.71 -0.16 0.00 2.01 0.16 -0.63 115.64 119.80 1i89 s THR 18 Ca 0.71 -1.11 -0.26 0.00 0.31 0.00 0.00 61.69 61.34 1i89 s THR 18 Cb -0.46 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 70.58 1i89 s THR 18 CO 0.32 0.31 0.85 -0.63 -0.69 0.00 0.00 174.62 174.78 1i89 s ILE 19 N -0.70 4.87 -0.57 1.82 1.01 0.52 -0.74 121.20 127.41 1i89 s ILE 19 Ca 0.08 1.67 0.07 0.00 0.00 0.00 0.00 60.65 62.47 1i89 s ILE 19 Cb -0.09 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.22 1i89 s ILE 19 CO 0.01 0.02 0.48 0.18 0.00 0.00 0.00 174.94 175.63 1i89 n LEU 20 N 5.23 0.91 -3.63 2.97 4.77 0.63 -0.55 117.00 127.32 1i89 n LEU 20 Ca 0.05 -0.74 -0.07 0.00 -0.03 0.00 0.00 56.01 55.22 1i89 n LEU 20 Cb 0.49 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1i89 n LEU 20 CO 0.49 0.19 0.92 0.00 -1.33 0.00 0.00 177.39 177.66 1i89 s ALA 21 N -1.09 -2.06 -0.03 -1.18 0.00 -1.24 -4.50 121.76 111.66 1i89 s ALA 21 Ca 0.05 1.76 0.01 0.00 0.00 0.00 0.00 51.96 53.79 1i89 s ALA 21 Cb 0.05 -1.41 0.02 0.00 0.00 0.00 0.00 23.12 21.78 1i89 s ALA 21 CO 0.17 -0.21 -0.04 0.42 0.00 0.00 0.00 175.76 176.10 1i89 s ILE 22 N -0.24 0.44 0.01 0.00 1.01 -1.26 -2.34 121.20 118.83 1i89 s ILE 22 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1i89 s ILE 22 Cb -0.04 -0.46 -0.01 0.00 0.01 0.00 0.00 42.46 41.97 1i89 s ILE 22 CO -0.08 0.18 -0.03 -0.83 0.00 0.00 0.00 174.94 174.19 1i89 s GLY 23 N 0.64 0.19 0.17 6.18 0.00 -0.30 -4.66 107.32 109.55 1i89 s GLY 23 Ca -0.08 -0.40 0.03 0.00 0.00 0.00 0.00 44.72 44.28 1i89 s GLY 23 CO -0.00 -0.44 -0.05 -0.51 0.00 0.00 0.00 173.10 172.10 1i89 s THR 24 N -0.91 0.98 0.07 0.90 -4.23 -1.26 -0.57 115.64 110.62 1i89 s THR 24 Ca -0.09 -2.03 -0.19 0.00 -1.18 0.00 0.00 61.69 58.20 1i89 s THR 24 Cb -0.06 -2.04 0.04 0.00 1.34 0.00 0.00 72.50 71.77 1i89 s THR 24 CO -0.01 -0.57 0.44 0.00 -0.54 0.00 0.00 174.62 173.95 1i89 s ALA 25 N -3.45 -1.09 -0.02 3.99 0.00 0.10 -4.49 121.76 116.80 1i89 s ALA 25 Ca 0.21 0.29 -0.19 0.00 0.00 0.00 0.00 51.96 52.27 1i89 s ALA 25 Cb 0.04 0.48 0.04 0.00 0.00 0.00 0.00 23.12 23.68 1i89 s ALA 25 CO 0.03 -0.54 0.42 -0.80 0.00 0.00 0.00 175.76 174.87 1i89 s ASN 26 N -2.26 -0.32 0.58 0.00 -0.87 -1.26 -1.19 114.94 109.62 1i89 s ASN 26 Ca -0.03 0.23 -0.19 0.00 -1.57 0.00 0.00 52.86 51.30 1i89 s ASN 26 Cb -0.00 0.38 -0.05 0.00 -0.02 0.00 0.00 41.25 41.56 1i89 s ASN 26 CO -0.05 -0.52 0.98 -2.65 -2.57 0.00 0.00 177.10 172.29 1i89 n PRO 27 N 1.08 0.98 0.02 -0.60 -0.02 -1.26 -4.89 135.00 130.30 1i89 n PRO 27 Ca -0.21 0.37 0.01 0.00 -2.02 0.00 0.00 63.50 61.66 1i89 n PRO 27 Cb 0.57 -2.17 0.35 0.00 -0.02 0.00 0.00 33.50 32.23 1i89 n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i89 h ALA 28 N 0.63 1.49 -1.87 3.55 0.00 -1.98 -3.42 119.26 117.67 1i89 h ALA 28 Ca -0.48 -0.15 -0.58 0.00 0.00 0.00 0.00 54.91 53.70 1i89 h ALA 28 Cb 1.36 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1i89 h ALA 28 CO 0.52 0.37 1.28 1.21 0.00 0.00 0.00 179.25 182.63 1i89 s ASN 29 N -6.75 5.87 -0.13 0.00 2.47 -1.26 -4.95 114.94 110.19 1i89 s ASN 29 Ca -0.07 1.30 -0.15 0.00 0.42 0.00 0.00 52.86 54.36 1i89 s ASN 29 Cb 0.16 -2.53 -0.05 0.00 -1.45 0.00 0.00 41.25 37.39 1i89 s ASN 29 CO 0.75 -1.73 0.36 0.00 -3.72 0.00 0.00 177.10 172.76 1i89 s VAL 31 N 0.30 2.33 0.28 0.00 1.01 0.14 -4.97 120.40 119.49 1i89 s VAL 31 Ca 0.20 -1.59 -0.29 0.00 0.00 0.00 0.00 61.98 60.30 1i89 s VAL 31 Cb -0.14 -2.36 -0.10 0.00 0.00 0.00 0.00 36.38 33.77 1i89 s VAL 31 CO 0.07 -0.04 1.41 -1.61 0.00 0.00 0.00 175.10 174.92 1i89 s GLU 32 N 1.13 4.28 0.12 2.72 0.41 -1.26 -1.79 118.70 124.30 1i89 s GLU 32 Ca -0.08 2.30 -0.09 0.00 -0.41 0.00 0.00 54.97 56.69 1i89 s GLU 32 Cb -0.20 -3.09 -0.11 0.00 -1.78 0.00 0.00 34.13 28.96 1i89 s GLU 32 CO -0.04 -0.37 1.32 0.37 -0.49 0.00 0.00 175.26 176.05 1i89 h GLN 33 N 4.39 0.67 -0.80 1.61 5.75 -0.80 -3.02 115.11 122.91 1i89 h GLN 33 Ca -0.47 -0.57 0.09 0.00 -0.15 0.00 0.00 58.65 57.54 1i89 h GLN 33 Cb 1.22 0.13 -0.07 0.00 1.07 0.00 0.00 27.48 29.83 1i89 h GLN 33 CO 0.73 1.19 0.46 0.66 -2.65 0.00 0.00 178.83 179.21 1i89 h SER 34 N 0.44 0.66 -0.66 -0.69 4.64 -1.88 -1.82 113.55 114.25 1i89 h SER 34 Ca -0.06 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1i89 h SER 34 Cb 1.43 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1i89 h SER 34 CO 0.16 0.39 0.00 0.35 -0.87 0.00 0.00 176.83 176.85 1i89 n THR 35 N -4.75 0.87 -0.12 2.95 -2.24 -1.25 -4.59 114.28 105.17 1i89 n THR 35 Ca 0.13 -0.91 -0.06 0.00 -2.27 0.00 0.00 64.05 60.93 1i89 n THR 35 Cb 0.26 0.56 0.02 0.00 -2.10 0.00 0.00 70.33 69.06 1i89 n THR 35 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1i89 h TYR 36 N 4.19 0.30 -0.32 4.78 3.20 -1.19 -2.77 116.97 125.17 1i89 h TYR 36 Ca 0.00 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.95 1i89 h TYR 36 Cb 0.95 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 39.06 1i89 h TYR 36 CO 0.44 0.15 -0.44 -1.35 -1.64 0.00 0.00 178.16 175.31 1i89 h PRO 37 N 0.35 -0.37 -0.54 1.82 0.11 -1.81 0.21 132.00 131.76 1i89 h PRO 37 Ca 0.17 0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.39 1i89 h PRO 37 Cb 0.11 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.23 1i89 h PRO 37 CO -0.14 -0.25 0.14 -0.44 -0.21 0.00 0.00 178.00 177.10 1i89 h ASP 38 N -0.39 0.06 -0.37 -2.05 3.32 -1.88 -0.17 116.42 114.95 1i89 h ASP 38 Ca 0.11 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 1i89 h ASP 38 Cb 0.60 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.24 1i89 h ASP 38 CO -0.52 0.06 0.14 0.15 -1.72 0.00 0.00 179.24 177.34 1i89 h PHE 39 N 0.29 0.57 -0.21 4.55 3.57 -1.02 -1.78 116.94 122.91 1i89 h PHE 39 Ca 0.27 -0.05 -0.19 0.00 3.53 0.00 0.00 57.97 61.54 1i89 h PHE 39 Cb 0.36 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 1i89 h PHE 39 CO -0.21 0.52 -0.61 -0.92 -2.23 0.00 0.00 178.31 174.86 1i89 h TYR 40 N 0.45 0.91 0.00 0.41 3.20 -0.19 -0.78 116.97 120.97 1i89 h TYR 40 Ca 0.12 -0.35 -0.09 0.00 3.14 0.00 0.00 58.73 61.55 1i89 h TYR 40 Cb 0.20 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1i89 h TYR 40 CO 0.00 1.14 -0.45 0.74 -1.64 0.00 0.00 178.16 177.96 1i89 h PHE 41 N 0.53 0.00 0.10 -3.82 -1.00 -1.05 -2.32 116.94 109.38 1i89 h PHE 41 Ca -0.01 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.54 1i89 h PHE 41 Cb 1.20 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.79 1i89 h PHE 41 CO 0.06 0.45 -0.96 0.87 -1.61 0.00 0.00 178.31 177.12 1i89 h LYS 42 N 0.00 0.48 0.00 1.51 1.57 -1.20 0.97 116.57 119.90 1i89 h LYS 42 Ca -0.00 -0.64 -0.05 0.00 -1.87 0.00 0.00 60.65 58.09 1i89 h LYS 42 Cb 0.89 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1i89 h LYS 42 CO 0.06 1.27 -0.22 0.97 -0.57 0.00 0.00 179.45 180.96 1i89 h ILE 43 N -0.01 0.64 -0.66 1.86 6.09 -1.05 -2.26 117.51 122.11 1i89 h ILE 43 Ca -0.15 -0.97 0.00 0.00 -1.37 0.00 0.00 64.86 62.37 1i89 h ILE 43 Cb 1.68 1.63 0.00 0.00 0.47 0.00 0.00 36.82 40.60 1i89 h ILE 43 CO 0.18 0.21 0.00 0.35 -3.07 0.00 0.00 178.15 175.82 1i89 n THR 44 N -3.54 1.74 -3.96 2.19 -2.24 -0.88 -4.92 114.28 102.67 1i89 n THR 44 Ca -0.01 -1.18 -0.31 0.00 -2.27 0.00 0.00 64.05 60.29 1i89 n THR 44 Cb 0.37 0.17 0.01 0.00 -2.10 0.00 0.00 70.33 68.79 1i89 n THR 44 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1i89 n ASN 45 N 1.20 -4.08 -0.40 3.42 4.13 -0.85 -4.88 115.26 113.80 1i89 n ASN 45 Ca 0.26 -0.84 0.07 0.00 1.68 0.00 0.00 54.58 55.75 1i89 n ASN 45 Cb 0.86 -3.64 0.14 0.00 -1.54 0.00 0.00 39.78 35.60 1i89 n ASN 45 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1i89 n SER 46 N -2.82 1.81 -0.11 6.41 7.64 0.32 -4.83 113.62 122.04 1i89 n SER 46 Ca 0.01 -3.21 0.25 0.00 1.01 0.00 0.00 58.87 56.92 1i89 n SER 46 Cb 0.54 -0.44 0.70 0.00 -1.01 0.00 0.00 64.21 64.00 1i89 n SER 46 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1i89 h GLU 47 N 0.43 0.03 0.00 1.43 4.39 -1.88 -1.43 114.58 117.56 1i89 h GLU 47 Ca -0.02 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1i89 h GLU 47 Cb 1.10 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1i89 h GLU 47 CO 0.01 0.02 0.00 -2.39 -1.16 0.00 0.00 179.01 175.49 1i89 n HIS 48 N -4.33 0.00 -3.00 4.33 1.44 -1.26 -4.45 115.22 107.96 1i89 n HIS 48 Ca 0.15 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 55.42 1i89 n HIS 48 Cb 0.80 -0.34 -0.02 0.00 0.12 0.00 0.00 29.99 30.55 1i89 n HIS 48 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1i89 s LYS 49 N -2.68 3.79 -0.00 -1.40 1.02 -0.54 -4.89 119.74 115.03 1i89 s LYS 49 Ca 0.24 -2.17 -0.23 0.00 0.02 0.00 0.00 55.97 53.82 1i89 s LYS 49 Cb 0.19 -4.89 -0.18 0.00 -0.52 0.00 0.00 37.83 32.43 1i89 s LYS 49 CO 0.46 -1.69 1.26 1.15 -0.92 0.00 0.00 175.35 175.61 1i89 h THR 50 N 5.24 1.40 -0.55 2.17 2.02 -1.85 -1.41 112.91 119.91 1i89 h THR 50 Ca 0.20 -1.34 -0.06 0.00 0.77 0.00 0.00 66.41 65.98 1i89 h THR 50 Cb 0.97 2.14 -0.02 0.00 -1.74 0.00 0.00 68.15 69.50 1i89 h THR 50 CO 1.11 0.37 0.09 -0.33 0.37 0.00 0.00 175.52 177.13 1i89 h GLU 51 N -0.29 0.88 -0.27 6.66 5.08 -1.98 -2.48 114.58 122.18 1i89 h GLU 51 Ca 0.01 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 1i89 h GLU 51 Cb 0.65 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1i89 h GLU 51 CO 0.02 0.82 -0.21 1.25 -1.00 0.00 0.00 179.01 179.89 1i89 h LEU 52 N 0.84 0.65 -1.53 1.33 5.85 -1.97 -2.44 115.31 118.04 1i89 h LEU 52 Ca 0.17 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1i89 h LEU 52 Cb 0.36 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1i89 h LEU 52 CO 0.01 0.96 -0.25 0.50 -0.34 0.00 0.00 178.44 179.33 1i89 h LYS 53 N 0.35 0.00 -0.42 1.25 3.64 -1.14 -1.57 116.57 118.67 1i89 h LYS 53 Ca 0.05 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1i89 h LYS 53 Cb 0.76 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1i89 h LYS 53 CO 0.06 0.25 -0.23 0.93 -2.27 0.00 0.00 179.45 178.18 1i89 h GLU 54 N 0.00 0.84 -0.28 1.90 5.08 -1.32 -0.06 114.58 120.74 1i89 h GLU 54 Ca -0.00 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 1i89 h GLU 54 Cb 0.47 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1i89 h GLU 54 CO 0.03 0.99 0.14 0.87 -1.00 0.00 0.00 179.01 180.04 1i89 h LYS 55 N 0.73 0.41 -0.43 2.33 6.56 -0.82 -1.85 116.57 123.49 1i89 h LYS 55 Ca 0.10 -0.06 -0.09 0.00 -1.06 0.00 0.00 60.65 59.54 1i89 h LYS 55 Cb 0.76 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.34 1i89 h LYS 55 CO 0.06 0.38 -0.07 0.35 -2.06 0.00 0.00 179.45 178.11 1i89 h PHE 56 N 0.33 0.90 -0.54 -1.35 3.57 -1.08 -1.68 116.94 117.09 1i89 h PHE 56 Ca 0.10 -0.18 0.07 0.00 3.53 0.00 0.00 57.97 61.49 1i89 h PHE 56 Cb 0.10 -0.23 -0.06 0.00 2.79 0.00 0.00 35.95 38.55 1i89 h PHE 56 CO -0.02 0.91 0.21 0.37 -2.23 0.00 0.00 178.31 177.54 1i89 h GLN 57 N 0.64 0.39 -0.50 1.11 5.75 -0.92 0.93 115.11 122.51 1i89 h GLN 57 Ca 0.11 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.59 1i89 h GLN 57 Cb 0.59 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 1i89 h GLN 57 CO 0.04 0.26 0.31 -0.09 -2.65 0.00 0.00 178.83 176.69 1i89 h ARG 58 N 0.40 0.68 -0.33 1.69 2.43 -1.05 0.29 114.38 118.50 1i89 h ARG 58 Ca 0.26 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.43 1i89 h ARG 58 Cb 0.28 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.63 1i89 h ARG 58 CO -0.26 0.50 -0.05 0.52 -1.51 0.00 0.00 179.97 179.18 1i89 h MET 59 N 0.68 0.04 -0.48 0.20 2.86 -0.76 0.55 114.93 118.01 1i89 h MET 59 Ca 0.18 -0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 1i89 h MET 59 Cb -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1i89 h MET 59 CO -0.03 0.03 -0.05 0.00 1.06 0.00 0.00 176.91 177.92 1i89 h ASP 61 N 0.76 0.60 0.90 0.00 3.32 -0.40 -2.49 116.42 119.11 1i89 h ASP 61 Ca 0.14 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1i89 h ASP 61 Cb 0.53 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1i89 h ASP 61 CO 0.03 0.83 -0.38 0.29 -1.72 0.00 0.00 179.24 178.29 1i89 n LYS 62 N -4.12 0.17 -0.07 3.56 5.02 0.14 -4.29 118.16 118.56 1i89 n LYS 62 Ca -0.00 0.07 0.08 0.00 -2.02 0.00 0.00 58.31 56.44 1i89 n LYS 62 Cb 0.41 -1.63 0.44 0.00 -0.02 0.00 0.00 35.03 34.23 1i89 n LYS 62 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1i89 h SER 63 N 0.00 0.47 -1.23 4.39 4.64 -0.73 -3.46 113.55 117.63 1i89 h SER 63 Ca 0.00 -0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1i89 h SER 63 Cb 0.64 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 1i89 h SER 63 CO 0.00 0.31 -0.25 0.23 -0.87 0.00 0.00 176.83 176.25 1i89 n MET 64 N -4.47 -0.83 -4.27 4.77 2.81 -1.26 -4.42 117.12 109.45 1i89 n MET 64 Ca 0.07 0.63 -0.34 0.00 -1.81 0.00 0.00 57.70 56.26 1i89 n MET 64 Cb 0.22 -4.69 -0.11 0.00 -0.71 0.00 0.00 33.22 27.93 1i89 n MET 64 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1i89 s ILE 65 N -2.50 4.22 -0.18 2.02 1.01 -1.26 -3.63 121.20 120.88 1i89 s ILE 65 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.42 1i89 s ILE 65 Cb 0.00 -2.86 -0.22 0.00 0.01 0.00 0.00 42.46 39.39 1i89 s ILE 65 CO 0.00 0.49 0.12 0.29 0.00 0.00 0.00 174.94 175.84 1i89 n LYS 66 N 3.45 0.69 -3.67 2.79 5.02 0.13 -4.69 118.16 121.89 1i89 n LYS 66 Ca -0.17 0.19 -0.10 0.00 -2.02 0.00 0.00 58.31 56.21 1i89 n LYS 66 Cb 0.52 -1.62 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 1i89 n LYS 66 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1i89 s ARG 67 N -2.54 1.04 0.05 1.97 1.70 -1.02 -0.12 118.95 120.02 1i89 s ARG 67 Ca -0.24 -0.75 0.01 0.00 -0.47 0.00 0.00 55.73 54.28 1i89 s ARG 67 Cb 0.08 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.88 1i89 s ARG 67 CO 0.71 -0.40 -0.06 1.03 -1.08 0.00 0.00 175.30 175.51 1i89 s ARG 68 N -3.81 0.55 -0.18 3.89 0.52 -0.74 -2.79 118.95 116.39 1i89 s ARG 68 Ca 0.03 -0.89 -0.08 0.00 -0.52 0.00 0.00 55.73 54.27 1i89 s ARG 68 Cb 0.02 -0.13 -0.04 0.00 0.52 0.00 0.00 34.95 35.31 1i89 s ARG 68 CO -0.12 -0.00 0.09 0.71 0.02 0.00 0.00 175.30 176.00 1i89 s TYR 69 N -2.11 3.33 -0.04 -0.53 1.51 -1.26 0.24 117.35 118.48 1i89 s TYR 69 Ca -0.05 0.20 0.01 0.00 -1.01 0.00 0.00 57.07 56.22 1i89 s TYR 69 Cb -0.05 -2.07 0.02 0.00 -0.11 0.00 0.00 41.96 39.75 1i89 s TYR 69 CO -0.02 0.27 -0.04 -1.64 -1.11 0.00 0.00 175.55 173.01 1i89 s MET 70 N 0.16 0.75 0.18 -0.62 -1.94 0.66 -1.37 119.30 117.13 1i89 s MET 70 Ca 0.06 -0.10 -0.11 0.00 -1.71 0.00 0.00 55.69 53.83 1i89 s MET 70 Cb -0.12 -0.77 0.10 0.00 2.01 0.00 0.00 34.83 36.05 1i89 s MET 70 CO -0.00 -0.07 1.77 -0.92 -0.01 0.00 0.00 175.02 175.79 1i89 h TYR 71 N 7.08 0.92 -2.70 -0.03 3.20 -1.92 -3.38 116.97 120.13 1i89 h TYR 71 Ca -0.38 -0.04 -0.53 0.00 3.14 0.00 0.00 58.73 60.91 1i89 h TYR 71 Cb 1.15 -0.28 0.02 0.00 1.54 0.00 0.00 36.73 39.16 1i89 h TYR 71 CO 0.49 0.69 0.98 -0.51 -1.64 0.00 0.00 178.16 178.18 1i89 s LEU 72 N -9.86 4.36 0.42 2.82 1.43 -1.26 -4.98 118.68 111.62 1i89 s LEU 72 Ca -0.13 2.48 0.07 0.00 -1.03 0.00 0.00 54.13 55.52 1i89 s LEU 72 Cb 0.13 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 1i89 s LEU 72 CO 0.79 -0.88 0.31 0.42 0.23 0.00 0.00 176.35 177.22 1i89 s THR 73 N 2.54 2.48 0.20 5.49 -4.23 -1.26 -4.99 115.64 115.87 1i89 s THR 73 Ca 0.73 -1.48 -0.10 0.00 -1.18 0.00 0.00 61.69 59.66 1i89 s THR 73 Cb -0.40 -2.96 0.13 0.00 1.34 0.00 0.00 72.50 70.61 1i89 s THR 73 CO 0.32 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 176.14 1i89 h GLU 74 N 1.16 0.70 -0.26 3.99 4.81 -1.98 -0.49 114.58 122.50 1i89 h GLU 74 Ca -0.42 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 58.79 1i89 h GLU 74 Cb 1.26 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1i89 h GLU 74 CO 0.62 0.46 0.12 1.49 -0.73 0.00 0.00 179.01 180.97 1i89 h GLU 75 N 0.72 0.25 -0.44 1.92 4.57 -1.99 0.10 114.58 119.72 1i89 h GLU 75 Ca 0.27 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.41 1i89 h GLU 75 Cb 0.10 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1i89 h GLU 75 CO -0.14 0.17 0.16 0.82 -1.18 0.00 0.00 179.01 178.84 1i89 h ILE 76 N 0.26 1.21 -0.40 2.32 2.04 -1.91 -2.81 117.51 118.22 1i89 h ILE 76 Ca 0.11 -0.66 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1i89 h ILE 76 Cb 0.03 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1i89 h ILE 76 CO -0.08 0.24 -0.07 -0.07 0.00 0.00 0.00 178.15 178.17 1i89 h LEU 77 N 0.56 0.66 -1.49 1.44 3.38 -0.63 -2.49 115.31 116.74 1i89 h LEU 77 Ca 0.14 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1i89 h LEU 77 Cb 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1i89 h LEU 77 CO -0.01 0.78 -0.26 0.07 0.09 0.00 0.00 178.44 179.11 1i89 h LYS 78 N 0.63 0.00 -0.00 1.13 -0.00 -0.59 -0.48 116.57 117.26 1i89 h LYS 78 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.77 1i89 h LYS 78 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.73 1i89 h LYS 78 CO 0.03 0.26 -0.00 0.39 -0.00 0.00 0.00 179.45 180.12 1i89 n GLU 79 N -4.20 0.68 -3.22 0.07 1.02 -0.95 -4.41 120.64 109.62 1i89 n GLU 79 Ca -0.02 -0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.87 1i89 n GLU 79 Cb 0.31 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.16 1i89 n GLU 79 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1i89 n ASN 80 N -1.16 0.76 0.24 1.62 3.02 -0.19 -4.95 115.26 114.61 1i89 n ASN 80 Ca 0.19 -2.83 0.07 0.00 -0.03 0.00 0.00 54.58 51.98 1i89 n ASN 80 Cb 0.18 -0.64 0.59 0.00 -0.61 0.00 0.00 39.78 39.30 1i89 n ASN 80 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1i89 h PRO 81 N 3.96 0.01 -0.37 3.52 0.13 -1.77 -0.71 132.00 136.77 1i89 h PRO 81 Ca 0.09 -0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.13 1i89 h PRO 81 Cb 0.85 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 1i89 h PRO 81 CO 0.52 0.07 -0.12 -0.91 -0.23 0.00 0.00 178.00 177.33 1i89 h ASN 82 N 0.01 0.64 0.27 1.44 -0.26 -1.91 -1.16 115.58 114.61 1i89 h ASN 82 Ca 0.00 -0.18 -0.11 0.00 -0.56 0.00 0.00 56.30 55.45 1i89 h ASN 82 Cb 0.10 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.17 1i89 h ASN 82 CO 0.01 0.79 -0.45 0.58 -1.06 0.00 0.00 177.43 177.30 1i89 h VAL 83 N 0.60 1.33 0.00 2.81 2.07 -1.46 -3.13 116.25 118.47 1i89 h VAL 83 Ca 0.10 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 66.02 1i89 h VAL 83 Cb 0.56 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1i89 h VAL 83 CO 0.03 0.48 0.00 0.00 0.02 0.00 0.00 177.57 178.10 1i89 s GLU 85 N -3.25 2.42 0.15 0.00 2.02 -0.73 -2.40 118.70 116.92 1i89 s GLU 85 Ca 0.07 1.20 -0.12 0.00 0.02 0.00 0.00 54.97 56.14 1i89 s GLU 85 Cb 0.09 -1.92 0.02 0.00 0.10 0.00 0.00 34.13 32.43 1i89 s GLU 85 CO 0.59 -1.52 1.61 -0.92 0.02 0.00 0.00 175.26 175.04 1i89 h TYR 86 N -0.84 0.97 -2.13 1.61 3.20 -1.86 -1.88 116.97 116.03 1i89 h TYR 86 Ca -0.44 -0.16 -0.43 0.00 3.14 0.00 0.00 58.73 60.84 1i89 h TYR 86 Cb 1.23 -0.25 -0.33 0.00 1.54 0.00 0.00 36.73 38.92 1i89 h TYR 86 CO 0.57 0.90 -0.73 1.41 -1.64 0.00 0.00 178.16 178.67 1i89 s MET 87 N -5.04 0.61 0.05 1.82 1.75 -1.26 -4.55 119.30 112.68 1i89 s MET 87 Ca -0.12 -0.98 0.04 0.00 -1.25 0.00 0.00 55.69 53.37 1i89 s MET 87 Cb 0.12 -0.89 -0.03 0.00 2.84 0.00 0.00 34.83 36.88 1i89 s MET 87 CO 0.82 -1.20 -0.11 0.00 -0.65 0.00 0.00 175.02 173.89 1i89 s ALA 88 N 1.34 0.84 -0.11 4.11 0.00 -1.26 -5.06 121.76 121.62 1i89 s ALA 88 Ca 0.17 -0.86 -0.34 0.00 0.00 0.00 0.00 51.96 50.93 1i89 s ALA 88 Cb -0.17 -0.02 -0.11 0.00 0.00 0.00 0.00 23.12 22.81 1i89 s ALA 88 CO -0.03 0.07 1.92 -2.30 0.00 0.00 0.00 175.76 175.42 1i89 n PRO 89 N 1.41 2.12 -0.24 0.00 -0.02 -1.26 -4.25 135.00 132.75 1i89 n PRO 89 Ca -0.22 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1i89 n PRO 89 Cb 0.54 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1i89 n PRO 89 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1i89 n SER 90 N 7.15 0.00 -0.06 2.55 3.41 0.14 -4.83 113.62 121.98 1i89 n SER 90 Ca 0.24 -1.08 -0.15 0.00 -0.26 0.00 0.00 58.87 57.62 1i89 n SER 90 Cb 0.30 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 1i89 n SER 90 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1i89 h LEU 91 N 0.00 0.94 -0.10 1.04 5.85 -1.15 -2.10 115.31 119.78 1i89 h LEU 91 Ca 0.00 -0.52 0.03 0.00 0.84 0.00 0.00 57.88 58.23 1i89 h LEU 91 Cb 1.03 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.76 1i89 h LEU 91 CO 0.00 1.31 -0.08 0.44 -0.34 0.00 0.00 178.44 179.77 1i89 h ASP 92 N 0.63 -0.24 -0.80 1.25 3.32 -1.94 0.13 116.42 118.76 1i89 h ASP 92 Ca 0.00 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1i89 h ASP 92 Cb 1.19 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.83 1i89 h ASP 92 CO 0.13 -0.11 0.44 0.00 -1.72 0.00 0.00 179.24 177.98 1i89 h ALA 93 N 1.00 1.03 -0.40 3.45 0.00 -1.92 -0.29 119.26 122.13 1i89 h ALA 93 Ca 0.07 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1i89 h ALA 93 Cb 0.18 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1i89 h ALA 93 CO -0.16 0.53 0.07 0.00 0.00 0.00 0.00 179.25 179.70 1i89 h ARG 94 N 1.11 0.67 -0.38 0.00 3.08 -1.15 -2.67 114.38 115.04 1i89 h ARG 94 Ca 0.28 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 60.18 1i89 h ARG 94 Cb 0.02 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 1i89 h ARG 94 CO -0.05 0.71 0.19 1.96 -1.07 0.00 0.00 179.97 181.71 1i89 h GLN 95 N 0.52 0.37 -0.82 0.04 1.08 -0.64 -1.18 115.11 114.47 1i89 h GLN 95 Ca 0.12 -0.02 0.11 0.00 -1.45 0.00 0.00 58.65 57.41 1i89 h GLN 95 Cb 0.36 -0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.65 1i89 h GLN 95 CO 0.01 0.25 0.54 -0.44 -0.95 0.00 0.00 178.83 178.23 1i89 h ASP 96 N 0.39 0.66 0.17 1.46 3.32 -0.80 0.03 116.42 121.64 1i89 h ASP 96 Ca 0.16 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1i89 h ASP 96 Cb 0.07 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1i89 h ASP 96 CO -0.11 0.38 -0.08 0.24 -1.72 0.00 0.00 179.24 177.94 1i89 h MET 97 N 0.72 -0.22 0.00 3.56 2.86 -1.11 -3.35 114.93 117.40 1i89 h MET 97 Ca 0.39 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.99 1i89 h MET 97 Cb 0.52 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 1i89 h MET 97 CO -0.16 0.15 -0.31 -0.39 1.06 0.00 0.00 176.91 177.26 1i89 h VAL 98 N -0.64 0.40 0.00 -2.22 -1.51 -0.74 -0.41 116.25 111.13 1i89 h VAL 98 Ca -0.02 -1.57 -0.03 0.00 -1.23 0.00 0.00 66.70 63.84 1i89 h VAL 98 Cb 0.47 2.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.79 1i89 h VAL 98 CO 0.04 0.23 -0.15 0.58 -1.23 0.00 0.00 177.57 177.04 1i89 h VAL 99 N 0.00 0.79 0.08 7.19 2.07 -1.17 -0.51 116.25 124.70 1i89 h VAL 99 Ca -0.01 -0.57 -0.37 0.00 0.82 0.00 0.00 66.70 66.56 1i89 h VAL 99 Cb 1.19 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.27 1i89 h VAL 99 CO 0.03 0.14 -2.16 0.52 0.02 0.00 0.00 177.57 176.13 1i89 n VAL 100 N -3.90 1.67 0.05 2.57 0.31 -1.09 -4.47 118.33 113.47 1i89 n VAL 100 Ca -0.02 -0.61 -0.07 0.00 -0.01 0.00 0.00 64.34 63.63 1i89 n VAL 100 Cb 0.24 -1.64 0.09 0.00 -0.91 0.00 0.00 33.84 31.63 1i89 n VAL 100 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1i89 h GLU 101 N 0.01 0.39 0.22 5.55 4.57 -0.93 -2.35 114.58 122.04 1i89 h GLU 101 Ca -0.48 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 57.43 1i89 h GLU 101 Cb 1.97 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 30.59 1i89 h GLU 101 CO 0.01 0.86 -0.11 0.28 -1.18 0.00 0.00 179.01 178.87 1i89 h VAL 102 N 0.29 0.79 -0.22 0.32 2.07 -1.32 -1.30 116.25 116.88 1i89 h VAL 102 Ca -0.00 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.38 1i89 h VAL 102 Cb 1.10 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1i89 h VAL 102 CO 0.10 0.01 -0.30 1.55 0.02 0.00 0.00 177.57 178.95 1i89 h PRO 103 N -0.32 0.43 0.48 1.57 0.13 -1.77 -0.82 132.00 131.69 1i89 h PRO 103 Ca -0.03 -0.17 -0.01 0.00 -0.87 0.00 0.00 66.00 64.91 1i89 h PRO 103 Cb 0.25 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1i89 h PRO 103 CO 0.05 0.69 -0.34 -0.09 -0.23 0.00 0.00 178.00 178.08 1i89 h ARG 104 N 0.37 -0.77 -0.67 0.86 2.43 -1.15 0.78 114.38 116.24 1i89 h ARG 104 Ca 0.05 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 1i89 h ARG 104 Cb 0.71 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 1i89 h ARG 104 CO 0.05 -0.51 0.25 1.25 -1.51 0.00 0.00 179.97 179.50 1i89 h LEU 105 N -0.80 0.93 -1.04 3.80 5.85 -1.27 -2.50 115.31 120.29 1i89 h LEU 105 Ca -0.05 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 1i89 h LEU 105 Cb 0.67 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1i89 h LEU 105 CO 0.02 0.86 0.16 1.23 -0.34 0.00 0.00 178.44 180.38 1i89 h GLY 106 N 0.95 0.91 0.95 3.75 0.00 -1.00 -1.78 103.07 106.85 1i89 h GLY 106 Ca 0.22 -0.51 0.02 0.00 0.00 0.00 0.00 47.33 47.06 1i89 h GLY 106 CO -0.01 0.48 0.65 1.70 0.00 0.00 0.00 176.54 179.36 1i89 h LYS 107 N 0.82 1.27 -0.15 4.80 3.64 -0.43 0.19 116.57 126.71 1i89 h LYS 107 Ca 0.19 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1i89 h LYS 107 Cb 0.26 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1i89 h LYS 107 CO -0.01 0.84 0.09 0.93 -2.27 0.00 0.00 179.45 179.03 1i89 h GLU 108 N 1.31 0.18 -0.53 1.90 5.08 -0.92 -0.59 114.58 121.01 1i89 h GLU 108 Ca 0.38 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.71 1i89 h GLU 108 Cb -0.09 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1i89 h GLU 108 CO -0.10 0.12 0.27 0.00 -1.00 0.00 0.00 179.01 178.30 1i89 h ALA 109 N 1.06 0.69 -0.66 3.43 0.00 -1.19 -2.83 119.26 119.75 1i89 h ALA 109 Ca 0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1i89 h ALA 109 Cb -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1i89 h ALA 109 CO -0.02 0.23 0.35 0.00 0.00 0.00 0.00 179.25 179.81 1i89 h ALA 110 N 1.11 0.85 -0.89 0.00 0.00 -0.69 -1.68 119.26 117.95 1i89 h ALA 110 Ca 0.18 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1i89 h ALA 110 Cb 0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 1i89 h ALA 110 CO -0.03 0.39 0.58 0.28 0.00 0.00 0.00 179.25 180.47 1i89 h VAL 111 N 0.91 1.13 -0.37 0.00 2.07 -0.99 0.26 116.25 119.27 1i89 h VAL 111 Ca 0.23 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1i89 h VAL 111 Cb 0.07 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 1i89 h VAL 111 CO -0.03 0.20 0.18 0.11 0.02 0.00 0.00 177.57 178.05 1i89 h LYS 112 N 1.11 0.53 -0.39 1.57 1.57 -1.23 -0.11 116.57 119.60 1i89 h LYS 112 Ca 0.36 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 59.01 1i89 h LYS 112 Cb 0.03 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1i89 h LYS 112 CO -0.13 0.47 0.05 0.00 -0.57 0.00 0.00 179.45 179.27 1i89 h ALA 113 N 1.03 0.52 -0.42 3.86 0.00 -0.76 -1.35 119.26 122.14 1i89 h ALA 113 Ca 0.13 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1i89 h ALA 113 Cb 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1i89 h ALA 113 CO -0.02 0.25 0.25 0.82 0.00 0.00 0.00 179.25 180.55 1i89 h ILE 114 N 0.50 1.04 -0.35 0.00 2.04 -0.80 -1.03 117.51 118.90 1i89 h ILE 114 Ca 0.12 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.85 1i89 h ILE 114 Cb 0.39 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 1i89 h ILE 114 CO 0.01 0.09 0.08 0.50 0.00 0.00 0.00 178.15 178.84 1i89 h LYS 115 N 0.50 0.20 -0.09 2.37 3.64 -0.86 -0.41 116.57 121.93 1i89 h LYS 115 Ca 0.17 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.57 1i89 h LYS 115 Cb 0.01 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1i89 h LYS 115 CO -0.08 0.14 -0.11 1.49 -2.27 0.00 0.00 179.45 178.62 1i89 h GLU 116 N 0.21 -0.14 -0.60 1.90 4.81 -1.01 -2.89 114.58 116.86 1i89 h GLU 116 Ca 0.17 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.49 1i89 h GLU 116 Cb 0.18 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.53 1i89 h GLU 116 CO -0.21 -0.09 0.27 2.35 -0.73 0.00 0.00 179.01 180.60 1i89 h TRP 117 N -0.15 0.47 0.00 0.92 7.01 -0.80 -3.47 115.95 119.94 1i89 h TRP 117 Ca 0.07 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.10 1i89 h TRP 117 Cb 0.25 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.19 1i89 h TRP 117 CO -0.22 0.17 0.00 0.41 -2.79 0.00 0.00 178.44 176.01 1i89 n GLY 118 N -1.28 0.91 3.83 2.65 0.00 -0.20 -4.85 105.19 106.25 1i89 n GLY 118 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1i89 n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i89 s GLN 119 N -0.50 2.96 0.37 1.61 -1.52 -1.26 -5.06 119.66 116.26 1i89 s GLN 119 Ca 0.00 -0.99 -0.28 0.00 -1.95 0.00 0.00 55.36 52.13 1i89 s GLN 119 Cb 0.00 -2.61 -0.11 0.00 -0.22 0.00 0.00 33.01 30.08 1i89 s GLN 119 CO 0.00 0.42 1.47 -2.14 -0.25 0.00 0.00 175.29 174.79 1i89 s PRO 120 N -3.70 4.13 0.60 2.91 0.02 -1.26 -4.87 135.00 132.83 1i89 s PRO 120 Ca 0.33 2.54 0.35 0.00 0.02 0.00 0.00 61.00 64.24 1i89 s PRO 120 Cb -0.08 -2.98 1.96 0.00 0.02 0.00 0.00 34.50 33.42 1i89 s PRO 120 CO 0.25 -0.50 2.25 1.57 -0.33 0.00 0.00 177.00 180.23 1i89 h LYS 121 N 3.04 0.00 0.00 5.54 2.10 -1.96 -2.19 116.57 123.10 1i89 h LYS 121 Ca -0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 1i89 h LYS 121 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 1i89 h LYS 121 CO 0.64 0.02 0.00 0.66 -2.00 0.00 0.00 179.45 178.78 1i89 h SER 122 N 0.00 0.00 0.14 7.07 4.64 -1.89 -1.90 113.55 121.60 1i89 h SER 122 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i89 h SER 122 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1i89 h SER 122 CO 0.00 0.00 -0.10 0.29 -0.87 0.00 0.00 176.83 176.16 1i89 n LYS 123 N -2.46 1.15 -2.26 4.77 4.76 -0.82 -4.82 118.16 118.47 1i89 n LYS 123 Ca -0.01 -0.57 -0.43 0.00 -2.87 0.00 0.00 58.31 54.43 1i89 n LYS 123 Cb 0.07 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.74 1i89 n LYS 123 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1i89 s ILE 124 N -2.24 3.92 -0.05 -0.18 1.01 -0.72 -4.26 121.20 118.68 1i89 s ILE 124 Ca 0.33 1.06 0.19 0.00 0.00 0.00 0.00 60.65 62.24 1i89 s ILE 124 Cb 0.20 -3.89 -0.30 0.00 0.01 0.00 0.00 42.46 38.49 1i89 s ILE 124 CO 0.42 -0.32 0.43 0.35 0.00 0.00 0.00 174.94 175.82 1i89 n THR 125 N 6.12 0.00 -4.06 2.92 -2.24 0.03 -4.77 114.28 112.28 1i89 n THR 125 Ca 0.17 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1i89 n THR 125 Cb 0.45 0.08 -0.12 0.00 -2.10 0.00 0.00 70.33 68.65 1i89 n THR 125 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1i89 s HIS 126 N -3.32 0.63 -0.06 4.78 3.76 -1.12 -1.13 115.29 118.83 1i89 s HIS 126 Ca -0.07 -0.47 -0.01 0.00 -0.15 0.00 0.00 55.06 54.37 1i89 s HIS 126 Cb 0.12 -0.38 0.03 0.00 1.11 0.00 0.00 32.58 33.46 1i89 s HIS 126 CO 0.80 -0.08 -0.01 -1.17 -0.85 0.00 0.00 174.74 173.43 1i89 s LEU 127 N -1.44 0.84 -0.21 0.89 2.96 0.13 -0.71 118.68 121.14 1i89 s LEU 127 Ca -0.09 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.67 1i89 s LEU 127 Cb -0.09 -0.42 -0.03 0.00 0.50 0.00 0.00 46.19 46.15 1i89 s LEU 127 CO 0.00 -0.15 0.02 -0.63 -1.32 0.00 0.00 176.35 174.28 1i89 s ILE 128 N 1.59 4.12 -0.06 6.68 1.01 -0.21 -0.78 121.20 133.54 1i89 s ILE 128 Ca -0.01 -0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.44 1i89 s ILE 128 Cb -0.13 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 1i89 s ILE 128 CO -0.03 0.41 -0.24 -0.69 0.00 0.00 0.00 174.94 174.39 1i89 s VAL 129 N 1.04 2.02 -0.04 2.92 1.01 -0.44 -0.06 120.40 126.85 1i89 s VAL 129 Ca 0.03 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 60.99 1i89 s VAL 129 Cb -0.14 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.54 1i89 s VAL 129 CO 0.02 0.56 -0.07 0.00 0.00 0.00 0.00 175.10 175.61 1i89 s THR 131 N 0.59 0.04 -0.62 0.00 -1.32 -0.51 -1.40 115.64 112.42 1i89 s THR 131 Ca -0.09 -0.34 0.07 0.00 -1.21 0.00 0.00 61.69 60.12 1i89 s THR 131 Cb -0.12 -1.04 0.17 0.00 -1.51 0.00 0.00 72.50 70.00 1i89 s THR 131 CO 0.01 -0.19 1.10 0.41 -2.21 0.00 0.00 174.62 173.74 1i89 n THR 132 N 0.09 0.86 -3.89 5.08 -1.04 -1.26 -1.50 114.28 112.61 1i89 n THR 132 Ca -0.17 -0.93 -0.30 0.00 -2.04 0.00 0.00 64.05 60.61 1i89 n THR 132 Cb 0.62 0.59 -0.15 0.00 -1.82 0.00 0.00 70.33 69.57 1i89 n THR 132 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1i89 s SER 133 N -0.94 4.14 0.00 8.00 1.04 -1.26 -4.74 113.70 119.94 1i89 s SER 133 Ca 0.14 -1.59 0.00 0.00 0.48 0.00 0.00 55.95 54.98 1i89 s SER 133 Cb 0.07 -1.19 0.00 0.00 0.10 0.00 0.00 66.02 65.00 1i89 s SER 133 CO 0.10 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1i89 n GLY 134 N 4.62 -2.17 3.12 7.32 0.00 -1.26 -4.74 105.19 112.08 1i89 n GLY 134 Ca -0.04 -1.49 -0.08 0.00 0.00 0.00 0.00 46.02 44.40 1i89 n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1i89 s VAL 135 N -2.67 0.17 0.13 1.61 -7.23 -1.26 -4.71 120.40 106.43 1i89 s VAL 135 Ca 0.00 -1.37 -0.25 0.00 -1.81 0.00 0.00 61.98 58.55 1i89 s VAL 135 Cb 0.00 -1.19 0.07 0.00 0.56 0.00 0.00 36.38 35.82 1i89 s VAL 135 CO 0.00 -0.75 0.84 -0.62 -0.31 0.00 0.00 175.10 174.26 1i89 s ASP 136 N -2.54 -0.31 -0.07 4.85 2.15 -1.26 -4.98 116.67 114.51 1i89 s ASP 136 Ca 0.01 -0.25 -0.00 0.00 0.43 0.00 0.00 52.55 52.74 1i89 s ASP 136 Cb 0.03 0.51 0.03 0.00 -0.30 0.00 0.00 42.92 43.19 1i89 s ASP 136 CO -0.08 -0.90 -0.02 -0.04 -0.17 0.00 0.00 175.17 173.96 1i89 s MET 137 N -3.42 0.82 0.72 4.34 -1.94 -1.26 -3.24 119.30 115.32 1i89 s MET 137 Ca 0.08 -0.01 -0.16 0.00 -1.71 0.00 0.00 55.69 53.88 1i89 s MET 137 Cb -0.02 -1.03 -0.03 0.00 2.01 0.00 0.00 34.83 35.76 1i89 s MET 137 CO -0.03 -0.23 0.58 -2.30 -0.01 0.00 0.00 175.02 173.03 1i89 n PRO 138 N 4.77 0.31 -1.40 2.03 -0.02 -1.26 -5.15 135.00 134.29 1i89 n PRO 138 Ca -0.13 0.15 -0.21 0.00 -2.02 0.00 0.00 63.50 61.28 1i89 n PRO 138 Cb 0.50 -1.87 0.15 0.00 -0.02 0.00 0.00 33.50 32.26 1i89 n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i89 n GLY 139 N 1.58 -1.34 0.31 -1.23 0.00 -1.20 -4.88 105.19 98.43 1i89 n GLY 139 Ca 0.10 -1.71 0.18 0.00 0.00 0.00 0.00 46.02 44.59 1i89 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i89 h ALA 140 N -1.81 1.30 -0.38 4.61 0.00 -1.93 -1.81 119.26 119.24 1i89 h ALA 140 Ca -0.31 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1i89 h ALA 140 Cb 0.86 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1i89 h ALA 140 CO 0.22 0.02 0.10 0.38 0.00 0.00 0.00 179.25 179.97 1i89 h ASP 141 N 0.00 0.57 -0.59 0.00 2.03 -1.92 -0.50 116.42 116.00 1i89 h ASP 141 Ca -0.00 -0.23 -0.04 0.00 -0.73 0.00 0.00 57.03 56.03 1i89 h ASP 141 Cb 0.05 -0.15 -0.03 0.00 -0.83 0.00 0.00 39.33 38.37 1i89 h ASP 141 CO 0.00 0.65 0.20 0.22 -1.03 0.00 0.00 179.24 179.28 1i89 h TYR 142 N 0.47 0.94 -0.74 4.15 3.20 -1.72 -1.83 116.97 121.43 1i89 h TYR 142 Ca 0.12 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1i89 h TYR 142 Cb 0.29 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1i89 h TYR 142 CO 0.02 0.77 0.37 1.96 -1.64 0.00 0.00 178.16 179.64 1i89 h GLN 143 N 0.83 1.06 0.00 1.82 1.08 -1.14 -1.29 115.11 117.47 1i89 h GLN 143 Ca 0.19 -0.14 -0.12 0.00 -1.45 0.00 0.00 58.65 57.13 1i89 h GLN 143 Cb 0.26 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 1i89 h GLN 143 CO -0.01 0.81 -0.58 -0.07 -0.95 0.00 0.00 178.83 178.04 1i89 h LEU 144 N 1.03 0.00 -0.32 1.46 3.38 -1.08 0.72 115.31 120.51 1i89 h LEU 144 Ca 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 1i89 h LEU 144 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1i89 h LEU 144 CO -0.04 0.58 0.11 0.74 0.09 0.00 0.00 178.44 179.93 1i89 h THR 145 N 0.00 1.19 0.77 0.22 2.02 -0.53 0.34 112.91 116.91 1i89 h THR 145 Ca -0.01 -0.62 -0.04 0.00 0.77 0.00 0.00 66.41 66.52 1i89 h THR 145 Cb 1.07 1.00 0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1i89 h THR 145 CO 0.08 0.21 -0.37 0.50 0.37 0.00 0.00 175.52 176.31 1i89 h LYS 146 N 0.37 -0.99 -0.81 6.66 3.64 -0.88 -1.32 116.57 123.23 1i89 h LYS 146 Ca 0.11 0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1i89 h LYS 146 Cb 0.22 0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.22 1i89 h LYS 146 CO -0.01 -0.66 0.53 -0.07 -2.27 0.00 0.00 179.45 176.98 1i89 h LEU 147 N -1.03 0.87 0.00 5.20 3.38 -0.70 -2.62 115.31 120.41 1i89 h LEU 147 Ca -0.11 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1i89 h LEU 147 Cb 0.79 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1i89 h LEU 147 CO 0.17 0.61 -0.48 0.18 0.09 0.00 0.00 178.44 179.01 1i89 n LEU 148 N -4.44 0.71 -2.15 1.67 4.77 0.09 -4.97 117.00 112.68 1i89 n LEU 148 Ca 0.10 0.29 -0.13 0.00 -0.03 0.00 0.00 56.01 56.25 1i89 n LEU 148 Cb 0.09 -0.22 0.04 0.00 -2.33 0.00 0.00 43.42 41.01 1i89 n LEU 148 CO 0.35 -0.07 0.12 0.61 -1.33 0.00 0.00 177.39 177.07 1i89 n GLY 149 N 1.34 0.12 3.73 -0.72 0.00 -0.57 -5.01 105.19 104.07 1i89 n GLY 149 Ca 0.04 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1i89 n GLY 149 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i89 s LEU 150 N -4.41 2.50 0.51 0.99 1.43 -0.78 -4.88 118.68 114.05 1i89 s LEU 150 Ca 0.31 1.63 -0.22 0.00 -1.03 0.00 0.00 54.13 54.81 1i89 s LEU 150 Cb -0.13 -4.13 -0.06 0.00 0.03 0.00 0.00 46.19 41.90 1i89 s LEU 150 CO 0.38 -2.50 1.30 -0.13 0.23 0.00 0.00 176.35 175.63 1i89 s ARG 151 N -4.90 3.36 0.46 1.70 1.81 -1.26 -4.87 118.95 115.25 1i89 s ARG 151 Ca 0.63 2.10 0.31 0.00 -1.72 0.00 0.00 55.73 57.05 1i89 s ARG 151 Cb -0.18 -2.32 1.33 0.00 -0.45 0.00 0.00 34.95 33.33 1i89 s ARG 151 CO 0.57 -0.97 1.92 -1.00 -0.68 0.00 0.00 175.30 175.13 1i89 h PRO 152 N 1.68 0.00 -0.67 3.54 0.13 -1.95 -1.68 132.00 133.06 1i89 h PRO 152 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1i89 h PRO 152 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1i89 h PRO 152 CO 0.58 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.83 1i89 n TYR 153 N -2.80 1.34 -1.89 1.56 0.18 -1.26 -4.92 117.16 109.37 1i89 n TYR 153 Ca 0.01 -0.48 -0.41 0.00 1.88 0.00 0.00 57.90 58.89 1i89 n TYR 153 Cb 0.25 -0.32 -0.02 0.00 -0.38 0.00 0.00 39.34 38.87 1i89 n TYR 153 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1i89 s VAL 154 N -2.08 2.33 -0.25 -3.48 0.11 -0.63 -4.96 120.40 111.44 1i89 s VAL 154 Ca 0.38 0.29 -0.25 0.00 -2.93 0.00 0.00 61.98 59.47 1i89 s VAL 154 Cb 0.28 -3.19 -0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1i89 s VAL 154 CO 0.14 0.05 0.84 -0.54 -3.33 0.00 0.00 175.10 172.26 1i89 s LYS 155 N -0.82 4.16 0.03 1.54 1.02 -0.28 -4.87 119.74 120.51 1i89 s LYS 155 Ca 0.59 0.93 0.01 0.00 0.02 0.00 0.00 55.97 57.51 1i89 s LYS 155 Cb -0.45 -3.66 -0.04 0.00 -0.52 0.00 0.00 37.83 33.17 1i89 s LYS 155 CO 0.49 -0.56 0.10 1.03 -0.92 0.00 0.00 175.35 175.50 1i89 s ARG 156 N 2.90 3.07 -0.30 1.68 0.52 -1.26 0.19 118.95 125.76 1i89 s ARG 156 Ca 0.35 -0.54 -0.03 0.00 -0.52 0.00 0.00 55.73 55.00 1i89 s ARG 156 Cb -0.15 -2.85 0.10 0.00 0.52 0.00 0.00 34.95 32.57 1i89 s ARG 156 CO 0.08 0.62 0.12 0.71 0.02 0.00 0.00 175.30 176.85 1i89 s TYR 157 N -1.30 0.75 -0.43 -0.53 1.51 0.04 -4.94 117.35 112.44 1i89 s TYR 157 Ca 0.27 -1.16 -0.17 0.00 -1.01 0.00 0.00 57.07 55.00 1i89 s TYR 157 Cb -0.12 -1.15 0.03 0.00 -0.11 0.00 0.00 41.96 40.61 1i89 s TYR 157 CO 0.18 -0.84 0.44 1.41 -1.11 0.00 0.00 175.55 175.63 1i89 s MET 158 N 1.93 3.08 -0.43 -0.62 1.75 -1.26 -1.33 119.30 122.41 1i89 s MET 158 Ca 0.09 -0.82 -0.11 0.00 -1.25 0.00 0.00 55.69 53.60 1i89 s MET 158 Cb -0.17 -3.99 0.08 0.00 2.84 0.00 0.00 34.83 33.60 1i89 s MET 158 CO -0.33 -0.88 0.30 -1.64 -0.65 0.00 0.00 175.02 171.82 1i89 s MET 159 N 2.11 2.69 0.12 4.11 -1.94 0.46 -4.99 119.30 121.86 1i89 s MET 159 Ca 0.11 -1.45 0.06 0.00 -1.71 0.00 0.00 55.69 52.71 1i89 s MET 159 Cb -0.18 -3.87 -0.04 0.00 2.01 0.00 0.00 34.83 32.75 1i89 s MET 159 CO 0.13 -0.98 -0.04 0.71 -0.01 0.00 0.00 175.02 174.83 1i89 s TYR 160 N 1.47 2.85 -1.51 -0.03 2.02 -1.26 -1.43 117.35 119.47 1i89 s TYR 160 Ca 0.03 -0.11 -0.13 0.00 -0.37 0.00 0.00 57.07 56.50 1i89 s TYR 160 Cb -0.23 -1.45 0.07 0.00 -0.40 0.00 0.00 41.96 39.95 1i89 s TYR 160 CO 0.03 0.47 1.00 0.94 -1.57 0.00 0.00 175.55 176.42 1i89 n GLN 161 N 0.39 -5.81 -0.00 -0.62 -0.06 -0.56 -4.91 117.38 105.81 1i89 n GLN 161 Ca -0.11 0.63 -0.18 0.00 -2.00 0.00 0.00 57.00 55.33 1i89 n GLN 161 Cb 0.53 -5.53 -0.14 0.00 -4.06 0.00 0.00 30.24 21.05 1i89 n GLN 161 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 1i89 h GLN 162 N -2.16 0.18 0.00 3.69 1.08 -1.81 -3.48 115.11 112.60 1i89 h GLN 162 Ca -0.58 -0.30 0.00 0.00 -1.45 0.00 0.00 58.65 56.32 1i89 h GLN 162 Cb 1.37 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.92 1i89 h GLN 162 CO 0.66 1.14 0.00 0.41 -0.95 0.00 0.00 178.83 180.09 1i89 n GLY 163 N 1.64 0.94 1.63 3.46 0.00 -1.26 -4.68 105.19 106.92 1i89 n GLY 163 Ca -0.14 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1i89 n GLY 163 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1i89 n PHE 165 N 0.00 0.00 1.36 1.61 1.16 -1.06 -4.05 117.46 116.48 1i89 n PHE 165 Ca 0.00 0.00 0.14 0.00 -1.87 0.00 0.00 57.45 55.72 1i89 n PHE 165 Cb 0.00 -0.33 0.73 0.00 -1.61 0.00 0.00 39.48 38.27 1i89 n PHE 165 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1i89 n ALA 166 N 0.36 2.44 -0.07 1.98 0.00 -1.26 -3.02 120.51 120.93 1i89 n ALA 166 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.26 1i89 n ALA 166 Cb 0.00 -1.48 0.18 0.00 0.00 0.00 0.00 19.45 18.15 1i89 n ALA 166 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1i89 h GLY 167 N 4.86 0.76 0.81 0.00 0.00 -1.82 -0.99 103.07 106.70 1i89 h GLY 167 Ca 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.77 1i89 h GLY 167 CO 0.00 0.49 0.01 -1.33 0.00 0.00 0.00 176.54 175.71 1i89 h GLY 168 N 0.96 0.34 0.74 4.60 0.00 -1.84 -3.05 103.07 104.81 1i89 h GLY 168 Ca 0.12 -0.24 0.05 0.00 0.00 0.00 0.00 47.33 47.27 1i89 h GLY 168 CO 0.03 0.22 0.47 -0.84 0.00 0.00 0.00 176.54 176.42 1i89 h THR 169 N 0.08 1.03 -0.22 4.70 2.02 -1.55 -1.10 112.91 117.87 1i89 h THR 169 Ca 0.05 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.84 1i89 h THR 169 Cb 0.36 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1i89 h THR 169 CO 0.01 0.16 -0.26 -0.37 0.37 0.00 0.00 175.52 175.42 1i89 h VAL 170 N 0.86 1.26 -0.29 3.16 -1.51 -1.21 -0.58 116.25 117.95 1i89 h VAL 170 Ca 0.33 -1.27 -0.07 0.00 -1.23 0.00 0.00 66.70 64.46 1i89 h VAL 170 Cb 0.15 1.38 -0.01 0.00 -2.13 0.00 0.00 31.29 30.68 1i89 h VAL 170 CO -0.16 0.40 -0.11 -0.07 -1.23 0.00 0.00 177.57 176.39 1i89 h LEU 171 N 0.38 0.59 -0.64 4.19 3.38 -1.30 0.48 115.31 122.40 1i89 h LEU 171 Ca 0.06 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 57.73 1i89 h LEU 171 Cb 0.67 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.18 1i89 h LEU 171 CO 0.05 0.85 0.26 -0.09 0.09 0.00 0.00 178.44 179.60 1i89 h ARG 172 N 0.33 0.44 0.11 1.13 2.43 -0.88 0.90 114.38 118.84 1i89 h ARG 172 Ca 0.07 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1i89 h ARG 172 Cb 0.62 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1i89 h ARG 172 CO 0.04 0.29 -0.05 1.25 -1.51 0.00 0.00 179.97 179.99 1i89 h LEU 173 N 0.46 -0.12 -1.38 3.80 5.85 -1.00 -3.23 115.31 119.69 1i89 h LEU 173 Ca 0.32 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1i89 h LEU 173 Cb 0.39 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1i89 h LEU 173 CO -0.30 0.25 -0.11 0.00 -0.34 0.00 0.00 178.44 177.94 1i89 h ALA 174 N 0.33 1.49 -0.26 1.25 0.00 -0.51 -1.82 119.26 119.74 1i89 h ALA 174 Ca -0.01 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1i89 h ALA 174 Cb 0.41 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1i89 h ALA 174 CO 0.02 0.36 -0.09 -0.22 0.00 0.00 0.00 179.25 179.32 1i89 h LYS 175 N 0.27 -0.04 -0.27 0.00 3.64 -0.85 -1.13 116.57 118.19 1i89 h LYS 175 Ca 0.06 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1i89 h LYS 175 Cb 0.36 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1i89 h LYS 175 CO 0.02 -0.03 -0.35 -0.44 -2.27 0.00 0.00 179.45 176.38 1i89 h ASP 176 N -0.04 0.62 -0.43 4.20 3.32 -1.37 -2.30 116.42 120.41 1i89 h ASP 176 Ca 0.13 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.92 1i89 h ASP 176 Cb 0.24 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1i89 h ASP 176 CO -0.29 0.92 0.25 -0.07 -1.72 0.00 0.00 179.24 178.32 1i89 h LEU 177 N 0.50 0.52 -0.20 1.55 3.38 -1.14 -2.37 115.31 117.55 1i89 h LEU 177 Ca 0.05 -0.07 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 1i89 h LEU 177 Cb 0.84 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1i89 h LEU 177 CO 0.07 0.43 -0.57 0.00 0.09 0.00 0.00 178.44 178.47 1i89 h ALA 178 N 1.11 0.35 0.00 1.53 0.00 -1.20 -3.25 119.26 117.79 1i89 h ALA 178 Ca 0.15 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.44 1i89 h ALA 178 Cb 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1i89 h ALA 178 CO -0.03 0.57 -0.47 0.93 0.00 0.00 0.00 179.25 180.25 1i89 h GLU 179 N 0.47 0.00 -0.02 0.00 5.08 -1.43 -3.13 114.58 115.55 1i89 h GLU 179 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1i89 h GLU 179 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1i89 h GLU 179 CO 0.12 0.47 -0.02 -1.71 -1.00 0.00 0.00 179.01 176.88 1i89 n ASN 180 N -3.57 2.40 -3.64 1.42 5.15 -0.89 -2.51 115.26 113.61 1i89 n ASN 180 Ca -0.00 -1.79 -0.28 0.00 -0.60 0.00 0.00 54.58 51.92 1i89 n ASN 180 Cb 0.57 0.02 -0.16 0.00 -0.53 0.00 0.00 39.78 39.67 1i89 n ASN 180 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1i89 s ASN 181 N -2.02 2.95 0.08 1.20 0.01 -1.18 -4.04 114.94 111.94 1i89 s ASN 181 Ca 0.31 -0.94 -0.35 0.00 -0.71 0.00 0.00 52.86 51.18 1i89 s ASN 181 Cb 0.20 -0.42 -0.14 0.00 0.41 0.00 0.00 41.25 41.30 1i89 s ASN 181 CO 0.32 -0.37 1.58 1.17 -1.51 0.00 0.00 177.10 178.29 1i89 n LYS 182 N 5.17 1.87 -0.43 -0.60 4.81 0.55 -1.41 118.16 128.11 1i89 n LYS 182 Ca -0.07 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 1i89 n LYS 182 Cb 0.46 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.09 1i89 n LYS 182 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i89 n GLY 183 N 3.40 1.69 3.76 3.14 0.00 -1.26 -4.93 105.19 111.00 1i89 n GLY 183 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1i89 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i89 s ALA 184 N -3.04 3.61 -0.13 4.61 0.00 -0.50 -4.89 121.76 121.42 1i89 s ALA 184 Ca 0.00 1.46 -0.01 0.00 0.00 0.00 0.00 51.96 53.41 1i89 s ALA 184 Cb 0.00 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.57 1i89 s ALA 184 CO 0.00 -0.88 -0.07 1.03 0.00 0.00 0.00 175.76 175.84 1i89 s ARG 185 N -1.25 1.46 -0.23 0.00 1.81 -1.26 -4.22 118.95 115.27 1i89 s ARG 185 Ca 0.56 -0.33 -0.09 0.00 -1.72 0.00 0.00 55.73 54.16 1i89 s ARG 185 Cb -0.44 -1.71 -0.04 0.00 -0.45 0.00 0.00 34.95 32.31 1i89 s ARG 185 CO 0.53 -0.32 0.11 0.08 -0.68 0.00 0.00 175.30 175.02 1i89 s VAL 186 N 1.69 4.96 -0.11 3.52 1.01 0.71 -0.79 120.40 131.39 1i89 s VAL 186 Ca 0.04 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 61.87 1i89 s VAL 186 Cb -0.13 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1i89 s VAL 186 CO -0.08 0.37 0.49 -0.22 0.00 0.00 0.00 175.10 175.66 1i89 s LEU 187 N 1.00 4.28 -0.17 3.92 2.96 0.12 -0.75 118.68 130.03 1i89 s LEU 187 Ca 0.06 0.84 0.00 0.00 -0.22 0.00 0.00 54.13 54.81 1i89 s LEU 187 Cb -0.14 -2.72 0.00 0.00 0.50 0.00 0.00 46.19 43.84 1i89 s LEU 187 CO 0.03 -0.00 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.22 1i89 s VAL 188 N 0.61 2.57 -0.15 1.68 1.01 0.47 -1.05 120.40 125.54 1i89 s VAL 188 Ca 0.27 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1i89 s VAL 188 Cb -0.15 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1i89 s VAL 188 CO 0.11 0.51 -0.14 -0.69 0.00 0.00 0.00 175.10 174.89 1i89 s VAL 189 N 1.01 1.55 -0.20 2.92 1.01 0.91 -0.56 120.40 127.04 1i89 s VAL 189 Ca -0.02 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 1i89 s VAL 189 Cb -0.15 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 1i89 s VAL 189 CO -0.04 0.43 0.03 0.00 0.00 0.00 0.00 175.10 175.53 1i89 s SER 191 N 0.89 0.67 -0.07 0.00 0.15 -0.49 -0.66 113.70 114.19 1i89 s SER 191 Ca 0.02 0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.76 1i89 s SER 191 Cb -0.14 -0.08 0.02 0.00 -1.71 0.00 0.00 66.02 64.11 1i89 s SER 191 CO 0.02 -0.20 -0.05 -1.61 1.20 0.00 0.00 173.24 172.60 1i89 s GLU 192 N 1.73 1.08 -0.10 5.44 0.41 -0.43 -4.41 118.70 122.43 1i89 s GLU 192 Ca -0.01 -0.13 0.02 0.00 -0.41 0.00 0.00 54.97 54.43 1i89 s GLU 192 Cb -0.12 -1.15 0.02 0.00 -1.78 0.00 0.00 34.13 31.09 1i89 s GLU 192 CO -0.03 -0.17 -0.14 0.08 -0.49 0.00 0.00 175.26 174.51 1i89 s VAL 193 N 1.36 1.39 -1.89 2.63 1.01 -1.26 -1.42 120.40 122.22 1i89 s VAL 193 Ca -0.03 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1i89 s VAL 193 Cb -0.14 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 34.97 1i89 s VAL 193 CO -0.03 0.42 0.96 0.35 0.00 0.00 0.00 175.10 176.80 1i89 n THR 194 N 4.20 0.02 0.27 3.92 -2.24 -1.26 -3.83 114.28 115.36 1i89 n THR 194 Ca -0.19 -0.02 0.12 0.00 -2.27 0.00 0.00 64.05 61.69 1i89 n THR 194 Cb 0.51 -0.04 0.74 0.00 -2.10 0.00 0.00 70.33 69.43 1i89 n THR 194 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i89 h ALA 195 N 2.92 1.36 0.00 6.98 0.00 -1.95 -0.77 119.26 127.80 1i89 h ALA 195 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1i89 h ALA 195 Cb 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i89 h ALA 195 CO 0.00 0.13 -0.33 0.28 0.00 0.00 0.00 179.25 179.33 1i89 h VAL 196 N 0.00 0.21 0.00 0.00 2.07 -1.86 -3.37 116.25 113.30 1i89 h VAL 196 Ca -0.00 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 1i89 h VAL 196 Cb 0.28 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1i89 h VAL 196 CO 0.01 0.12 -1.82 0.35 0.02 0.00 0.00 177.57 176.26 1i89 n THR 197 N -3.05 0.05 -1.68 2.57 -2.24 -0.73 -1.19 114.28 108.00 1i89 n THR 197 Ca 0.02 -0.42 -0.45 0.00 -2.27 0.00 0.00 64.05 60.94 1i89 n THR 197 Cb 0.59 0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 1i89 n THR 197 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1i89 n PHE 198 N -2.13 2.37 -3.53 4.78 -0.00 -0.37 -4.89 117.46 113.68 1i89 n PHE 198 Ca -0.04 0.28 -0.11 0.00 -0.00 0.00 0.00 57.45 57.58 1i89 n PHE 198 Cb 0.48 -2.54 -0.02 0.00 -0.00 0.00 0.00 39.48 37.40 1i89 n PHE 198 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1i89 s ARG 199 N 0.42 1.36 1.05 -4.13 1.70 -1.26 -4.82 118.95 113.27 1i89 s ARG 199 Ca 0.74 -0.60 -0.12 0.00 -0.47 0.00 0.00 55.73 55.28 1i89 s ARG 199 Cb -0.63 0.58 0.22 0.00 -0.57 0.00 0.00 34.95 34.55 1i89 s ARG 199 CO 0.42 -0.60 1.07 0.20 -1.08 0.00 0.00 175.30 175.31 1i89 s GLY 200 N -2.79 1.57 0.28 3.88 0.00 -0.71 -4.86 107.32 104.70 1i89 s GLY 200 Ca 0.03 -0.17 -0.15 0.00 0.00 0.00 0.00 44.72 44.44 1i89 s GLY 200 CO -0.09 0.46 0.70 2.56 0.00 0.00 0.00 173.10 176.73 1i89 s PRO 201 N -4.74 4.02 -0.07 2.90 0.04 -1.26 -4.26 135.00 131.64 1i89 s PRO 201 Ca 0.66 0.65 -0.03 0.00 0.04 0.00 0.00 61.00 62.32 1i89 s PRO 201 Cb -0.21 -2.57 0.03 0.00 0.04 0.00 0.00 34.50 31.79 1i89 s PRO 201 CO 0.60 0.24 0.15 0.45 0.04 0.00 0.00 177.00 178.48 1i89 s SER 202 N -2.14 -0.13 0.01 6.66 0.15 -1.26 -4.76 113.70 112.23 1i89 s SER 202 Ca 0.50 0.31 0.17 0.00 0.70 0.00 0.00 55.95 57.64 1i89 s SER 202 Cb -0.12 0.22 0.73 0.00 -1.71 0.00 0.00 66.02 65.15 1i89 s SER 202 CO 0.19 -0.13 1.55 -0.90 1.20 0.00 0.00 173.24 175.15 1i89 n ASP 203 N 3.96 0.03 -1.12 5.45 5.68 -1.26 -1.91 116.55 127.39 1i89 n ASP 203 Ca -0.24 0.51 0.12 0.00 -0.50 0.00 0.00 54.79 54.68 1i89 n ASP 203 Cb 0.53 -0.51 0.21 0.00 -1.14 0.00 0.00 41.12 40.21 1i89 n ASP 203 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1i89 n THR 204 N -1.53 0.43 -3.46 2.12 -2.24 -1.26 -4.61 114.28 103.73 1i89 n THR 204 Ca 0.04 -0.70 -0.27 0.00 -2.27 0.00 0.00 64.05 60.85 1i89 n THR 204 Cb 0.20 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.36 1i89 n THR 204 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1i89 n HIS 205 N 1.45 0.27 0.36 4.78 8.25 -0.80 -4.96 115.22 124.56 1i89 n HIS 205 Ca 0.19 -3.60 0.13 0.00 -0.26 0.00 0.00 57.72 54.18 1i89 n HIS 205 Cb 0.60 -0.07 0.36 0.00 1.12 0.00 0.00 29.99 32.00 1i89 n HIS 205 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1i89 h LEU 206 N 5.19 0.00 -0.17 2.41 3.38 -1.82 -2.29 115.31 122.02 1i89 h LEU 206 Ca 0.21 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 1i89 h LEU 206 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1i89 h LEU 206 CO 0.48 0.00 -0.31 -2.24 0.09 0.00 0.00 178.44 176.46 1i89 h ASP 207 N 0.00 0.57 -0.59 -0.43 2.03 -1.90 -0.48 116.42 115.62 1i89 h ASP 207 Ca 0.00 -0.54 0.09 0.00 -0.73 0.00 0.00 57.03 55.84 1i89 h ASP 207 Cb 0.78 -0.16 -0.07 0.00 -0.83 0.00 0.00 39.33 39.05 1i89 h ASP 207 CO 0.00 1.01 0.22 -1.28 -1.03 0.00 0.00 179.24 178.16 1i89 h SER 208 N 0.16 0.23 -0.84 4.15 0.87 -1.47 -2.61 113.55 114.04 1i89 h SER 208 Ca 0.01 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1i89 h SER 208 Cb 0.90 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.87 1i89 h SER 208 CO 0.07 0.14 0.51 0.25 -0.53 0.00 0.00 176.83 177.28 1i89 h LEU 209 N 0.41 1.00 -0.68 2.23 5.85 -1.29 -2.50 115.31 120.32 1i89 h LEU 209 Ca 0.29 -0.06 0.09 0.00 0.84 0.00 0.00 57.88 59.05 1i89 h LEU 209 Cb 0.34 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 1i89 h LEU 209 CO -0.29 0.76 0.32 0.58 -0.34 0.00 0.00 178.44 179.47 1i89 h VAL 210 N 1.15 0.82 -0.95 1.05 2.07 -0.71 0.12 116.25 119.81 1i89 h VAL 210 Ca 0.30 -0.19 0.20 0.00 0.82 0.00 0.00 66.70 67.83 1i89 h VAL 210 Cb -0.06 0.23 -0.11 0.00 -1.52 0.00 0.00 31.29 29.83 1i89 h VAL 210 CO -0.06 0.10 0.53 1.23 0.02 0.00 0.00 177.57 179.39 1i89 h GLY 211 N 0.54 1.68 2.00 2.17 0.00 -1.27 -1.31 103.07 106.89 1i89 h GLY 211 Ca 0.34 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 1i89 h GLY 211 CO -0.28 -0.14 -0.13 1.46 0.00 0.00 0.00 176.54 177.46 1i89 h GLN 212 N 0.63 0.00 0.00 4.80 1.08 -0.66 -1.78 115.11 119.17 1i89 h GLN 212 Ca 0.57 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.62 1i89 h GLN 212 Cb 0.95 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.36 1i89 h GLN 212 CO -0.43 0.13 -0.74 0.00 -0.95 0.00 0.00 178.83 176.84 1i89 h ALA 213 N 1.87 0.58 0.00 3.87 0.00 -0.96 -3.42 119.26 121.21 1i89 h ALA 213 Ca -0.00 -0.63 -0.32 0.00 0.00 0.00 0.00 54.91 53.95 1i89 h ALA 213 Cb 0.48 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1i89 h ALA 213 CO 0.02 0.84 -2.22 1.28 0.00 0.00 0.00 179.25 179.17 1i89 n LEU 214 N -3.23 2.44 -4.76 0.00 4.77 -0.73 -4.92 117.00 110.57 1i89 n LEU 214 Ca 0.00 -0.10 -0.40 0.00 -0.03 0.00 0.00 56.01 55.49 1i89 n LEU 214 Cb 0.81 -0.54 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 1i89 n LEU 214 CO 0.43 0.78 0.51 -0.36 -1.33 0.00 0.00 177.39 177.42 1i89 s PHE 215 N -2.43 3.87 0.25 -1.77 0.40 -0.86 -1.11 117.98 116.34 1i89 s PHE 215 Ca -0.25 1.64 0.01 0.00 -0.60 0.00 0.00 56.93 57.73 1i89 s PHE 215 Cb 0.07 -2.83 -0.04 0.00 0.51 0.00 0.00 43.02 40.73 1i89 s PHE 215 CO 0.53 0.42 0.15 0.20 0.70 0.00 0.00 175.22 177.22 1i89 s GLY 216 N -0.79 1.73 0.12 4.36 0.00 -0.61 -4.83 107.32 107.31 1i89 s GLY 216 Ca 0.38 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 43.34 1i89 s GLY 216 CO 0.26 -1.49 0.19 0.99 0.00 0.00 0.00 173.10 173.05 1i89 s ASP 217 N -3.26 5.96 0.00 1.64 1.11 -0.47 -4.17 116.67 117.47 1i89 s ASP 217 Ca 0.38 0.07 0.00 0.00 0.18 0.00 0.00 52.55 53.18 1i89 s ASP 217 Cb 0.06 -1.71 0.00 0.00 1.07 0.00 0.00 42.92 42.35 1i89 s ASP 217 CO 0.15 0.10 0.00 0.61 1.18 0.00 0.00 175.17 177.22 1i89 n GLY 218 N -0.12 1.84 3.16 0.21 0.00 -0.51 -4.49 105.19 105.29 1i89 n GLY 218 Ca -0.07 -0.58 -0.18 0.00 0.00 0.00 0.00 46.02 45.19 1i89 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i89 s ALA 219 N -2.00 1.15 0.00 4.61 0.00 -0.33 -1.31 121.76 123.88 1i89 s ALA 219 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1i89 s ALA 219 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 1i89 s ALA 219 CO 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 175.76 175.85 1i89 s ALA 220 N -1.20 0.61 0.02 0.00 0.00 0.16 -0.72 121.76 120.63 1i89 s ALA 220 Ca -0.02 -0.39 0.06 0.00 0.00 0.00 0.00 51.96 51.61 1i89 s ALA 220 Cb -0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1i89 s ALA 220 CO 0.02 0.13 -0.19 0.00 0.00 0.00 0.00 175.76 175.72 1i89 s ALA 221 N -0.36 1.58 0.16 0.00 0.00 0.27 -0.78 121.76 122.62 1i89 s ALA 221 Ca 0.01 -0.91 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1i89 s ALA 221 Cb -0.04 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 1i89 s ALA 221 CO -0.00 0.37 -0.17 -0.51 0.00 0.00 0.00 175.76 175.44 1i89 s LEU 222 N -0.82 2.43 -0.20 0.00 1.43 0.27 -1.15 118.68 120.64 1i89 s LEU 222 Ca 0.07 -0.85 -0.02 0.00 -1.03 0.00 0.00 54.13 52.29 1i89 s LEU 222 Cb -0.08 -0.76 -0.00 0.00 0.03 0.00 0.00 46.19 45.38 1i89 s LEU 222 CO 0.01 -0.06 -0.09 -0.63 0.23 0.00 0.00 176.35 175.80 1i89 s ILE 223 N -2.09 2.99 -0.06 -0.59 -1.09 -0.99 -0.39 121.20 118.98 1i89 s ILE 223 Ca 0.14 -0.63 0.06 0.00 -2.23 0.00 0.00 60.65 57.99 1i89 s ILE 223 Cb -0.05 -2.33 -0.01 0.00 -1.58 0.00 0.00 42.46 38.49 1i89 s ILE 223 CO 0.06 0.46 -0.25 -0.69 -1.23 0.00 0.00 174.94 173.29 1i89 s VAL 224 N 1.34 2.02 0.10 2.92 1.01 0.07 -0.27 120.40 127.59 1i89 s VAL 224 Ca 0.04 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 60.73 1i89 s VAL 224 Cb -0.14 -1.72 0.08 0.00 0.00 0.00 0.00 36.38 34.61 1i89 s VAL 224 CO -0.05 0.56 0.70 -0.83 0.00 0.00 0.00 175.10 175.48 1i89 s GLY 225 N -0.09 -0.57 0.32 4.51 0.00 0.08 -0.21 107.32 111.36 1i89 s GLY 225 Ca -0.05 0.70 0.03 0.00 0.00 0.00 0.00 44.72 45.40 1i89 s GLY 225 CO 0.04 0.25 0.49 -0.56 0.00 0.00 0.00 173.10 173.32 1i89 s SER 226 N -2.59 6.17 -1.12 1.64 0.01 -1.26 0.38 113.70 116.93 1i89 s SER 226 Ca 0.02 0.17 -0.12 0.00 1.31 0.00 0.00 55.95 57.33 1i89 s SER 226 Cb -0.01 -1.74 -0.04 0.00 0.21 0.00 0.00 66.02 64.45 1i89 s SER 226 CO -0.11 -0.31 0.85 0.47 0.41 0.00 0.00 173.24 174.55 1i89 n ASP 227 N -1.67 -5.42 -4.75 2.44 8.00 -1.26 -4.80 116.55 109.09 1i89 n ASP 227 Ca -0.04 -0.85 -0.38 0.00 0.71 0.00 0.00 54.79 54.23 1i89 n ASP 227 Cb 0.57 -4.31 0.04 0.00 -0.02 0.00 0.00 41.12 37.40 1i89 n ASP 227 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1i89 s PRO 228 N -5.26 3.15 -0.32 -0.24 0.02 -1.26 -4.94 135.00 126.15 1i89 s PRO 228 Ca 0.41 2.17 -0.29 0.00 0.02 0.00 0.00 61.00 63.31 1i89 s PRO 228 Cb -0.10 -2.23 0.01 0.00 0.02 0.00 0.00 34.50 32.20 1i89 s PRO 228 CO 0.80 -1.16 1.26 0.08 -0.33 0.00 0.00 177.00 177.64 1i89 s VAL 229 N -1.34 4.20 0.16 3.83 1.01 -1.26 -4.96 120.40 122.04 1i89 s VAL 229 Ca 0.72 1.34 -0.34 0.00 0.00 0.00 0.00 61.98 63.70 1i89 s VAL 229 Cb -0.39 -4.24 -0.15 0.00 0.00 0.00 0.00 36.38 31.60 1i89 s VAL 229 CO 0.46 -0.53 1.36 -2.65 0.00 0.00 0.00 175.10 173.73 1i89 n PRO 230 N 7.32 1.59 -0.92 2.72 -0.02 -1.26 -1.09 135.00 143.34 1i89 n PRO 230 Ca 0.14 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1i89 n PRO 230 Cb 0.47 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1i89 n PRO 230 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1i89 n GLU 231 N 2.39 -0.58 0.02 -0.52 1.02 -1.26 -4.62 120.64 117.09 1i89 n GLU 231 Ca 0.15 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 1i89 n GLU 231 Cb 0.26 -3.73 0.00 0.00 -0.02 0.00 0.00 31.44 27.95 1i89 n GLU 231 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1i89 n ILE 232 N -2.35 0.27 -3.82 -3.67 -0.00 -0.98 -5.03 119.36 103.78 1i89 n ILE 232 Ca 0.00 0.09 -0.28 0.00 -0.00 0.00 0.00 62.75 62.56 1i89 n ILE 232 Cb 0.15 -1.34 -0.03 0.00 -0.00 0.00 0.00 39.64 38.41 1i89 n ILE 232 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 1i89 s GLU 233 N -2.00 3.49 -0.34 0.38 2.02 -0.25 -4.98 118.70 117.02 1i89 s GLU 233 Ca 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.57 1i89 s GLU 233 Cb 0.00 -2.92 0.11 0.00 0.10 0.00 0.00 34.13 31.42 1i89 s GLU 233 CO 0.00 0.48 0.13 0.21 0.02 0.00 0.00 175.26 176.10 1i89 s LYS 234 N -3.09 0.93 0.34 1.61 2.20 -1.26 -4.67 119.74 115.80 1i89 s LYS 234 Ca 0.37 -1.39 -0.26 0.00 -0.36 0.00 0.00 55.97 54.33 1i89 s LYS 234 Cb -0.11 -2.19 -0.13 0.00 -1.51 0.00 0.00 37.83 33.88 1i89 s LYS 234 CO 0.28 -1.03 0.93 -2.30 -0.36 0.00 0.00 175.35 172.87 1i89 n PRO 235 N 4.46 1.20 -0.00 4.03 -0.02 -1.26 -4.58 135.00 138.83 1i89 n PRO 235 Ca 0.01 0.43 -0.03 0.00 -2.02 0.00 0.00 63.50 61.89 1i89 n PRO 235 Cb 0.40 -1.83 -0.01 0.00 -0.02 0.00 0.00 33.50 32.05 1i89 n PRO 235 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1i89 n ILE 236 N -0.14 0.62 -4.02 4.25 5.41 0.28 -4.90 119.36 120.86 1i89 n ILE 236 Ca 0.10 0.11 -0.10 0.00 1.00 0.00 0.00 62.75 63.86 1i89 n ILE 236 Cb 0.35 -1.61 -0.11 0.00 -0.71 0.00 0.00 39.64 37.56 1i89 n ILE 236 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1i89 s PHE 237 N -2.09 0.44 -0.07 1.39 0.08 -1.20 -3.53 117.98 113.00 1i89 s PHE 237 Ca -0.05 -0.59 0.01 0.00 0.12 0.00 0.00 56.93 56.43 1i89 s PHE 237 Cb 0.01 -0.29 -0.03 0.00 -0.57 0.00 0.00 43.02 42.15 1i89 s PHE 237 CO 0.06 -0.17 -0.10 -1.21 -0.10 0.00 0.00 175.22 173.71 1i89 s GLU 238 N -1.83 2.78 0.06 0.44 2.02 0.08 -0.35 118.70 121.90 1i89 s GLU 238 Ca -0.11 -0.60 -0.17 0.00 0.02 0.00 0.00 54.97 54.11 1i89 s GLU 238 Cb -0.08 -2.55 -0.06 0.00 0.10 0.00 0.00 34.13 31.54 1i89 s GLU 238 CO -0.02 0.59 0.50 -1.64 0.02 0.00 0.00 175.26 174.72 1i89 s MET 239 N -0.61 4.05 0.00 1.61 -1.94 0.20 -0.40 119.30 122.21 1i89 s MET 239 Ca 0.09 0.56 0.00 0.00 -1.71 0.00 0.00 55.69 54.64 1i89 s MET 239 Cb -0.11 -3.17 0.00 0.00 2.01 0.00 0.00 34.83 33.55 1i89 s MET 239 CO 0.02 0.63 0.00 0.28 -0.01 0.00 0.00 175.02 175.93 1i89 n VAL 240 N 1.57 0.00 -3.62 -6.03 0.31 -0.38 -4.24 118.33 105.94 1i89 n VAL 240 Ca -0.11 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.07 1i89 n VAL 240 Cb 0.51 -0.55 -0.07 0.00 -0.91 0.00 0.00 33.84 32.82 1i89 n VAL 240 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1i89 s TRP 241 N -1.85 -0.63 0.11 3.52 -0.00 -1.23 -5.00 118.94 113.85 1i89 s TRP 241 Ca 0.00 1.35 0.01 0.00 -0.00 0.00 0.00 56.10 57.46 1i89 s TRP 241 Cb 0.00 0.28 -0.04 0.00 -0.00 0.00 0.00 33.47 33.71 1i89 s TRP 241 CO 0.00 -0.44 -0.04 0.95 -0.00 0.00 0.00 176.95 177.42 1i89 s THR 242 N -0.38 0.59 0.05 5.86 -4.23 -1.26 0.33 115.64 116.61 1i89 s THR 242 Ca -0.05 -1.93 -0.20 0.00 -1.18 0.00 0.00 61.69 58.34 1i89 s THR 242 Cb -0.03 -1.76 0.04 0.00 1.34 0.00 0.00 72.50 72.09 1i89 s THR 242 CO 0.04 -0.80 0.45 0.00 -0.54 0.00 0.00 174.62 173.78 1i89 s ALA 243 N -3.70 -1.12 -0.02 3.99 0.00 -0.19 -4.98 121.76 115.73 1i89 s ALA 243 Ca 0.14 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.51 1i89 s ALA 243 Cb 0.06 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.57 1i89 s ALA 243 CO -0.04 -0.48 -0.05 -1.14 0.00 0.00 0.00 175.76 174.05 1i89 s GLN 244 N -2.53 0.64 0.17 0.00 0.74 -1.26 -0.07 119.66 117.35 1i89 s GLN 244 Ca -0.05 -0.14 -0.04 0.00 0.05 0.00 0.00 55.36 55.18 1i89 s GLN 244 Cb -0.01 -0.65 -0.03 0.00 1.10 0.00 0.00 33.01 33.43 1i89 s GLN 244 CO -0.03 0.02 0.17 -0.08 -0.55 0.00 0.00 175.29 174.82 1i89 s THR 245 N 0.43 0.05 -0.17 -0.34 -1.32 -0.13 -5.00 115.64 109.16 1i89 s THR 245 Ca -0.05 -1.80 -0.00 0.00 -1.21 0.00 0.00 61.69 58.62 1i89 s THR 245 Cb -0.09 -2.20 -0.00 0.00 -1.51 0.00 0.00 72.50 68.70 1i89 s THR 245 CO -0.00 -0.21 -0.14 -0.63 -2.21 0.00 0.00 174.62 171.43 1i89 s ILE 246 N -4.07 2.76 0.30 5.08 1.01 -1.26 -1.22 121.20 123.79 1i89 s ILE 246 Ca 0.28 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.92 1i89 s ILE 246 Cb 0.06 -2.18 -0.10 0.00 0.01 0.00 0.00 42.46 40.25 1i89 s ILE 246 CO 0.06 0.50 1.11 0.00 0.00 0.00 0.00 174.94 176.62 1i89 s ALA 247 N 0.93 3.38 0.78 9.38 0.00 0.01 -4.98 121.76 131.25 1i89 s ALA 247 Ca -0.03 0.91 -0.13 0.00 0.00 0.00 0.00 51.96 52.71 1i89 s ALA 247 Cb -0.15 -3.33 0.07 0.00 0.00 0.00 0.00 23.12 19.70 1i89 s ALA 247 CO -0.01 -0.21 1.18 -1.25 0.00 0.00 0.00 175.76 175.46 1i89 s PRO 248 N -1.59 1.88 -1.48 0.00 0.04 -1.26 -3.51 135.00 129.07 1i89 s PRO 248 Ca 0.46 1.64 -0.04 0.00 0.04 0.00 0.00 61.00 63.10 1i89 s PRO 248 Cb -0.32 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1i89 s PRO 248 CO 0.41 -2.01 0.40 -0.25 0.04 0.00 0.00 177.00 175.58 1i89 n ASP 249 N -3.18 -5.33 -0.18 6.66 8.00 -1.26 -4.82 116.55 116.43 1i89 n ASP 249 Ca 0.12 -0.20 0.06 0.00 0.71 0.00 0.00 54.79 55.49 1i89 n ASP 249 Cb 0.51 -4.37 0.09 0.00 -0.02 0.00 0.00 41.12 37.33 1i89 n ASP 249 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1i89 n SER 250 N -2.30 1.61 -4.68 -2.24 3.41 -1.23 -5.02 113.62 103.17 1i89 n SER 250 Ca -0.12 -2.66 -0.43 0.00 -0.26 0.00 0.00 58.87 55.39 1i89 n SER 250 Cb 0.62 -0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 1i89 n SER 250 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1i89 n GLU 251 N -0.94 2.76 -1.04 4.33 2.13 -1.26 -1.26 120.64 125.35 1i89 n GLU 251 Ca 0.10 1.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.91 1i89 n GLU 251 Cb 0.63 -2.91 -0.01 0.00 0.27 0.00 0.00 31.44 29.43 1i89 n GLU 251 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i89 n GLY 252 N 4.29 0.52 0.07 8.31 0.00 -1.26 -4.94 105.19 112.17 1i89 n GLY 252 Ca 0.19 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 1i89 n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i89 h ALA 253 N 0.00 0.07 -3.22 4.61 0.00 -1.49 -3.24 119.26 115.99 1i89 h ALA 253 Ca -0.03 0.02 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 1i89 h ALA 253 Cb 0.20 0.04 -0.37 0.00 0.00 0.00 0.00 17.79 17.66 1i89 h ALA 253 CO 0.05 -0.47 -0.81 0.42 0.00 0.00 0.00 179.25 178.44 1i89 s ILE 254 N -6.19 1.26 0.01 0.00 1.01 -1.26 -1.65 121.20 114.37 1i89 s ILE 254 Ca -0.13 -0.54 0.05 0.00 0.00 0.00 0.00 60.65 60.03 1i89 s ILE 254 Cb 0.08 -1.29 -0.02 0.00 0.01 0.00 0.00 42.46 41.24 1i89 s ILE 254 CO 0.67 0.31 -0.15 -1.81 0.00 0.00 0.00 174.94 173.96 1i89 s ASP 255 N 1.60 1.81 -0.05 3.58 1.01 -0.49 -4.30 116.67 119.82 1i89 s ASP 255 Ca 0.03 -0.36 0.00 0.00 0.71 0.00 0.00 52.55 52.93 1i89 s ASP 255 Cb -0.14 -0.17 0.02 0.00 1.01 0.00 0.00 42.92 43.65 1i89 s ASP 255 CO -0.09 0.13 -0.02 -0.76 0.21 0.00 0.00 175.17 174.64 1i89 s LEU 256 N -0.70 1.04 -0.07 1.23 1.02 -1.26 -1.24 118.68 118.70 1i89 s LEU 256 Ca 0.05 -0.10 0.04 0.00 0.02 0.00 0.00 54.13 54.14 1i89 s LEU 256 Cb -0.07 -0.42 -0.02 0.00 0.02 0.00 0.00 46.19 45.71 1i89 s LEU 256 CO 0.00 -0.11 -0.19 -1.00 0.02 0.00 0.00 176.35 175.07 1i89 s HIS 257 N 1.32 2.60 -0.38 0.29 3.76 -1.13 -4.90 115.29 116.84 1i89 s HIS 257 Ca -0.05 -0.50 -0.24 0.00 -0.15 0.00 0.00 55.06 54.12 1i89 s HIS 257 Cb -0.13 -1.65 0.01 0.00 1.11 0.00 0.00 32.58 31.91 1i89 s HIS 257 CO -0.02 -0.07 0.82 -1.17 -0.85 0.00 0.00 174.74 173.44 1i89 s LEU 258 N -0.27 4.11 0.46 0.89 2.96 -1.26 -1.31 118.68 124.26 1i89 s LEU 258 Ca 0.01 0.31 0.03 0.00 -0.22 0.00 0.00 54.13 54.25 1i89 s LEU 258 Cb -0.13 -3.07 -0.01 0.00 0.50 0.00 0.00 46.19 43.48 1i89 s LEU 258 CO 0.03 -0.80 0.10 -0.13 -1.32 0.00 0.00 176.35 174.22 1i89 s ARG 259 N 3.24 2.08 0.60 1.98 1.81 0.32 -4.98 118.95 124.00 1i89 s ARG 259 Ca 0.33 -2.31 0.30 0.00 -1.72 0.00 0.00 55.73 52.33 1i89 s ARG 259 Cb -0.13 -0.89 1.81 0.00 -0.45 0.00 0.00 34.95 35.30 1i89 s ARG 259 CO 0.19 -0.49 2.21 0.93 -0.68 0.00 0.00 175.30 177.46 1i89 h GLU 260 N 1.57 0.00 -0.64 3.54 5.08 -1.95 1.00 114.58 123.17 1i89 h GLU 260 Ca -0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1i89 h GLU 260 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1i89 h GLU 260 CO 0.61 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.62 1i89 n ALA 261 N -2.30 3.23 0.00 3.43 0.00 -1.26 0.25 120.51 123.86 1i89 n ALA 261 Ca -0.02 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 51.94 1i89 n ALA 261 Cb 0.16 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1i89 n ALA 261 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i89 n GLY 262 N 0.92 -1.79 3.57 0.00 0.00 0.34 -4.69 105.19 103.54 1i89 n GLY 262 Ca 0.23 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 1i89 n GLY 262 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i89 s LEU 263 N 0.00 4.26 0.36 0.99 2.96 -0.33 -0.52 118.68 126.40 1i89 s LEU 263 Ca 0.00 0.11 -0.09 0.00 -0.22 0.00 0.00 54.13 53.93 1i89 s LEU 263 Cb 0.00 -2.84 -0.06 0.00 0.50 0.00 0.00 46.19 43.79 1i89 s LEU 263 CO 0.00 -0.67 0.70 0.42 -1.32 0.00 0.00 176.35 175.49 1i89 s THR 264 N 2.85 4.84 -0.09 3.68 -4.23 -0.43 -4.41 115.64 117.86 1i89 s THR 264 Ca 0.26 0.50 0.01 0.00 -1.18 0.00 0.00 61.69 61.28 1i89 s THR 264 Cb -0.14 -3.72 0.02 0.00 1.34 0.00 0.00 72.50 70.00 1i89 s THR 264 CO 0.16 -0.43 -0.10 0.12 -0.54 0.00 0.00 174.62 173.83 1i89 s PHE 265 N -2.25 1.46 -0.01 3.99 5.36 -1.26 -2.82 117.98 122.46 1i89 s PHE 265 Ca 0.49 -0.63 0.03 0.00 -0.96 0.00 0.00 56.93 55.87 1i89 s PHE 265 Cb -0.10 -1.14 -0.01 0.00 -0.34 0.00 0.00 43.02 41.43 1i89 s PHE 265 CO 0.30 -0.39 -0.11 -1.01 -1.46 0.00 0.00 175.22 172.55 1i89 s HIS 266 N 1.14 0.97 -0.24 10.12 3.76 -0.37 -3.57 115.29 127.09 1i89 s HIS 266 Ca -0.06 -0.19 -0.01 0.00 -0.15 0.00 0.00 55.06 54.66 1i89 s HIS 266 Cb -0.14 -0.63 0.07 0.00 1.11 0.00 0.00 32.58 32.99 1i89 s HIS 266 CO -0.02 -0.02 0.02 -0.51 -0.85 0.00 0.00 174.74 173.37 1i89 s LEU 267 N -0.28 2.03 0.00 0.89 1.43 -1.26 -1.40 118.68 120.08 1i89 s LEU 267 Ca 0.04 -1.19 0.15 0.00 -1.03 0.00 0.00 54.13 52.10 1i89 s LEU 267 Cb -0.04 -0.89 -0.06 0.00 0.03 0.00 0.00 46.19 45.23 1i89 s LEU 267 CO -0.00 -0.31 0.76 0.18 0.23 0.00 0.00 176.35 177.20 1i89 n LEU 268 N 4.85 1.25 -4.30 1.79 4.77 -0.66 -4.91 117.00 119.80 1i89 n LEU 268 Ca -0.08 -0.67 -0.18 0.00 -0.03 0.00 0.00 56.01 55.06 1i89 n LEU 268 Cb 0.45 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 1i89 n LEU 268 CO 0.14 0.26 -0.18 -0.54 -1.33 0.00 0.00 177.39 175.74 1i89 s LYS 269 N -2.04 1.56 -0.98 3.23 1.02 -1.24 -4.89 119.74 116.40 1i89 s LYS 269 Ca 0.10 -1.89 -0.23 0.00 0.02 0.00 0.00 55.97 53.97 1i89 s LYS 269 Cb 0.12 0.10 0.06 0.00 -0.52 0.00 0.00 37.83 37.58 1i89 s LYS 269 CO 0.47 -0.50 1.39 0.34 -0.92 0.00 0.00 175.35 176.13 1i89 s ASP 270 N -3.33 6.48 0.10 2.83 -1.08 -1.26 -4.90 116.67 115.50 1i89 s ASP 270 Ca 0.38 -1.41 -0.26 0.00 -0.52 0.00 0.00 52.55 50.73 1i89 s ASP 270 Cb 0.05 -2.55 -0.11 0.00 -1.46 0.00 0.00 42.92 38.85 1i89 s ASP 270 CO 0.19 -1.49 1.67 0.58 0.52 0.00 0.00 175.17 176.64 1i89 h VAL 271 N 6.61 0.59 -0.84 1.11 2.07 -1.98 -0.79 116.25 123.02 1i89 h VAL 271 Ca 0.14 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.79 1i89 h VAL 271 Cb 1.02 0.59 -0.09 0.00 -1.52 0.00 0.00 31.29 31.29 1i89 h VAL 271 CO 1.38 0.00 0.45 -0.65 0.02 0.00 0.00 177.57 178.77 1i89 h PRO 272 N -0.38 0.67 -0.36 1.57 0.11 -1.90 0.28 132.00 131.99 1i89 h PRO 272 Ca 0.01 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.97 1i89 h PRO 272 Cb 0.37 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1i89 h PRO 272 CO -0.06 0.44 -0.21 0.78 -0.21 0.00 0.00 178.00 178.74 1i89 h GLY 273 N 0.69 0.85 0.95 -0.55 0.00 -1.82 -1.31 103.07 101.88 1i89 h GLY 273 Ca 0.44 -0.79 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 1i89 h GLY 273 CO -0.32 0.71 0.10 -2.22 0.00 0.00 0.00 176.54 174.82 1i89 h ILE 274 N 0.57 1.23 -0.30 2.60 2.04 -0.58 -0.69 117.51 122.38 1i89 h ILE 274 Ca 0.07 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 1i89 h ILE 274 Cb 0.77 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1i89 h ILE 274 CO 0.06 0.29 0.06 0.58 0.00 0.00 0.00 178.15 179.14 1i89 h VAL 275 N 0.57 1.23 -0.43 1.67 2.07 -0.93 -2.17 116.25 118.25 1i89 h VAL 275 Ca 0.14 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 1i89 h VAL 275 Cb 0.33 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1i89 h VAL 275 CO 0.00 0.25 0.08 0.77 0.02 0.00 0.00 177.57 178.69 1i89 h SER 276 N 0.31 0.61 0.72 0.57 4.64 -1.16 0.12 113.55 119.37 1i89 h SER 276 Ca 0.09 -0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.25 1i89 h SER 276 Cb 0.32 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1i89 h SER 276 CO 0.00 0.63 -0.25 0.11 -0.87 0.00 0.00 176.83 176.46 1i89 h LYS 277 N 0.64 0.00 -0.01 4.77 1.57 -0.90 -3.26 116.57 119.38 1i89 h LYS 277 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1i89 h LYS 277 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1i89 h LYS 277 CO 0.00 0.25 -0.21 0.09 -0.57 0.00 0.00 179.45 179.01 1i89 n ASN 278 N -3.54 1.46 0.20 0.86 3.02 -0.71 -4.63 115.26 111.91 1i89 n ASN 278 Ca -0.01 -1.23 0.04 0.00 -0.03 0.00 0.00 54.58 53.35 1i89 n ASN 278 Cb 0.40 0.40 0.40 0.00 -0.61 0.00 0.00 39.78 40.37 1i89 n ASN 278 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1i89 h ILE 279 N 1.51 1.16 -0.39 2.41 6.09 -0.83 -2.89 117.51 124.57 1i89 h ILE 279 Ca 0.00 -1.20 -0.07 0.00 -1.37 0.00 0.00 64.86 62.22 1i89 h ILE 279 Cb 0.43 1.66 -0.01 0.00 0.47 0.00 0.00 36.82 39.36 1i89 h ILE 279 CO 0.00 0.33 -0.03 0.74 -3.07 0.00 0.00 178.15 176.12 1i89 h THR 280 N 0.00 1.27 -0.96 2.19 2.02 -1.82 -0.40 112.91 115.20 1i89 h THR 280 Ca -0.00 -1.07 0.02 0.00 0.77 0.00 0.00 66.41 66.13 1i89 h THR 280 Cb 0.63 1.19 -0.05 0.00 -1.74 0.00 0.00 68.15 68.18 1i89 h THR 280 CO 0.04 0.36 0.63 0.50 0.37 0.00 0.00 175.52 177.42 1i89 h LYS 281 N 0.52 1.22 -0.47 6.66 3.64 -1.85 0.22 116.57 126.50 1i89 h LYS 281 Ca 0.10 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1i89 h LYS 281 Cb 0.52 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1i89 h LYS 281 CO 0.03 0.81 0.18 0.00 -2.27 0.00 0.00 179.45 178.19 1i89 h ALA 282 N 1.38 0.61 -0.71 5.00 0.00 -1.23 -1.33 119.26 122.98 1i89 h ALA 282 Ca 0.37 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1i89 h ALA 282 Cb -0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1i89 h ALA 282 CO -0.10 0.23 0.16 -0.07 0.00 0.00 0.00 179.25 179.47 1i89 h LEU 283 N 0.62 1.08 -0.54 0.00 3.38 -0.21 -2.20 115.31 117.43 1i89 h LEU 283 Ca 0.16 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 57.73 1i89 h LEU 283 Cb 0.21 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1i89 h LEU 283 CO -0.01 1.03 -0.57 -0.37 0.09 0.00 0.00 178.44 178.62 1i89 h VAL 284 N 1.07 1.33 -0.77 1.22 -1.51 -0.23 0.30 116.25 117.67 1i89 h VAL 284 Ca 0.22 -1.84 -0.02 0.00 -1.23 0.00 0.00 66.70 63.84 1i89 h VAL 284 Cb 0.38 1.82 -0.04 0.00 -2.13 0.00 0.00 31.29 31.33 1i89 h VAL 284 CO 0.00 0.56 0.42 -0.08 -1.23 0.00 0.00 177.57 177.25 1i89 h GLU 285 N 0.38 1.07 -0.09 5.19 4.81 -1.15 -0.74 114.58 124.04 1i89 h GLU 285 Ca 0.00 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 1i89 h GLU 285 Cb 1.10 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.27 1i89 h GLU 285 CO 0.10 0.80 -0.24 0.00 -0.73 0.00 0.00 179.01 178.93 1i89 h ALA 286 N 1.22 0.15 0.00 2.92 0.00 -1.11 -3.40 119.26 119.04 1i89 h ALA 286 Ca 0.27 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1i89 h ALA 286 Cb 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1i89 h ALA 286 CO -0.04 0.14 -1.83 1.19 0.00 0.00 0.00 179.25 178.70 1i89 n PHE 287 N -4.49 0.00 -0.25 0.00 3.72 0.10 -4.46 117.46 112.09 1i89 n PHE 287 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1i89 n PHE 287 Cb 0.45 -0.43 0.13 0.00 -0.94 0.00 0.00 39.48 38.69 1i89 n PHE 287 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1i89 h GLU 288 N 0.00 0.66 0.00 -1.08 4.57 -1.29 0.59 114.58 118.04 1i89 h GLU 288 Ca -0.01 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1i89 h GLU 288 Cb 0.86 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 1i89 h GLU 288 CO 0.00 0.44 0.00 -1.35 -1.18 0.00 0.00 179.01 176.92 1i89 h PRO 289 N 0.68 0.00 -0.02 0.92 0.11 -1.78 -1.28 132.00 130.63 1i89 h PRO 289 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1i89 h PRO 289 Cb 0.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.39 1i89 h PRO 289 CO -0.22 0.00 -0.17 1.28 -0.21 0.00 0.00 178.00 178.68 1i89 n LEU 290 N -2.95 1.90 -0.31 2.35 4.77 0.12 -4.95 117.00 117.93 1i89 n LEU 290 Ca -0.02 -0.63 -0.04 0.00 -0.03 0.00 0.00 56.01 55.29 1i89 n LEU 290 Cb 0.14 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1i89 n LEU 290 CO 0.21 0.33 -0.04 0.61 -1.33 0.00 0.00 177.39 177.17 1i89 n GLY 291 N 1.31 0.69 3.50 -0.72 0.00 -0.48 -5.02 105.19 104.47 1i89 n GLY 291 Ca 0.14 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 1i89 n GLY 291 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1i89 s ILE 292 N -2.11 3.68 0.00 -0.61 1.10 -0.73 -4.95 121.20 117.57 1i89 s ILE 292 Ca 0.00 -0.45 0.00 0.00 -0.51 0.00 0.00 60.65 59.69 1i89 s ILE 292 Cb 0.00 -2.57 0.00 0.00 0.15 0.00 0.00 42.46 40.04 1i89 s ILE 292 CO 0.00 0.53 0.06 -1.54 -2.11 0.00 0.00 174.94 171.88 1i89 n SER 293 N 3.14 0.11 -4.49 4.50 3.41 -1.26 -4.14 113.62 114.90 1i89 n SER 293 Ca -0.18 -0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 57.57 1i89 n SER 293 Cb 0.53 0.49 -0.04 0.00 -0.26 0.00 0.00 64.21 64.93 1i89 n SER 293 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i89 s ASP 294 N -0.49 6.26 0.00 4.04 2.15 -1.26 -4.92 116.67 122.45 1i89 s ASP 294 Ca 0.00 -0.65 0.24 0.00 0.43 0.00 0.00 52.55 52.57 1i89 s ASP 294 Cb 0.00 -2.41 1.40 0.00 -0.30 0.00 0.00 42.92 41.61 1i89 s ASP 294 CO 0.00 -1.26 1.81 -1.22 -0.17 0.00 0.00 175.17 174.33 1i89 n TYR 295 N 7.39 0.00 0.80 -5.34 4.01 -1.26 -1.92 117.16 120.84 1i89 n TYR 295 Ca -0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1i89 n TYR 295 Cb 0.46 -0.06 0.28 0.00 -0.31 0.00 0.00 39.34 39.71 1i89 n TYR 295 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1i89 n ASN 296 N -1.06 0.53 -0.54 7.72 3.02 -1.26 -3.86 115.26 119.81 1i89 n ASN 296 Ca 0.17 0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.90 1i89 n ASN 296 Cb 0.11 0.02 0.40 0.00 -0.61 0.00 0.00 39.78 39.70 1i89 n ASN 296 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1i89 n SER 297 N -1.81 1.63 -4.47 6.41 3.41 -0.81 -4.88 113.62 113.11 1i89 n SER 297 Ca 0.05 -1.67 -0.26 0.00 -0.26 0.00 0.00 58.87 56.73 1i89 n SER 297 Cb 0.39 -0.09 -0.11 0.00 -0.26 0.00 0.00 64.21 64.14 1i89 n SER 297 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1i89 s ILE 298 N -1.83 2.55 0.33 -1.33 -4.36 -1.25 -4.71 121.20 110.60 1i89 s ILE 298 Ca 0.33 -2.13 -0.13 0.00 -0.26 0.00 0.00 60.65 58.46 1i89 s ILE 298 Cb 0.18 -2.28 -0.08 0.00 1.25 0.00 0.00 42.46 41.53 1i89 s ILE 298 CO 0.28 -0.24 0.71 0.72 0.24 0.00 0.00 174.94 176.65 1i89 s PHE 299 N -2.03 3.40 -0.03 1.37 -0.71 0.19 -4.93 117.98 115.25 1i89 s PHE 299 Ca 0.25 1.11 0.07 0.00 -1.04 0.00 0.00 56.93 57.33 1i89 s PHE 299 Cb -0.07 -2.46 -0.02 0.00 -1.21 0.00 0.00 43.02 39.26 1i89 s PHE 299 CO 0.13 0.07 -0.25 -1.58 -1.34 0.00 0.00 175.22 172.25 1i89 s TRP 300 N -2.06 2.38 -0.15 3.49 0.52 -1.26 -0.66 118.94 121.20 1i89 s TRP 300 Ca 0.52 -0.48 -0.01 0.00 0.02 0.00 0.00 56.10 56.16 1i89 s TRP 300 Cb -0.10 -1.53 0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1i89 s TRP 300 CO 0.21 -0.06 -0.04 0.42 0.02 0.00 0.00 176.95 177.51 1i89 s ILE 301 N -0.52 0.95 -0.06 2.03 1.09 -0.15 -4.72 121.20 119.82 1i89 s ILE 301 Ca 0.07 -0.50 0.03 0.00 -1.10 0.00 0.00 60.65 59.15 1i89 s ILE 301 Cb -0.11 -1.14 0.00 0.00 -1.06 0.00 0.00 42.46 40.15 1i89 s ILE 301 CO 0.00 0.13 -0.15 0.00 -0.10 0.00 0.00 174.94 174.82 1i89 s ALA 302 N 1.71 1.42 -0.08 9.38 0.00 -1.26 -1.18 121.76 131.75 1i89 s ALA 302 Ca 0.01 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 1i89 s ALA 302 Cb -0.15 -0.55 -0.07 0.00 0.00 0.00 0.00 23.12 22.36 1i89 s ALA 302 CO -0.07 0.20 1.95 -1.58 0.00 0.00 0.00 175.76 176.25 1i89 s HIS 303 N 0.35 1.44 -1.47 0.00 2.46 -0.32 -4.84 115.29 112.92 1i89 s HIS 303 Ca -0.10 0.02 -0.13 0.00 0.47 0.00 0.00 55.06 55.32 1i89 s HIS 303 Cb -0.14 -4.09 0.03 0.00 -0.13 0.00 0.00 32.58 28.26 1i89 s HIS 303 CO 0.03 -4.60 2.30 -0.35 -2.47 0.00 0.00 174.74 169.65 1i89 n PRO 304 N 7.85 3.02 -0.28 2.88 -0.04 -1.26 -4.73 135.00 142.44 1i89 n PRO 304 Ca 0.22 -2.62 0.08 0.00 -0.04 0.00 0.00 63.50 61.14 1i89 n PRO 304 Cb 0.43 -3.20 0.22 0.00 -0.04 0.00 0.00 33.50 30.91 1i89 n PRO 304 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1i89 h GLY 305 N 9.46 1.27 -2.68 0.55 0.00 -1.92 -3.43 103.07 106.32 1i89 h GLY 305 Ca 0.60 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.74 1i89 h GLY 305 CO 1.86 -0.14 -0.01 -0.32 0.00 0.00 0.00 176.54 177.92 1i89 s GLY 306 N -3.56 -0.05 0.41 4.60 0.00 -1.26 -4.89 107.32 102.57 1i89 s GLY 306 Ca -0.12 -0.27 0.15 0.00 0.00 0.00 0.00 44.72 44.48 1i89 s GLY 306 CO 0.77 -0.32 1.91 -0.56 0.00 0.00 0.00 173.10 174.89 1i89 h PRO 307 N 2.25 0.00 -0.18 2.90 0.13 -1.83 -2.87 132.00 132.40 1i89 h PRO 307 Ca -0.30 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.76 1i89 h PRO 307 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1i89 h PRO 307 CO 0.39 0.28 -0.24 0.00 -0.23 0.00 0.00 178.00 178.20 1i89 h ALA 308 N 1.72 1.27 -0.26 -0.56 0.00 -1.94 -0.44 119.26 119.05 1i89 h ALA 308 Ca -0.00 -0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.65 1i89 h ALA 308 Cb 0.52 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1i89 h ALA 308 CO 0.04 0.49 -0.04 0.82 0.00 0.00 0.00 179.25 180.55 1i89 h ILE 309 N 0.29 0.76 -0.40 0.00 2.04 -1.83 -0.73 117.51 117.63 1i89 h ILE 309 Ca 0.05 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 1i89 h ILE 309 Cb 0.59 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1i89 h ILE 309 CO 0.04 0.00 0.22 -0.07 0.00 0.00 0.00 178.15 178.34 1i89 h LEU 310 N 0.02 0.51 -0.42 1.44 3.38 -1.47 -0.50 115.31 118.26 1i89 h LEU 310 Ca 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1i89 h LEU 310 Cb 0.18 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1i89 h LEU 310 CO -0.25 0.46 0.22 0.44 0.09 0.00 0.00 178.44 179.40 1i89 h ASP 311 N 0.52 0.54 0.68 -0.43 3.32 -1.00 -0.90 116.42 119.15 1i89 h ASP 311 Ca 0.14 -0.10 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 1i89 h ASP 311 Cb 0.07 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1i89 h ASP 311 CO -0.02 0.49 -0.56 1.56 -1.72 0.00 0.00 179.24 178.99 1i89 h GLN 312 N 0.55 0.00 -0.15 3.56 4.20 -0.98 -1.33 115.11 120.96 1i89 h GLN 312 Ca 0.15 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.77 1i89 h GLN 312 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1i89 h GLN 312 CO -0.02 0.56 -0.26 0.28 -0.67 0.00 0.00 178.83 178.71 1i89 h VAL 313 N 0.00 1.36 -0.42 -0.54 2.07 -0.86 -1.94 116.25 115.92 1i89 h VAL 313 Ca -0.01 -1.51 0.06 0.00 0.82 0.00 0.00 66.70 66.06 1i89 h VAL 313 Cb 1.05 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.75 1i89 h VAL 313 CO 0.07 0.45 0.14 -0.08 0.02 0.00 0.00 177.57 178.17 1i89 h GLU 314 N 0.05 0.29 -0.54 1.57 4.81 -1.02 -1.61 114.58 118.13 1i89 h GLU 314 Ca 0.01 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1i89 h GLU 314 Cb 0.85 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1i89 h GLU 314 CO 0.06 0.19 0.06 1.96 -0.73 0.00 0.00 179.01 180.55 1i89 h GLN 315 N 0.30 0.90 -0.49 1.92 4.20 -1.23 0.14 115.11 120.85 1i89 h GLN 315 Ca 0.20 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1i89 h GLN 315 Cb 0.20 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1i89 h GLN 315 CO -0.21 0.89 0.27 -0.22 -0.67 0.00 0.00 178.83 178.89 1i89 h LYS 316 N 0.79 0.69 -0.00 1.46 1.63 -0.98 -3.01 116.57 117.14 1i89 h LYS 316 Ca 0.16 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1i89 h LYS 316 Cb 0.44 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 1i89 h LYS 316 CO 0.01 0.54 -0.47 1.28 -3.45 0.00 0.00 179.45 177.37 1i89 n LEU 317 N -4.66 0.52 -3.49 5.20 4.77 -0.64 -4.95 117.00 113.75 1i89 n LEU 317 Ca 0.02 -0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.81 1i89 n LEU 317 Cb 0.08 -0.25 0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1i89 n LEU 317 CO 0.36 0.13 0.13 0.00 -1.33 0.00 0.00 177.39 176.68 1i89 n ALA 318 N -1.44 -1.84 -1.77 -1.18 0.00 0.28 -4.97 120.51 109.59 1i89 n ALA 318 Ca 0.06 0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.16 1i89 n ALA 318 Cb 0.34 -3.17 -0.03 0.00 0.00 0.00 0.00 19.45 16.59 1i89 n ALA 318 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1i89 s LEU 319 N -6.62 4.33 0.64 0.00 1.43 0.07 -4.93 118.68 113.60 1i89 s LEU 319 Ca 0.15 2.33 -0.18 0.00 -1.03 0.00 0.00 54.13 55.41 1i89 s LEU 319 Cb -0.07 -3.87 -0.01 0.00 0.03 0.00 0.00 46.19 42.27 1i89 s LEU 319 CO 0.74 -0.47 1.23 -0.54 0.23 0.00 0.00 176.35 177.53 1i89 s LYS 320 N -2.00 2.64 0.56 1.70 1.02 -1.26 -4.86 119.74 117.55 1i89 s LYS 320 Ca 0.52 1.88 0.27 0.00 0.02 0.00 0.00 55.97 58.66 1i89 s LYS 320 Cb -0.31 -1.88 1.48 0.00 -0.52 0.00 0.00 37.83 36.60 1i89 s LYS 320 CO 0.40 -1.47 2.01 -1.35 -0.92 0.00 0.00 175.35 174.01 1i89 h PRO 321 N 0.49 0.00 0.00 -1.68 0.11 -1.98 -1.52 132.00 127.42 1i89 h PRO 321 Ca -0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1i89 h PRO 321 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1i89 h PRO 321 CO 0.53 0.00 -0.06 0.93 -0.21 0.00 0.00 178.00 179.19 1i89 h GLU 322 N 0.00 0.00 -0.93 1.05 3.07 -2.02 -3.31 114.58 112.43 1i89 h GLU 322 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1i89 h GLU 322 Cb 0.88 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.75 1i89 h GLU 322 CO -0.00 0.06 0.60 0.87 -1.40 0.00 0.00 179.01 179.13 1i89 h LYS 323 N 0.00 1.24 -0.35 2.33 1.79 -1.64 -1.50 116.57 118.44 1i89 h LYS 323 Ca -0.00 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1i89 h LYS 323 Cb 0.72 -0.27 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1i89 h LYS 323 CO 0.01 0.84 0.00 -1.33 -1.08 0.00 0.00 179.45 177.89 1i89 n MET 324 N -4.41 1.80 -0.06 3.15 2.81 -1.25 -4.42 117.12 114.75 1i89 n MET 324 Ca 0.10 -1.20 -0.08 0.00 -1.81 0.00 0.00 57.70 54.72 1i89 n MET 324 Cb 0.03 -1.28 -0.02 0.00 -0.71 0.00 0.00 33.22 31.24 1i89 n MET 324 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1i89 h ASN 325 N 1.93 -0.27 -0.63 7.83 4.21 -1.42 0.32 115.58 127.55 1i89 h ASN 325 Ca 0.00 0.08 -0.06 0.00 1.21 0.00 0.00 56.30 57.53 1i89 h ASN 325 Cb 0.47 0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.81 1i89 h ASN 325 CO 0.01 -0.10 0.15 0.00 -1.29 0.00 0.00 177.43 176.20 1i89 h ALA 326 N 1.21 0.82 -0.09 -0.83 0.00 -1.82 -1.46 119.26 117.09 1i89 h ALA 326 Ca 0.12 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1i89 h ALA 326 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1i89 h ALA 326 CO -0.26 0.54 -0.02 1.15 0.00 0.00 0.00 179.25 180.65 1i89 h THR 327 N 0.92 0.91 0.00 0.00 2.02 -1.77 -2.33 112.91 112.66 1i89 h THR 327 Ca 0.20 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.30 1i89 h THR 327 Cb 0.36 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1i89 h THR 327 CO 0.00 0.00 -0.37 0.03 0.37 0.00 0.00 175.52 175.55 1i89 h ARG 328 N -0.00 0.00 -0.43 6.66 3.08 -0.77 -1.54 114.38 121.37 1i89 h ARG 328 Ca 0.04 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 1i89 h ARG 328 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1i89 h ARG 328 CO -0.09 0.37 -0.16 1.49 -1.07 0.00 0.00 179.97 180.51 1i89 h GLU 329 N 0.00 0.87 -0.34 0.04 4.57 -1.16 0.14 114.58 118.70 1i89 h GLU 329 Ca -0.00 -0.36 -0.10 0.00 -1.18 0.00 0.00 59.36 57.72 1i89 h GLU 329 Cb 0.68 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1i89 h GLU 329 CO 0.05 1.00 -0.16 0.28 -1.18 0.00 0.00 179.01 179.00 1i89 h VAL 330 N 0.70 1.29 -0.89 0.32 2.07 -1.11 -1.65 116.25 116.99 1i89 h VAL 330 Ca 0.10 -1.28 0.02 0.00 0.82 0.00 0.00 66.70 66.37 1i89 h VAL 330 Cb 0.71 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1i89 h VAL 330 CO 0.05 0.42 0.58 0.25 0.02 0.00 0.00 177.57 178.90 1i89 h LEU 331 N 0.50 0.98 -0.14 2.57 5.85 -1.13 -0.98 115.31 122.97 1i89 h LEU 331 Ca 0.08 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1i89 h LEU 331 Cb 0.70 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1i89 h LEU 331 CO 0.05 0.69 0.01 -1.28 -0.34 0.00 0.00 178.44 177.57 1i89 h SER 332 N 1.15 0.23 1.88 1.25 0.87 -0.41 -1.06 113.55 117.46 1i89 h SER 332 Ca 0.34 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1i89 h SER 332 Cb -0.06 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1i89 h SER 332 CO -0.09 0.46 0.00 -0.33 -0.53 0.00 0.00 176.83 176.34 1i89 h GLU 333 N -0.01 0.00 0.00 2.24 4.39 -1.19 0.39 114.58 120.40 1i89 h GLU 333 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1i89 h GLU 333 Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1i89 h GLU 333 CO 0.01 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.52 1i89 n TYR 334 N -3.00 0.00 -4.28 4.33 4.01 -0.38 -4.50 117.16 113.33 1i89 n TYR 334 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1i89 n TYR 334 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.53 1i89 n TYR 334 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i89 n GLY 335 N 0.00 -1.57 3.52 2.72 0.00 -0.41 -4.42 105.19 105.03 1i89 n GLY 335 Ca 0.00 -1.28 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 1i89 n GLY 335 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i89 s ASN 336 N -4.00 6.35 -0.36 1.61 3.84 -0.26 -4.52 114.94 117.60 1i89 s ASN 336 Ca 0.00 -0.35 0.03 0.00 0.21 0.00 0.00 52.86 52.75 1i89 s ASN 336 Cb 0.00 -2.38 0.53 0.00 -0.55 0.00 0.00 41.25 38.85 1i89 s ASN 336 CO 0.00 -1.01 1.74 0.23 -2.79 0.00 0.00 177.10 175.27 1i89 n MET 337 N 6.85 2.00 0.00 0.43 2.81 -1.26 -1.57 117.12 126.39 1i89 n MET 337 Ca 0.00 -2.40 0.00 0.00 -1.81 0.00 0.00 57.70 53.49 1i89 n MET 337 Cb 0.47 -1.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 1i89 n MET 337 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1i89 n SER 338 N -0.80 0.00 0.09 7.83 2.88 -1.26 -2.19 113.62 120.16 1i89 n SER 338 Ca 0.48 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 58.14 1i89 n SER 338 Cb 1.42 0.00 0.62 0.00 -0.75 0.00 0.00 64.21 65.50 1i89 n SER 338 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1i89 h SER 339 N 2.42 0.10 0.82 -3.46 4.64 -1.94 -2.03 113.55 114.09 1i89 h SER 339 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1i89 h SER 339 Cb 0.00 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1i89 h SER 339 CO 0.00 0.06 -0.20 0.00 -0.87 0.00 0.00 176.83 175.82 1i89 h ALA 340 N 1.84 1.06 -0.37 5.18 0.00 -1.72 -3.18 119.26 122.07 1i89 h ALA 340 Ca 0.15 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1i89 h ALA 340 Cb 0.45 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1i89 h ALA 340 CO -0.02 0.25 0.10 0.00 0.00 0.00 0.00 179.25 179.58 1i89 h VAL 342 N 0.24 1.03 -0.04 0.00 3.04 -1.79 -0.33 116.25 118.41 1i89 h VAL 342 Ca 0.18 -0.56 -0.20 0.00 -1.01 0.00 0.00 66.70 65.10 1i89 h VAL 342 Cb 0.18 1.31 0.01 0.00 -2.01 0.00 0.00 31.29 30.78 1i89 h VAL 342 CO -0.21 0.16 -0.75 -0.07 -1.01 0.00 0.00 177.57 175.69 1i89 h LEU 343 N 0.00 0.73 -0.82 3.16 3.38 -1.43 -2.14 115.31 118.18 1i89 h LEU 343 Ca -0.00 -0.71 0.05 0.00 0.09 0.00 0.00 57.88 57.30 1i89 h LEU 343 Cb 0.30 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1i89 h LEU 343 CO 0.02 1.34 0.51 -0.26 0.09 0.00 0.00 178.44 180.15 1i89 h PHE 344 N 0.19 0.96 -0.84 1.13 -1.00 -0.96 -1.79 116.94 114.62 1i89 h PHE 344 Ca -0.08 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.72 1i89 h PHE 344 Cb 1.42 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 40.63 1i89 h PHE 344 CO 0.12 0.51 0.49 0.82 -1.61 0.00 0.00 178.31 178.64 1i89 h ILE 345 N 0.97 1.24 -0.78 -0.55 2.04 -0.91 -0.98 117.51 118.53 1i89 h ILE 345 Ca 0.35 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1i89 h ILE 345 Cb 0.10 0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.22 1i89 h ILE 345 CO -0.15 0.26 0.49 -0.07 0.00 0.00 0.00 178.15 178.67 1i89 h LEU 346 N 1.16 0.92 -0.27 1.44 3.38 -1.05 0.49 115.31 121.38 1i89 h LEU 346 Ca 0.30 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 1i89 h LEU 346 Cb -0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1i89 h LEU 346 CO -0.05 0.70 0.04 -0.78 0.09 0.00 0.00 178.44 178.43 1i89 h ASP 347 N 1.07 0.44 0.09 -0.43 3.58 -0.88 -2.34 116.42 117.95 1i89 h ASP 347 Ca 0.28 -0.27 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1i89 h ASP 347 Cb -0.07 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 1i89 h ASP 347 CO -0.06 0.60 -0.15 -0.08 -2.88 0.00 0.00 179.24 176.68 1i89 h GLU 348 N 0.27 -0.28 -0.28 0.28 4.57 -0.90 0.06 114.58 118.30 1i89 h GLU 348 Ca 0.08 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.31 1i89 h GLU 348 Cb 0.35 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.97 1i89 h GLU 348 CO 0.01 -0.19 0.08 1.98 -1.18 0.00 0.00 179.01 179.71 1i89 h MET 349 N -0.29 0.19 -0.19 1.92 4.05 -0.85 -0.33 114.93 119.43 1i89 h MET 349 Ca 0.02 -0.01 -0.14 0.00 -0.28 0.00 0.00 59.70 59.30 1i89 h MET 349 Cb 0.31 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 1i89 h MET 349 CO -0.08 0.13 -0.45 0.07 0.23 0.00 0.00 176.91 176.80 1i89 h ARG 350 N 0.20 0.48 -0.17 0.39 -0.00 -1.27 -1.87 114.38 112.14 1i89 h ARG 350 Ca 0.12 -0.26 -0.01 0.00 -0.00 0.00 0.00 59.98 59.83 1i89 h ARG 350 Cb 0.11 0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 30.08 1i89 h ARG 350 CO -0.14 0.84 0.05 0.87 -0.00 0.00 0.00 179.97 181.59 1i89 h LYS 351 N 0.39 0.26 -0.72 0.08 1.57 -0.73 -1.75 116.57 115.66 1i89 h LYS 351 Ca 0.03 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 1i89 h LYS 351 Cb 0.95 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1i89 h LYS 351 CO 0.08 0.38 0.20 0.87 -0.57 0.00 0.00 179.45 180.41 1i89 h LYS 352 N 0.09 1.13 -0.61 3.15 1.79 -1.06 0.16 116.57 121.21 1i89 h LYS 352 Ca 0.05 -0.26 -0.04 0.00 -2.18 0.00 0.00 60.65 58.22 1i89 h LYS 352 Cb 0.23 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.70 1i89 h LYS 352 CO -0.00 0.98 0.22 0.77 -1.08 0.00 0.00 179.45 180.34 1i89 h SER 353 N 1.08 0.87 -0.05 0.86 0.02 -1.32 0.07 113.55 115.07 1i89 h SER 353 Ca 0.23 -0.19 -0.08 0.00 -0.84 0.00 0.00 61.79 60.91 1i89 h SER 353 Cb 0.34 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1i89 h SER 353 CO -0.00 0.82 -0.29 0.71 -1.14 0.00 0.00 176.83 176.94 1i89 h THR 354 N 0.87 1.44 -0.93 -2.27 1.35 -1.10 0.08 112.91 112.36 1i89 h THR 354 Ca 0.20 -1.73 0.01 0.00 -0.55 0.00 0.00 66.41 64.34 1i89 h THR 354 Cb 0.25 2.39 -0.05 0.00 -1.73 0.00 0.00 68.15 69.01 1i89 h THR 354 CO -0.01 0.49 0.61 -0.61 -0.25 0.00 0.00 175.52 175.75 1i89 h GLN 355 N -0.24 1.22 -0.20 4.72 4.15 -0.60 -2.20 115.11 121.97 1i89 h GLN 355 Ca -0.02 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.32 1i89 h GLN 355 Cb 0.95 -0.27 0.00 0.00 0.21 0.00 0.00 27.48 28.36 1i89 h GLN 355 CO 0.06 0.81 0.00 0.09 -1.93 0.00 0.00 178.83 177.86 1i89 n ASN 356 N -4.44 1.08 -2.42 -0.69 5.03 0.00 -4.92 115.26 108.91 1i89 n ASN 356 Ca 0.10 -1.98 -0.18 0.00 0.87 0.00 0.00 54.58 53.39 1i89 n ASN 356 Cb 0.01 -0.13 0.02 0.00 -1.02 0.00 0.00 39.78 38.67 1i89 n ASN 356 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1i89 n GLY 357 N 0.83 -0.32 3.87 7.41 0.00 -0.83 -5.01 105.19 111.15 1i89 n GLY 357 Ca 0.07 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1i89 n GLY 357 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i89 s LEU 358 N -5.48 2.62 0.29 0.99 1.43 0.00 -4.99 118.68 113.55 1i89 s LEU 358 Ca 0.20 1.00 0.16 0.00 -1.03 0.00 0.00 54.13 54.46 1i89 s LEU 358 Cb -0.09 -3.61 0.11 0.00 0.03 0.00 0.00 46.19 42.64 1i89 s LEU 358 CO 0.25 -1.75 1.47 0.11 0.23 0.00 0.00 176.35 176.66 1i89 h LYS 359 N -0.94 0.00 -4.88 1.70 1.57 -1.87 -3.43 116.57 108.72 1i89 h LYS 359 Ca -0.46 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 57.97 1i89 h LYS 359 Cb 1.29 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.46 1i89 h LYS 359 CO 0.64 0.46 -0.61 0.95 -0.57 0.00 0.00 179.45 180.32 1i89 s THR 360 N -3.00 0.55 -0.97 -0.16 -4.23 -1.26 -0.79 115.64 105.79 1i89 s THR 360 Ca 0.04 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.78 1i89 s THR 360 Cb 0.07 -2.63 0.19 0.00 1.34 0.00 0.00 72.50 71.47 1i89 s THR 360 CO 0.74 -0.00 1.72 0.35 -0.54 0.00 0.00 174.62 176.89 1i89 n THR 361 N -0.46 0.47 -2.79 3.99 -2.24 -0.55 -2.82 114.28 109.89 1i89 n THR 361 Ca 0.00 0.10 -0.36 0.00 -2.27 0.00 0.00 64.05 61.51 1i89 n THR 361 Cb 0.66 -0.74 -0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1i89 n THR 361 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i89 n GLY 362 N 0.81 5.85 3.26 3.38 0.00 -1.26 -3.79 105.19 113.45 1i89 n GLY 362 Ca 0.05 -2.66 -0.23 0.00 0.00 0.00 0.00 46.02 43.18 1i89 n GLY 362 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i89 n GLU 363 N 0.04 -3.98 -0.99 1.61 1.02 -1.23 -1.09 120.64 116.03 1i89 n GLU 363 Ca 0.40 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 58.16 1i89 n GLU 363 Cb 0.31 -5.39 0.00 0.00 -0.02 0.00 0.00 31.44 26.34 1i89 n GLU 363 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i89 n GLY 364 N -1.31 0.93 3.84 0.62 0.00 -1.13 -4.89 105.19 103.26 1i89 n GLY 364 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1i89 n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i89 s LEU 365 N 0.00 3.90 -0.09 0.99 1.43 -0.25 -4.58 118.68 120.09 1i89 s LEU 365 Ca 0.00 -0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 52.82 1i89 s LEU 365 Cb 0.00 -2.45 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 1i89 s LEU 365 CO 0.00 -0.01 0.41 -0.08 0.23 0.00 0.00 176.35 176.91 1i89 h GLU 366 N 1.75 -0.11 -6.24 1.70 4.81 -1.84 -3.39 114.58 111.25 1i89 h GLU 366 Ca -0.49 0.01 -0.65 0.00 -0.13 0.00 0.00 59.36 58.10 1i89 h GLU 366 Cb 1.22 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 30.52 1i89 h GLU 366 CO 0.62 0.20 -0.63 -1.58 -0.73 0.00 0.00 179.01 176.88 1i89 s TRP 367 N -2.30 3.10 0.34 0.92 0.52 -1.26 -0.18 118.94 120.09 1i89 s TRP 367 Ca -0.07 0.04 -0.05 0.00 0.02 0.00 0.00 56.10 56.04 1i89 s TRP 367 Cb -0.00 -1.60 0.01 0.00 -1.15 0.00 0.00 33.47 30.73 1i89 s TRP 367 CO 0.27 0.50 0.52 0.20 0.02 0.00 0.00 176.95 178.45 1i89 s GLY 368 N -2.22 1.24 0.02 0.98 0.00 0.53 -0.64 107.32 107.23 1i89 s GLY 368 Ca 0.26 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.64 1i89 s GLY 368 CO 0.19 -0.87 -0.03 0.54 0.00 0.00 0.00 173.10 172.93 1i89 s VAL 369 N -3.04 0.14 -0.09 1.40 0.11 0.16 -0.91 120.40 118.17 1i89 s VAL 369 Ca 0.28 -0.64 0.02 0.00 -2.93 0.00 0.00 61.98 58.70 1i89 s VAL 369 Cb -0.01 -0.23 0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1i89 s VAL 369 CO 0.18 -0.32 -0.14 -0.22 -3.33 0.00 0.00 175.10 171.28 1i89 s LEU 370 N -1.00 1.65 -0.06 2.54 0.20 -0.39 -0.98 118.68 120.65 1i89 s LEU 370 Ca -0.10 -0.38 0.03 0.00 0.69 0.00 0.00 54.13 54.37 1i89 s LEU 370 Cb -0.07 -0.99 -0.02 0.00 -0.43 0.00 0.00 46.19 44.68 1i89 s LEU 370 CO -0.01 0.01 -0.14 -0.36 -0.29 0.00 0.00 176.35 175.57 1i89 s PHE 371 N 0.93 2.73 -0.08 5.38 0.08 -0.32 -0.96 117.98 125.74 1i89 s PHE 371 Ca -0.08 -0.22 0.02 0.00 0.12 0.00 0.00 56.93 56.77 1i89 s PHE 371 Cb -0.15 -1.66 -0.02 0.00 -0.57 0.00 0.00 43.02 40.61 1i89 s PHE 371 CO -0.00 0.14 -0.14 0.20 -0.10 0.00 0.00 175.22 175.31 1i89 s GLY 372 N -0.58 1.52 -0.04 4.36 0.00 -0.36 -1.17 107.32 111.06 1i89 s GLY 372 Ca 0.08 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.88 1i89 s GLY 372 CO 0.01 -0.57 -0.12 -1.36 0.00 0.00 0.00 173.10 171.06 1i89 s PHE 373 N -0.36 1.28 0.00 1.90 0.08 -1.26 -1.24 117.98 118.39 1i89 s PHE 373 Ca 0.03 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.72 1i89 s PHE 373 Cb -0.12 -0.90 0.00 0.00 -0.57 0.00 0.00 43.02 41.42 1i89 s PHE 373 CO 0.02 -0.15 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 1i89 n GLY 374 N 3.34 1.05 3.54 4.36 0.00 -0.69 -2.56 105.19 114.22 1i89 n GLY 374 Ca -0.19 -0.81 -0.51 0.00 0.00 0.00 0.00 46.02 44.51 1i89 n GLY 374 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1i89 n PRO 375 N 0.00 0.80 0.00 1.61 -0.02 -1.26 -1.04 135.00 135.09 1i89 n PRO 375 Ca 0.00 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1i89 n PRO 375 Cb 0.00 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1i89 n PRO 375 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i89 n GLY 376 N 1.95 2.58 3.68 -1.23 0.00 -1.26 -3.10 105.19 107.80 1i89 n GLY 376 Ca 0.17 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1i89 n GLY 376 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i89 s LEU 377 N 0.00 4.30 -0.13 0.99 0.20 -1.24 -4.50 118.68 118.31 1i89 s LEU 377 Ca 0.00 2.12 -0.07 0.00 0.69 0.00 0.00 54.13 56.87 1i89 s LEU 377 Cb 0.00 -3.55 -0.04 0.00 -0.43 0.00 0.00 46.19 42.17 1i89 s LEU 377 CO 0.00 -0.80 0.13 -0.89 -0.29 0.00 0.00 176.35 174.50 1i89 s THR 378 N 3.06 5.46 -0.17 3.68 2.01 -0.21 -0.81 115.64 128.67 1i89 s THR 378 Ca 0.66 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.86 1i89 s THR 378 Cb -0.31 -3.39 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1i89 s THR 378 CO 0.26 0.60 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.97 1i89 s ILE 379 N -0.87 2.22 -0.16 1.82 1.01 -0.35 -1.71 121.20 123.15 1i89 s ILE 379 Ca 0.14 -0.90 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1i89 s ILE 379 Cb -0.12 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 1i89 s ILE 379 CO 0.03 0.53 0.08 -1.61 0.00 0.00 0.00 174.94 173.98 1i89 s GLU 380 N 1.14 3.79 -0.11 2.79 0.41 -0.37 -0.95 118.70 125.40 1i89 s GLU 380 Ca 0.01 -0.29 0.02 0.00 -0.41 0.00 0.00 54.97 54.31 1i89 s GLU 380 Cb -0.14 -3.20 0.01 0.00 -1.78 0.00 0.00 34.13 29.02 1i89 s GLU 380 CO -0.08 0.43 -0.19 0.99 -0.49 0.00 0.00 175.26 175.92 1i89 s THR 381 N -0.06 1.76 -0.11 3.63 2.01 0.90 -1.22 115.64 122.54 1i89 s THR 381 Ca 0.08 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.28 1i89 s THR 381 Cb -0.12 -1.57 0.02 0.00 0.01 0.00 0.00 72.50 70.84 1i89 s THR 381 CO 0.01 0.49 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.59 1i89 s VAL 382 N 0.80 1.51 -0.04 3.82 1.01 -0.13 -1.02 120.40 126.35 1i89 s VAL 382 Ca -0.09 -0.65 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 1i89 s VAL 382 Cb -0.16 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 1i89 s VAL 382 CO 0.00 0.44 0.47 -0.69 0.00 0.00 0.00 175.10 175.33 1i89 s VAL 383 N 1.03 5.04 0.13 2.92 1.01 0.15 -1.26 120.40 129.43 1i89 s VAL 383 Ca -0.05 0.97 0.09 0.00 0.00 0.00 0.00 61.98 62.99 1i89 s VAL 383 Cb -0.15 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1i89 s VAL 383 CO -0.02 0.46 -0.22 -0.76 0.00 0.00 0.00 175.10 174.55 1i89 s LEU 384 N -0.31 2.34 -0.04 3.92 1.43 -0.09 -1.25 118.68 124.69 1i89 s LEU 384 Ca 0.26 -0.75 0.06 0.00 -1.03 0.00 0.00 54.13 52.67 1i89 s LEU 384 Cb -0.17 -0.99 -0.02 0.00 0.03 0.00 0.00 46.19 45.04 1i89 s LEU 384 CO 0.13 0.08 -0.21 -0.60 0.23 0.00 0.00 176.35 175.98 1i89 s ARG 385 N -2.18 2.34 1.07 1.70 3.52 0.47 -0.35 118.95 125.52 1i89 s ARG 385 Ca 0.11 -0.84 -0.18 0.00 -0.13 0.00 0.00 55.73 54.70 1i89 s ARG 385 Cb -0.09 -2.19 0.26 0.00 -1.56 0.00 0.00 34.95 31.37 1i89 s ARG 385 CO 0.06 0.55 0.98 -1.13 -0.81 0.00 0.00 175.30 174.95 1i89 n SER 386 N 2.48 -1.83 -4.21 -2.12 3.41 0.75 -0.74 113.62 111.36 1i89 n SER 386 Ca -0.17 -1.11 -0.27 0.00 -0.26 0.00 0.00 58.87 57.07 1i89 n SER 386 Cb 0.52 -0.89 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 1i89 n SER 386 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1i89 s VAL 387 N -2.80 1.59 0.10 -3.33 1.01 -1.23 -4.71 120.40 111.03 1i89 s VAL 387 Ca 0.63 -0.88 -0.31 0.00 0.00 0.00 0.00 61.98 61.42 1i89 s VAL 387 Cb -0.06 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.91 1i89 s VAL 387 CO 0.48 0.43 1.71 0.00 0.00 0.00 0.00 175.10 177.72 1i89 s ALA 388 N -0.49 3.73 0.00 5.51 0.00 -1.26 -1.48 121.76 127.77 1i89 s ALA 388 Ca 0.08 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1i89 s ALA 388 Cb -0.08 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1i89 s ALA 388 CO -0.01 -1.11 0.00 -0.89 0.00 0.00 0.00 175.76 173.75