#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i33 n PRO 2 N 0.00 0.91 -1.98 0.00 -0.02 -1.26 -4.86 135.00 127.79 1i33 n PRO 2 Ca 0.00 0.33 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 1i33 n PRO 2 Cb 0.00 -1.96 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 1i33 n PRO 2 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1i33 s ILE 3 N 2.30 2.93 -0.72 4.25 1.01 -0.46 -4.69 121.20 125.83 1i33 s ILE 3 Ca 0.95 0.56 -0.21 0.00 0.00 0.00 0.00 60.65 61.95 1i33 s ILE 3 Cb -1.11 -3.36 0.09 0.00 0.01 0.00 0.00 42.46 38.09 1i33 s ILE 3 CO 0.62 0.02 0.97 -0.54 0.00 0.00 0.00 174.94 176.01 1i33 s LYS 4 N 1.77 3.22 0.14 2.79 -0.14 -1.26 -0.08 119.74 126.18 1i33 s LYS 4 Ca 0.70 -1.15 0.07 0.00 -1.36 0.00 0.00 55.97 54.24 1i33 s LYS 4 Cb -0.41 -4.41 -0.04 0.00 -1.68 0.00 0.00 37.83 31.29 1i33 s LYS 4 CO 0.31 -1.76 -0.05 0.14 -0.76 0.00 0.00 175.35 173.22 1i33 s VAL 5 N 3.50 3.54 0.07 3.17 -7.23 -0.74 -0.40 120.40 122.30 1i33 s VAL 5 Ca 0.23 -1.36 0.06 0.00 -1.81 0.00 0.00 61.98 59.09 1i33 s VAL 5 Cb -0.15 -2.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.04 1i33 s VAL 5 CO 0.04 -0.01 -0.15 -0.83 -0.31 0.00 0.00 175.10 173.84 1i33 s GLY 6 N -2.60 0.91 -0.24 2.32 0.00 0.66 -1.62 107.32 106.75 1i33 s GLY 6 Ca 0.25 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 43.96 1i33 s GLY 6 CO 0.16 -1.00 -0.07 -0.42 0.00 0.00 0.00 173.10 171.77 1i33 s ILE 7 N -1.14 2.78 -0.46 0.90 -1.09 -0.90 -0.17 121.20 121.13 1i33 s ILE 7 Ca 0.00 -1.03 -0.17 0.00 -2.23 0.00 0.00 60.65 57.22 1i33 s ILE 7 Cb -0.09 -2.40 0.05 0.00 -1.58 0.00 0.00 42.46 38.43 1i33 s ILE 7 CO 0.02 0.22 0.47 0.21 -1.23 0.00 0.00 174.94 174.64 1i33 s ASN 8 N 1.31 6.19 0.00 3.58 2.47 0.22 0.26 114.94 128.97 1i33 s ASN 8 Ca 0.00 -0.93 0.00 0.00 0.42 0.00 0.00 52.86 52.35 1i33 s ASN 8 Cb -0.16 -2.23 0.00 0.00 -1.45 0.00 0.00 41.25 37.41 1i33 s ASN 8 CO -0.05 -0.68 0.00 0.61 -3.72 0.00 0.00 177.10 173.26 1i33 n GLY 9 N 5.16 1.02 2.76 1.21 0.00 0.14 -1.28 105.19 114.19 1i33 n GLY 9 Ca -0.09 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1i33 n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1i33 n PHE 10 N 1.64 3.28 -1.72 1.61 7.35 -1.20 -3.96 117.46 124.46 1i33 n PHE 10 Ca 0.00 -3.11 0.00 0.00 -0.76 0.00 0.00 57.45 53.58 1i33 n PHE 10 Cb 0.00 -0.90 0.00 0.00 0.35 0.00 0.00 39.48 38.93 1i33 n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1i33 n GLY 11 N -0.16 2.74 0.39 7.13 0.00 -1.26 -4.56 105.19 109.47 1i33 n GLY 11 Ca 0.41 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 1i33 n GLY 11 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1i33 h ARG 12 N 0.00 -0.36 0.36 1.61 2.47 -1.95 0.14 114.38 116.65 1i33 h ARG 12 Ca 0.00 0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1i33 h ARG 12 Cb 0.00 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 1i33 h ARG 12 CO 0.00 -0.24 -0.34 0.82 0.56 0.00 0.00 179.97 180.77 1i33 h ILE 13 N -0.37 0.30 -0.10 2.04 1.08 -1.93 -0.79 117.51 117.74 1i33 h ILE 13 Ca 0.12 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.61 1i33 h ILE 13 Cb 0.59 0.30 -0.03 0.00 -3.07 0.00 0.00 36.82 34.61 1i33 h ILE 13 CO -0.52 0.00 -0.23 1.23 -0.69 0.00 0.00 178.15 177.94 1i33 h GLY 14 N -0.72 -1.44 0.11 5.37 0.00 -1.53 -1.14 103.07 103.72 1i33 h GLY 14 Ca -0.02 0.72 0.07 0.00 0.00 0.00 0.00 47.33 48.10 1i33 h GLY 14 CO -0.05 -0.45 -0.23 3.21 0.00 0.00 0.00 176.54 179.02 1i33 h ARG 15 N -0.22 -0.20 -0.70 4.80 3.08 -0.74 -1.77 114.38 118.63 1i33 h ARG 15 Ca 0.02 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.21 1i33 h ARG 15 Cb 0.28 0.05 -0.13 0.00 0.08 0.00 0.00 29.97 30.24 1i33 h ARG 15 CO -0.21 -0.13 -0.28 0.52 -1.07 0.00 0.00 179.97 178.79 1i33 h MET 16 N -0.21 -0.07 -0.17 0.04 2.86 -0.74 0.44 114.93 117.08 1i33 h MET 16 Ca 0.15 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 1i33 h MET 16 Cb 0.44 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1i33 h MET 16 CO -0.41 -0.05 0.02 0.28 1.06 0.00 0.00 176.91 177.81 1i33 h VAL 17 N -0.08 0.91 -0.09 -2.22 2.07 -0.41 0.27 116.25 116.70 1i33 h VAL 17 Ca 0.30 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.83 1i33 h VAL 17 Cb 0.56 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1i33 h VAL 17 CO -0.76 0.01 -0.16 0.15 0.02 0.00 0.00 177.57 176.84 1i33 h PHE 18 N 0.08 -0.40 -0.68 1.57 3.57 -0.10 -1.04 116.94 119.94 1i33 h PHE 18 Ca 0.08 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.67 1i33 h PHE 18 Cb 0.08 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 1i33 h PHE 18 CO -0.14 -0.23 0.45 1.96 -2.23 0.00 0.00 178.31 178.12 1i33 h GLN 19 N -0.22 0.62 -0.81 1.11 4.20 0.20 0.23 115.11 120.44 1i33 h GLN 19 Ca 0.08 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1i33 h GLN 19 Cb 0.33 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1i33 h GLN 19 CO -0.22 0.41 0.41 0.00 -0.67 0.00 0.00 178.83 178.76 1i33 h ALA 20 N 1.64 1.04 0.85 3.87 0.00 0.77 0.25 119.26 127.68 1i33 h ALA 20 Ca 0.30 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1i33 h ALA 20 Cb 0.35 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1i33 h ALA 20 CO -0.10 0.59 -0.41 0.82 0.00 0.00 0.00 179.25 180.15 1i33 h ILE 21 N 1.14 0.00 -0.58 0.00 2.04 -0.05 -1.65 117.51 118.42 1i33 h ILE 21 Ca 0.28 -0.16 0.12 0.00 1.00 0.00 0.00 64.86 66.10 1i33 h ILE 21 Cb 0.09 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.06 1i33 h ILE 21 CO -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 178.15 177.99 1i33 h ASP 23 N 0.01 0.73 0.01 0.00 3.58 -0.45 0.32 116.42 120.62 1i33 h ASP 23 Ca 0.28 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.78 1i33 h ASP 23 Cb 0.44 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1i33 h ASP 23 CO -0.59 0.36 -0.00 0.00 -2.88 0.00 0.00 179.24 176.13 1i33 n GLN 24 N -4.60 1.01 -1.81 0.28 6.02 -0.01 -4.89 117.38 113.38 1i33 n GLN 24 Ca 0.19 -0.03 -0.12 0.00 -0.01 0.00 0.00 57.00 57.02 1i33 n GLN 24 Cb 0.46 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.20 1i33 n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1i33 n GLY 25 N 1.01 0.55 0.04 1.08 0.00 0.11 -4.89 105.19 103.09 1i33 n GLY 25 Ca 0.24 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1i33 n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i33 n LEU 26 N -1.56 0.60 -4.68 0.99 4.32 -1.14 -4.77 117.00 110.77 1i33 n LEU 26 Ca -0.13 0.03 -0.45 0.00 -0.02 0.00 0.00 56.01 55.43 1i33 n LEU 26 Cb 0.51 -0.09 -0.04 0.00 -1.62 0.00 0.00 43.42 42.18 1i33 n LEU 26 CO 0.17 0.01 1.45 0.00 -1.22 0.00 0.00 177.39 177.80 1i33 n ILE 27 N -2.07 0.43 0.00 -0.08 0.13 -1.26 -0.86 119.36 115.65 1i33 n ILE 27 Ca 0.01 -0.08 0.00 0.00 -1.10 0.00 0.00 62.75 61.59 1i33 n ILE 27 Cb 0.46 -1.94 0.00 0.00 -0.84 0.00 0.00 39.64 37.31 1i33 n ILE 27 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1i33 n GLY 28 N 4.18 2.05 0.00 4.50 0.00 0.43 -4.74 105.19 111.61 1i33 n GLY 28 Ca 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1i33 n GLY 28 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i33 n THR 29 N 0.00 0.00 0.17 2.61 -2.24 -1.09 -4.69 114.28 109.04 1i33 n THR 29 Ca 0.00 0.34 -0.09 0.00 -2.27 0.00 0.00 64.05 62.03 1i33 n THR 29 Cb 0.00 -0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 67.49 1i33 n THR 29 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1i33 h GLU 30 N 0.00 -0.49 -5.63 -0.78 4.39 -1.66 -3.39 114.58 107.01 1i33 h GLU 30 Ca 0.00 0.03 -0.65 0.00 0.34 0.00 0.00 59.36 59.08 1i33 h GLU 30 Cb 0.00 0.11 -0.16 0.00 -0.10 0.00 0.00 28.75 28.60 1i33 h GLU 30 CO 0.00 -0.27 -0.61 0.42 -1.16 0.00 0.00 179.01 177.39 1i33 s ILE 31 N -3.45 4.38 -0.40 3.13 1.01 -0.04 -1.35 121.20 124.48 1i33 s ILE 31 Ca -0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 1i33 s ILE 31 Cb 0.01 -2.90 0.11 0.00 0.01 0.00 0.00 42.46 39.69 1i33 s ILE 31 CO 0.29 0.55 0.20 -0.62 0.00 0.00 0.00 174.94 175.36 1i33 s ASP 32 N -0.30 5.26 -0.67 3.58 -1.08 0.88 -0.43 116.67 123.91 1i33 s ASP 32 Ca 0.07 -1.96 -0.27 0.00 -0.52 0.00 0.00 52.55 49.87 1i33 s ASP 32 Cb -0.12 -1.83 0.03 0.00 -1.46 0.00 0.00 42.92 39.53 1i33 s ASP 32 CO 0.02 -0.53 1.24 -0.69 0.52 0.00 0.00 175.17 175.73 1i33 s VAL 33 N 1.17 3.85 0.05 1.11 1.01 -1.26 -1.79 120.40 124.54 1i33 s VAL 33 Ca 0.07 0.59 -0.22 0.00 0.00 0.00 0.00 61.98 62.41 1i33 s VAL 33 Cb -0.23 -4.84 -0.14 0.00 0.00 0.00 0.00 36.38 31.17 1i33 s VAL 33 CO -0.04 -1.64 1.49 0.58 0.00 0.00 0.00 175.10 175.49 1i33 h VAL 34 N 6.08 1.23 -2.19 2.92 2.07 -1.63 -3.42 116.25 121.32 1i33 h VAL 34 Ca -0.27 -0.74 0.08 0.00 0.82 0.00 0.00 66.70 66.59 1i33 h VAL 34 Cb 1.05 1.55 -0.17 0.00 -1.52 0.00 0.00 31.29 32.21 1i33 h VAL 34 CO 1.24 0.21 0.45 0.00 0.02 0.00 0.00 177.57 179.49 1i33 s ALA 35 N -5.06 -1.82 0.10 1.67 0.00 -1.26 -1.93 121.76 113.47 1i33 s ALA 35 Ca -0.14 1.10 0.07 0.00 0.00 0.00 0.00 51.96 52.99 1i33 s ALA 35 Cb 0.05 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 1i33 s ALA 35 CO 0.70 -0.60 -0.11 0.14 0.00 0.00 0.00 175.76 175.88 1i33 s VAL 36 N -2.63 3.27 -0.06 0.00 -7.23 -0.20 -2.12 120.40 111.44 1i33 s VAL 36 Ca 0.02 -1.28 0.06 0.00 -1.81 0.00 0.00 61.98 58.97 1i33 s VAL 36 Cb -0.01 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 1i33 s VAL 36 CO -0.06 0.13 -0.24 -0.69 -0.31 0.00 0.00 175.10 173.94 1i33 s VAL 37 N -1.18 1.94 0.02 1.32 1.01 0.14 -1.50 120.40 122.15 1i33 s VAL 37 Ca 0.20 -1.00 -0.28 0.00 0.00 0.00 0.00 61.98 60.90 1i33 s VAL 37 Cb -0.11 -1.65 0.10 0.00 0.00 0.00 0.00 36.38 34.72 1i33 s VAL 37 CO 0.12 0.54 0.96 -0.62 0.00 0.00 0.00 175.10 176.10 1i33 s ASP 38 N -0.08 -0.28 0.31 3.32 -1.08 -1.19 0.26 116.67 117.93 1i33 s ASP 38 Ca -0.05 -0.12 0.13 0.00 -0.52 0.00 0.00 52.55 51.99 1i33 s ASP 38 Cb -0.14 0.38 0.71 0.00 -1.46 0.00 0.00 42.92 42.41 1i33 s ASP 38 CO 0.04 -0.65 1.29 0.23 0.52 0.00 0.00 175.17 176.60 1i33 n MET 39 N -0.31 0.09 -4.14 4.34 2.81 -1.26 -2.49 117.12 116.15 1i33 n MET 39 Ca -0.07 0.56 -0.14 0.00 -1.81 0.00 0.00 57.70 56.24 1i33 n MET 39 Cb 0.61 -2.07 -0.11 0.00 -0.71 0.00 0.00 33.22 30.94 1i33 n MET 39 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1i33 s SER 40 N -3.41 1.31 -0.05 7.83 0.15 -1.26 -4.83 113.70 113.45 1i33 s SER 40 Ca -0.01 -0.72 0.07 0.00 0.70 0.00 0.00 55.95 55.98 1i33 s SER 40 Cb 0.04 0.01 0.10 0.00 -1.71 0.00 0.00 66.02 64.46 1i33 s SER 40 CO 0.12 -0.23 1.02 0.35 1.20 0.00 0.00 173.24 175.70 1i33 n THR 41 N 0.89 1.21 -2.01 6.45 -2.24 -1.26 -4.91 114.28 112.40 1i33 n THR 41 Ca -0.18 -1.34 -0.26 0.00 -2.27 0.00 0.00 64.05 59.99 1i33 n THR 41 Cb 0.56 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 69.01 1i33 n THR 41 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1i33 s ASN 42 N -1.61 5.01 0.45 3.42 3.84 -1.26 -4.24 114.94 120.55 1i33 s ASN 42 Ca 0.11 -0.74 0.16 0.00 0.21 0.00 0.00 52.86 52.60 1i33 s ASN 42 Cb 0.10 -2.56 1.09 0.00 -0.55 0.00 0.00 41.25 39.33 1i33 s ASN 42 CO 0.01 -2.90 1.98 0.00 -2.79 0.00 0.00 177.10 173.40 1i33 h ALA 43 N 11.21 2.10 -0.22 1.71 0.00 -1.84 -1.04 119.26 131.18 1i33 h ALA 43 Ca 0.10 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1i33 h ALA 43 Cb 1.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1i33 h ALA 43 CO 1.19 -0.24 0.05 0.93 0.00 0.00 0.00 179.25 181.19 1i33 h GLU 44 N 0.34 0.14 -0.06 0.00 5.08 -1.86 0.14 114.58 118.36 1i33 h GLU 44 Ca 0.28 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1i33 h GLU 44 Cb 0.64 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1i33 h GLU 44 CO -0.07 0.09 -0.04 -0.92 -1.00 0.00 0.00 179.01 177.07 1i33 h TYR 45 N 0.14 -0.10 -0.64 4.33 3.20 -1.61 -0.27 116.97 122.02 1i33 h TYR 45 Ca 0.10 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.08 1i33 h TYR 45 Cb 0.09 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.33 1i33 h TYR 45 CO -0.14 -0.07 0.24 0.74 -1.64 0.00 0.00 178.16 177.29 1i33 h PHE 46 N -0.05 0.42 -0.56 -3.82 0.04 -0.95 0.95 116.94 112.96 1i33 h PHE 46 Ca 0.04 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.90 1i33 h PHE 46 Cb 0.11 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.11 1i33 h PHE 46 CO -0.15 0.09 0.28 0.00 -0.60 0.00 0.00 178.31 177.94 1i33 h ALA 47 N 1.44 0.73 0.18 2.45 0.00 -0.01 -0.57 119.26 123.48 1i33 h ALA 47 Ca 0.33 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1i33 h ALA 47 Cb 0.42 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1i33 h ALA 47 CO -0.32 -0.08 -0.22 -0.92 0.00 0.00 0.00 179.25 177.70 1i33 h TYR 48 N 0.52 -0.58 -0.14 0.00 3.20 0.75 -0.04 116.97 120.67 1i33 h TYR 48 Ca 0.26 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.17 1i33 h TYR 48 Cb 0.20 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1i33 h TYR 48 CO -0.11 -0.32 0.14 1.96 -1.64 0.00 0.00 178.16 178.19 1i33 h GLN 49 N -0.45 0.00 0.15 1.82 4.20 -0.30 -2.42 115.11 118.11 1i33 h GLN 49 Ca 0.01 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.37 1i33 h GLN 49 Cb 0.44 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1i33 h GLN 49 CO -0.08 0.00 -1.85 0.52 -0.67 0.00 0.00 178.83 176.75 1i33 h MET 50 N 0.00 0.32 0.00 1.46 2.86 -0.42 -3.35 114.93 115.79 1i33 h MET 50 Ca 0.07 -0.54 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1i33 h MET 50 Cb 0.35 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1i33 h MET 50 CO -0.00 1.24 0.00 0.87 1.06 0.00 0.00 176.91 180.08 1i33 h LYS 51 N 0.09 0.00 -3.67 1.72 1.57 -0.60 -3.40 116.57 112.28 1i33 h LYS 51 Ca -0.37 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 57.96 1i33 h LYS 51 Cb 2.07 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 33.99 1i33 h LYS 51 CO 0.14 0.00 -0.77 -1.01 -0.57 0.00 0.00 179.45 177.24 1i33 s HIS 52 N -3.51 0.68 -0.11 -1.35 3.76 -0.95 -4.44 115.29 109.38 1i33 s HIS 52 Ca 0.03 -0.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.71 1i33 s HIS 52 Cb 0.09 -0.82 0.02 0.00 1.11 0.00 0.00 32.58 32.99 1i33 s HIS 52 CO 0.47 -0.36 -0.09 0.34 -0.85 0.00 0.00 174.74 174.26 1i33 s ASP 53 N 1.97 2.12 0.36 1.40 2.15 -1.16 -4.74 116.67 118.76 1i33 s ASP 53 Ca 0.04 -0.31 0.06 0.00 0.43 0.00 0.00 52.55 52.77 1i33 s ASP 53 Cb -0.13 -0.85 0.74 0.00 -0.30 0.00 0.00 42.92 42.37 1i33 s ASP 53 CO -0.06 -0.09 1.94 0.74 -0.17 0.00 0.00 175.17 177.54 1i33 h THR 54 N 6.13 1.00 0.04 1.71 2.02 -1.97 -1.68 112.91 120.15 1i33 h THR 54 Ca -0.31 -0.26 -0.38 0.00 0.77 0.00 0.00 66.41 66.23 1i33 h THR 54 Cb 1.14 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.66 1i33 h THR 54 CO 0.43 0.14 -2.23 0.52 0.37 0.00 0.00 175.52 174.74 1i33 n VAL 55 N -4.49 1.59 0.46 3.16 0.31 -1.26 -4.62 118.33 113.48 1i33 n VAL 55 Ca 0.12 -0.52 0.11 0.00 -0.01 0.00 0.00 64.34 64.04 1i33 n VAL 55 Cb 0.26 -1.64 -0.02 0.00 -0.91 0.00 0.00 33.84 31.53 1i33 n VAL 55 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1i33 n HIS 56 N -3.59 0.29 -1.65 3.52 8.25 -1.24 -4.96 115.22 115.84 1i33 n HIS 56 Ca -0.42 0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 1i33 n HIS 56 Cb 0.96 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1i33 n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i33 n GLY 57 N 1.34 -1.68 3.79 -1.41 0.00 -0.63 -4.91 105.19 101.69 1i33 n GLY 57 Ca 0.01 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 1i33 n GLY 57 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1i33 s ARG 58 N 0.00 4.37 0.66 1.61 6.06 -1.26 -2.96 118.95 127.42 1i33 s ARG 58 Ca 0.00 0.92 -0.15 0.00 -2.50 0.00 0.00 55.73 54.01 1i33 s ARG 58 Cb 0.00 -3.26 -0.00 0.00 0.06 0.00 0.00 34.95 31.75 1i33 s ARG 58 CO 0.00 0.58 1.10 -1.25 -2.50 0.00 0.00 175.30 173.23 1i33 s PRO 59 N -1.03 2.83 -0.01 5.12 0.04 -1.26 -4.93 135.00 135.76 1i33 s PRO 59 Ca 0.32 1.35 0.05 0.00 0.04 0.00 0.00 61.00 62.76 1i33 s PRO 59 Cb -0.21 -1.96 0.16 0.00 0.04 0.00 0.00 34.50 32.53 1i33 s PRO 59 CO 0.22 -1.22 1.08 1.63 0.04 0.00 0.00 177.00 178.75 1i33 n LYS 60 N -2.46 1.47 -4.46 4.56 4.76 -1.26 -4.85 118.16 115.92 1i33 n LYS 60 Ca 0.10 -0.64 -0.22 0.00 -2.87 0.00 0.00 58.31 54.69 1i33 n LYS 60 Cb 0.52 -1.21 -0.10 0.00 -1.84 0.00 0.00 35.03 32.40 1i33 n LYS 60 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 1i33 s TYR 61 N -1.72 1.95 -0.20 2.13 -0.85 -1.26 -5.11 117.35 112.29 1i33 s TYR 61 Ca 0.12 -0.98 -0.08 0.00 -0.52 0.00 0.00 57.07 55.61 1i33 s TYR 61 Cb 0.06 -1.28 -0.04 0.00 0.38 0.00 0.00 41.96 41.09 1i33 s TYR 61 CO 0.07 -0.01 0.08 0.95 -1.52 0.00 0.00 175.55 175.12 1i33 s THR 62 N -3.29 4.81 -0.08 -3.49 -4.23 -1.26 -5.03 115.64 103.08 1i33 s THR 62 Ca 0.36 -0.02 0.05 0.00 -1.18 0.00 0.00 61.69 60.90 1i33 s THR 62 Cb 0.08 -3.19 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 1i33 s THR 62 CO 0.15 0.43 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.73 1i33 s VAL 63 N 0.60 2.09 0.03 2.29 1.01 -1.26 -2.84 120.40 122.32 1i33 s VAL 63 Ca 0.04 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1i33 s VAL 63 Cb -0.13 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1i33 s VAL 63 CO 0.01 0.57 -0.02 -0.70 0.00 0.00 0.00 175.10 174.96 1i33 s GLU 64 N 0.05 0.39 -0.04 2.72 2.12 -0.99 -5.00 118.70 117.95 1i33 s GLU 64 Ca -0.10 -0.73 -0.00 0.00 0.36 0.00 0.00 54.97 54.50 1i33 s GLU 64 Cb -0.15 0.14 -0.03 0.00 0.26 0.00 0.00 34.13 34.34 1i33 s GLU 64 CO 0.06 -0.07 0.00 0.00 -0.54 0.00 0.00 175.26 174.71 1i33 s ALA 65 N -2.02 3.30 0.27 6.30 0.00 -1.26 -0.98 121.76 127.37 1i33 s ALA 65 Ca -0.11 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1i33 s ALA 65 Cb -0.06 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 1i33 s ALA 65 CO -0.03 0.62 0.31 0.14 0.00 0.00 0.00 175.76 176.80 1i33 s VAL 66 N -0.99 0.00 -0.10 0.00 -7.23 -0.50 -4.98 120.40 106.60 1i33 s VAL 66 Ca 0.17 -1.79 -0.03 0.00 -1.81 0.00 0.00 61.98 58.52 1i33 s VAL 66 Cb -0.11 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1i33 s VAL 66 CO 0.07 0.00 0.03 -0.54 -0.31 0.00 0.00 175.10 174.34 1i33 s LYS 67 N -3.74 3.10 0.29 4.82 1.02 -1.26 -1.02 119.74 122.94 1i33 s LYS 67 Ca 0.34 -0.36 -0.00 0.00 0.02 0.00 0.00 55.97 55.97 1i33 s LYS 67 Cb 0.03 -2.87 0.43 0.00 -0.52 0.00 0.00 37.83 34.90 1i33 s LYS 67 CO 0.16 0.69 1.83 0.66 -0.92 0.00 0.00 175.35 177.78 1i33 h SER 68 N 5.20 0.72 -3.53 2.83 4.64 -1.93 -3.42 113.55 118.07 1i33 h SER 68 Ca -0.51 -0.13 -0.34 0.00 -0.47 0.00 0.00 61.79 60.34 1i33 h SER 68 Cb 1.20 -0.19 -0.33 0.00 -0.31 0.00 0.00 62.40 62.77 1i33 h SER 68 CO 0.56 0.73 -0.75 -0.44 -0.87 0.00 0.00 176.83 176.05 1i33 s SER 69 N -6.61 0.43 0.00 4.97 0.01 -1.26 -4.99 113.70 106.24 1i33 s SER 69 Ca -0.09 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.13 1i33 s SER 69 Cb 0.15 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1i33 s SER 69 CO 0.79 -0.08 0.55 -0.81 0.41 0.00 0.00 173.24 174.10 1i33 n PRO 70 N 4.02 0.00 0.02 12.44 -0.04 -1.26 -0.59 135.00 149.59 1i33 n PRO 70 Ca -0.26 0.15 -0.18 0.00 -0.04 0.00 0.00 63.50 63.17 1i33 n PRO 70 Cb 0.51 -1.59 -0.08 0.00 -0.04 0.00 0.00 33.50 32.31 1i33 n PRO 70 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1i33 h SER 71 N 0.00 0.86 -4.02 3.54 0.02 -1.96 -3.46 113.55 108.53 1i33 h SER 71 Ca 0.00 -0.63 -0.53 0.00 -0.84 0.00 0.00 61.79 59.79 1i33 h SER 71 Cb 0.17 -0.26 0.10 0.00 0.14 0.00 0.00 62.40 62.55 1i33 h SER 71 CO 0.00 1.43 0.54 0.68 -1.14 0.00 0.00 176.83 178.34 1i33 s VAL 72 N -3.50 2.65 0.00 2.27 -7.23 0.24 -4.97 120.40 109.87 1i33 s VAL 72 Ca -0.09 0.49 -0.20 0.00 -1.81 0.00 0.00 61.98 60.37 1i33 s VAL 72 Cb 0.08 -3.25 -0.23 0.00 0.56 0.00 0.00 36.38 33.54 1i33 s VAL 72 CO 0.90 -0.01 1.09 1.05 -0.31 0.00 0.00 175.10 177.83 1i33 h GLU 73 N 1.80 0.40 -5.78 4.82 9.09 -1.89 -3.45 114.58 119.57 1i33 h GLU 73 Ca -0.50 -0.43 -0.65 0.00 0.05 0.00 0.00 59.36 57.83 1i33 h GLU 73 Cb 1.27 0.12 -0.31 0.00 -1.65 0.00 0.00 28.75 28.18 1i33 h GLU 73 CO 0.59 1.10 -0.87 0.95 0.05 0.00 0.00 179.01 180.83 1i33 s THR 74 N -3.20 1.85 0.35 -1.06 -4.23 -1.26 -5.11 115.64 102.98 1i33 s THR 74 Ca -0.13 -0.95 -0.21 0.00 -1.18 0.00 0.00 61.69 59.22 1i33 s THR 74 Cb 0.03 -1.57 -0.15 0.00 1.34 0.00 0.00 72.50 72.16 1i33 s THR 74 CO 0.82 0.52 0.14 0.00 -0.54 0.00 0.00 174.62 175.56 1i33 n ALA 75 N 3.01 -2.88 -2.02 3.99 0.00 -1.26 -4.87 120.51 116.47 1i33 n ALA 75 Ca -0.18 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1i33 n ALA 75 Cb 0.52 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1i33 n ALA 75 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1i33 n ASP 76 N 2.15 0.04 -3.79 0.00 5.75 -0.19 -2.60 116.55 117.91 1i33 n ASP 76 Ca 0.12 -1.89 -0.13 0.00 -0.01 0.00 0.00 54.79 52.87 1i33 n ASP 76 Cb 0.35 -0.18 -0.13 0.00 -1.03 0.00 0.00 41.12 40.13 1i33 n ASP 76 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1i33 s VAL 77 N 0.00 -0.02 -0.12 2.12 1.01 -0.73 -2.13 120.40 120.54 1i33 s VAL 77 Ca 0.02 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 62.00 1i33 s VAL 77 Cb 0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1i33 s VAL 77 CO -0.01 0.03 0.10 -0.76 0.00 0.00 0.00 175.10 174.46 1i33 s LEU 78 N 0.50 4.16 -0.30 3.92 1.02 0.97 -1.42 118.68 127.54 1i33 s LEU 78 Ca -0.04 0.36 0.03 0.00 0.02 0.00 0.00 54.13 54.50 1i33 s LEU 78 Cb -0.05 -2.01 0.08 0.00 0.02 0.00 0.00 46.19 44.24 1i33 s LEU 78 CO -0.02 0.38 -0.00 -0.69 0.02 0.00 0.00 176.35 176.03 1i33 s VAL 79 N -0.85 2.02 -0.22 -1.59 1.01 -0.15 0.88 120.40 121.50 1i33 s VAL 79 Ca 0.14 -1.91 -0.05 0.00 0.00 0.00 0.00 61.98 60.15 1i33 s VAL 79 Cb -0.12 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1i33 s VAL 79 CO 0.03 -0.38 0.01 -0.69 0.00 0.00 0.00 175.10 174.07 1i33 s VAL 80 N 1.09 3.89 -1.60 2.92 1.01 0.17 -2.34 120.40 125.53 1i33 s VAL 80 Ca 0.03 -0.32 -0.18 0.00 0.00 0.00 0.00 61.98 61.51 1i33 s VAL 80 Cb -0.19 -2.78 0.16 0.00 0.00 0.00 0.00 36.38 33.57 1i33 s VAL 80 CO -0.09 0.40 0.65 0.59 0.00 0.00 0.00 175.10 176.65 1i33 n ASN 81 N 4.62 -2.82 0.00 3.32 3.02 -1.13 -0.07 115.26 122.20 1i33 n ASN 81 Ca -0.17 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.47 1i33 n ASN 81 Cb 0.51 -2.35 0.00 0.00 -0.61 0.00 0.00 39.78 37.33 1i33 n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i33 n GLY 82 N -1.21 2.57 3.71 7.41 0.00 -1.26 -5.02 105.19 111.38 1i33 n GLY 82 Ca 0.08 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 1i33 n GLY 82 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1i33 n HIS 83 N 0.00 2.49 -3.49 1.61 -0.00 0.90 -4.94 115.22 111.79 1i33 n HIS 83 Ca 0.00 0.35 -0.37 0.00 -0.00 0.00 0.00 57.72 57.70 1i33 n HIS 83 Cb 0.00 -2.52 -0.08 0.00 -0.00 0.00 0.00 29.99 27.39 1i33 n HIS 83 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1i33 s ARG 84 N -0.52 4.17 -0.14 1.57 0.52 -1.26 -0.66 118.95 122.64 1i33 s ARG 84 Ca 0.66 0.06 0.02 0.00 -0.52 0.00 0.00 55.73 55.95 1i33 s ARG 84 Cb -0.57 -3.51 0.00 0.00 0.52 0.00 0.00 34.95 31.39 1i33 s ARG 84 CO 0.50 0.06 -0.20 0.42 0.02 0.00 0.00 175.30 176.10 1i33 s ILE 85 N 1.02 2.27 0.25 1.52 1.09 0.25 -4.83 121.20 122.78 1i33 s ILE 85 Ca 0.16 -0.91 -0.28 0.00 -1.10 0.00 0.00 60.65 58.51 1i33 s ILE 85 Cb -0.14 -1.92 -0.09 0.00 -1.06 0.00 0.00 42.46 39.25 1i33 s ILE 85 CO 0.06 0.54 0.92 -0.54 -0.10 0.00 0.00 174.94 175.81 1i33 s LYS 86 N 0.73 4.73 -0.92 2.79 -0.14 -0.81 -0.02 119.74 126.10 1i33 s LYS 86 Ca -0.08 1.39 -0.06 0.00 -1.36 0.00 0.00 55.97 55.85 1i33 s LYS 86 Cb -0.16 -3.13 0.23 0.00 -1.68 0.00 0.00 37.83 33.10 1i33 s LYS 86 CO 0.00 0.45 0.84 0.00 -0.76 0.00 0.00 175.35 175.89 1i33 s VAL 88 N -0.88 3.35 0.36 0.00 1.01 -0.56 -4.73 120.40 118.94 1i33 s VAL 88 Ca 0.25 0.79 -0.25 0.00 0.00 0.00 0.00 61.98 62.78 1i33 s VAL 88 Cb -0.10 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.88 1i33 s VAL 88 CO -0.09 -0.23 1.01 -0.75 0.00 0.00 0.00 175.10 175.04 1i33 s LYS 89 N -3.45 4.36 0.64 2.72 2.47 -1.26 -3.14 119.74 122.08 1i33 s LYS 89 Ca 0.70 1.44 -0.14 0.00 -1.56 0.00 0.00 55.97 56.41 1i33 s LYS 89 Cb -0.21 -2.66 -0.01 0.00 -1.46 0.00 0.00 37.83 33.48 1i33 s LYS 89 CO 0.28 0.05 1.07 0.00 0.16 0.00 0.00 175.35 176.92 1i33 s ALA 90 N -1.64 2.62 0.23 3.13 0.00 -1.04 -4.71 121.76 120.35 1i33 s ALA 90 Ca 0.54 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.93 1i33 s ALA 90 Cb -0.21 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 1i33 s ALA 90 CO 0.26 -1.08 -0.10 -0.65 0.00 0.00 0.00 175.76 174.19 1i33 s GLN 91 N -4.32 1.37 -0.02 0.00 -1.52 -1.26 -4.96 119.66 108.94 1i33 s GLN 91 Ca 0.63 -1.65 -0.23 0.00 -1.95 0.00 0.00 55.36 52.16 1i33 s GLN 91 Cb -0.17 -1.03 -0.21 0.00 -0.22 0.00 0.00 33.01 31.39 1i33 s GLN 91 CO 0.43 0.10 1.13 0.00 -0.25 0.00 0.00 175.29 176.70 1i33 h ARG 92 N 2.48 0.22 -5.27 2.91 3.08 -1.98 -3.43 114.38 112.39 1i33 h ARG 92 Ca -0.39 -0.18 -0.65 0.00 0.07 0.00 0.00 59.98 58.84 1i33 h ARG 92 Cb 1.22 0.04 -0.24 0.00 0.08 0.00 0.00 29.97 31.07 1i33 h ARG 92 CO 0.64 0.85 -0.71 1.21 -1.07 0.00 0.00 179.97 180.89 1i33 s ASN 93 N -6.24 4.45 0.49 7.04 2.47 -1.26 -5.00 114.94 116.89 1i33 s ASN 93 Ca -0.15 -0.23 0.29 0.00 0.42 0.00 0.00 52.86 53.19 1i33 s ASN 93 Cb 0.02 -1.71 1.38 0.00 -1.45 0.00 0.00 41.25 39.49 1i33 s ASN 93 CO 0.74 0.15 1.80 -0.65 -3.72 0.00 0.00 177.10 175.42 1i33 h PRO 94 N 6.86 0.14 0.00 0.43 0.11 -1.87 0.84 132.00 138.51 1i33 h PRO 94 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1i33 h PRO 94 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1i33 h PRO 94 CO 0.60 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 178.48 1i33 h ALA 95 N 1.50 1.00 -0.20 -0.75 0.00 -1.87 -2.17 119.26 116.78 1i33 h ALA 95 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1i33 h ALA 95 Cb 1.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1i33 h ALA 95 CO -0.12 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.88 1i33 n ASP 96 N -2.92 1.14 -4.82 0.00 8.00 0.29 -4.09 116.55 114.15 1i33 n ASP 96 Ca -0.00 -2.02 -0.38 0.00 0.71 0.00 0.00 54.79 53.10 1i33 n ASP 96 Cb 0.22 -0.16 -0.06 0.00 -0.02 0.00 0.00 41.12 41.10 1i33 n ASP 96 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1i33 s LEU 97 N -0.98 4.47 0.00 0.64 1.43 -0.81 -4.97 118.68 118.45 1i33 s LEU 97 Ca 0.13 1.01 -0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1i33 s LEU 97 Cb 0.07 -2.66 -0.05 0.00 0.03 0.00 0.00 46.19 43.58 1i33 s LEU 97 CO 0.09 0.28 1.97 -0.81 0.23 0.00 0.00 176.35 178.11 1i33 n PRO 98 N 2.00 1.01 -0.27 1.29 -0.04 -1.26 -4.49 135.00 133.24 1i33 n PRO 98 Ca -0.12 -0.19 -0.01 0.00 -0.04 0.00 0.00 63.50 63.14 1i33 n PRO 98 Cb 0.52 -1.27 0.12 0.00 -0.04 0.00 0.00 33.50 32.82 1i33 n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1i33 h TRP 99 N 1.97 0.86 0.08 0.54 -0.00 -1.87 0.54 115.95 118.07 1i33 h TRP 99 Ca 0.04 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.95 1i33 h TRP 99 Cb 0.92 -0.27 0.00 0.00 -0.00 0.00 0.00 29.16 29.81 1i33 h TRP 99 CO 0.59 0.44 -0.04 0.78 -0.00 0.00 0.00 178.44 180.20 1i33 h GLY 100 N 0.86 -0.11 1.23 1.49 0.00 -1.51 0.17 103.07 105.19 1i33 h GLY 100 Ca 0.34 0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.79 1i33 h GLY 100 CO -0.17 -0.04 0.33 1.70 0.00 0.00 0.00 176.54 178.36 1i33 h LYS 101 N -0.59 0.31 0.00 4.80 3.64 -1.78 -0.82 116.57 122.13 1i33 h LYS 101 Ca -0.01 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1i33 h LYS 101 Cb 0.49 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1i33 h LYS 101 CO 0.02 0.21 -0.49 -0.07 -2.27 0.00 0.00 179.45 176.85 1i33 h LEU 102 N 0.32 0.00 -0.09 5.20 3.38 0.16 -3.48 115.31 120.81 1i33 h LEU 102 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1i33 h LEU 102 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1i33 h LEU 102 CO -0.05 0.44 0.00 0.61 0.09 0.00 0.00 178.44 179.53 1i33 n GLY 103 N 1.22 0.97 3.59 0.83 0.00 -0.31 -5.03 105.19 106.45 1i33 n GLY 103 Ca 0.02 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 1i33 n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i33 s VAL 104 N -2.09 5.16 -0.22 1.61 1.01 0.48 -4.77 120.40 121.59 1i33 s VAL 104 Ca 0.00 0.47 -0.18 0.00 0.00 0.00 0.00 61.98 62.26 1i33 s VAL 104 Cb 0.00 -3.73 -0.18 0.00 0.00 0.00 0.00 36.38 32.47 1i33 s VAL 104 CO 0.00 0.09 0.08 0.47 0.00 0.00 0.00 175.10 175.74 1i33 n ASP 105 N 5.37 1.91 -4.49 3.32 8.00 0.46 -4.30 116.55 126.81 1i33 n ASP 105 Ca -0.08 0.37 -0.37 0.00 0.71 0.00 0.00 54.79 55.42 1i33 n ASP 105 Cb 0.50 -0.91 -0.12 0.00 -0.02 0.00 0.00 41.12 40.57 1i33 n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1i33 s TYR 106 N -2.42 3.14 -0.20 1.24 1.51 -0.28 -0.68 117.35 119.67 1i33 s TYR 106 Ca -0.31 -0.28 -0.03 0.00 -1.01 0.00 0.00 57.07 55.44 1i33 s TYR 106 Cb 0.08 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.62 1i33 s TYR 106 CO 0.58 -0.31 -0.06 0.08 -1.11 0.00 0.00 175.55 174.73 1i33 s VAL 107 N 1.66 3.35 -0.37 0.71 1.01 -0.57 -0.25 120.40 125.94 1i33 s VAL 107 Ca 0.06 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.29 1i33 s VAL 107 Cb -0.16 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1i33 s VAL 107 CO 0.06 0.45 0.83 -0.63 0.00 0.00 0.00 175.10 175.81 1i33 s ILE 108 N 1.22 4.68 -0.55 2.22 1.01 0.76 -1.83 121.20 128.71 1i33 s ILE 108 Ca 0.03 0.94 -0.19 0.00 0.00 0.00 0.00 60.65 61.42 1i33 s ILE 108 Cb -0.14 -4.26 0.08 0.00 0.01 0.00 0.00 42.46 38.14 1i33 s ILE 108 CO -0.02 -0.49 0.69 -0.70 0.00 0.00 0.00 174.94 174.42 1i33 s GLU 109 N 3.24 3.10 -0.19 2.79 2.56 -0.86 -0.61 118.70 128.74 1i33 s GLU 109 Ca 0.33 -1.02 0.16 0.00 0.00 0.00 0.00 54.97 54.44 1i33 s GLU 109 Cb -0.13 -4.17 0.45 0.00 2.00 0.00 0.00 34.13 32.28 1i33 s GLU 109 CO 0.18 -1.39 1.18 -1.13 -0.56 0.00 0.00 175.26 173.54 1i33 n SER 110 N 6.39 2.27 0.04 -1.70 3.41 -0.41 -1.96 113.62 121.67 1i33 n SER 110 Ca -0.07 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.44 1i33 n SER 110 Cb 0.44 -0.42 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 1i33 n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1i33 h THR 111 N 3.49 0.52 0.00 6.66 1.35 -1.80 -3.42 112.91 119.70 1i33 h THR 111 Ca 0.01 -1.99 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1i33 h THR 111 Cb 1.39 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.86 1i33 h THR 111 CO 0.23 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 1i33 n GLY 112 N 1.38 1.42 1.03 5.82 0.00 -1.26 -4.85 105.19 108.72 1i33 n GLY 112 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1i33 n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i33 n LEU 113 N 0.00 3.14 -2.78 0.99 4.77 -1.26 -4.38 117.00 117.48 1i33 n LEU 113 Ca 0.00 -1.18 -0.12 0.00 -0.03 0.00 0.00 56.01 54.67 1i33 n LEU 113 Cb 0.00 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 1i33 n LEU 113 CO 0.00 0.59 -0.12 0.49 -1.33 0.00 0.00 177.39 177.02 1i33 n PHE 114 N 1.37 1.11 1.62 -1.77 3.72 -1.26 -4.87 117.46 117.39 1i33 n PHE 114 Ca 0.16 -3.07 0.09 0.00 -0.05 0.00 0.00 57.45 54.58 1i33 n PHE 114 Cb 0.60 -0.37 0.41 0.00 -0.94 0.00 0.00 39.48 39.17 1i33 n PHE 114 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1i33 n THR 115 N -0.01 0.11 -3.82 4.37 -2.24 -1.26 -4.29 114.28 107.14 1i33 n THR 115 Ca 0.15 -0.17 -0.36 0.00 -2.27 0.00 0.00 64.05 61.40 1i33 n THR 115 Cb 0.77 0.03 -0.12 0.00 -2.10 0.00 0.00 70.33 68.91 1i33 n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i33 s ASP 116 N -1.49 5.38 0.20 3.42 2.15 -1.26 -1.49 116.67 123.57 1i33 s ASP 116 Ca 0.27 -0.10 -0.03 0.00 0.43 0.00 0.00 52.55 53.12 1i33 s ASP 116 Cb 0.14 -1.96 0.38 0.00 -0.30 0.00 0.00 42.92 41.18 1i33 s ASP 116 CO 0.21 0.02 1.06 1.17 -0.17 0.00 0.00 175.17 177.46 1i33 n LYS 117 N 4.54 -0.06 0.01 4.34 3.00 -1.09 -0.57 118.16 128.33 1i33 n LYS 117 Ca -0.16 1.04 -0.00 0.00 -0.00 0.00 0.00 58.31 59.19 1i33 n LYS 117 Cb 0.52 -1.59 -0.00 0.00 0.00 0.00 0.00 35.03 33.96 1i33 n LYS 117 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1i33 h LEU 118 N 0.00 -0.01 -0.91 3.14 4.07 -1.88 -2.31 115.31 117.41 1i33 h LEU 118 Ca 0.35 0.00 0.25 0.00 0.08 0.00 0.00 57.88 58.57 1i33 h LEU 118 Cb 0.62 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.22 1i33 h LEU 118 CO -0.68 -0.01 0.34 0.11 -1.08 0.00 0.00 178.44 177.13 1i33 h LYS 119 N -0.02 0.26 -0.83 1.13 1.57 -1.59 0.25 116.57 117.35 1i33 h LYS 119 Ca -0.00 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1i33 h LYS 119 Cb 0.01 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.22 1i33 h LYS 119 CO 0.00 0.17 0.54 0.00 -0.57 0.00 0.00 179.45 179.60 1i33 h ALA 120 N 1.78 1.48 0.00 3.86 0.00 -0.82 -0.27 119.26 125.30 1i33 h ALA 120 Ca 0.60 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1i33 h ALA 120 Cb 1.23 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1i33 h ALA 120 CO -0.62 0.44 0.05 0.93 0.00 0.00 0.00 179.25 180.04 1i33 h GLU 121 N 1.04 0.00 -0.85 0.00 5.08 0.09 -2.01 114.58 117.93 1i33 h GLU 121 Ca 0.33 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.87 1i33 h GLU 121 Cb 0.02 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.16 1i33 h GLU 121 CO -0.09 0.00 0.37 0.78 -1.00 0.00 0.00 179.01 179.07 1i33 h GLY 122 N 0.00 1.38 0.12 -3.84 0.00 -1.06 -0.19 103.07 99.48 1i33 h GLY 122 Ca 0.00 -0.18 0.12 0.00 0.00 0.00 0.00 47.33 47.27 1i33 h GLY 122 CO 0.00 -0.16 0.14 0.45 0.00 0.00 0.00 176.54 176.97 1i33 h HIS 123 N 0.47 0.22 -0.52 5.60 3.86 -1.53 -0.47 115.15 122.77 1i33 h HIS 123 Ca 0.50 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.73 1i33 h HIS 123 Cb 0.84 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.28 1i33 h HIS 123 CO -0.14 -0.04 0.29 0.82 0.86 0.00 0.00 177.93 179.72 1i33 h ILE 124 N 0.27 1.18 0.00 2.45 2.04 -1.19 0.15 117.51 122.40 1i33 h ILE 124 Ca 0.34 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1i33 h ILE 124 Cb 0.52 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1i33 h ILE 124 CO -0.43 0.19 0.00 0.29 0.00 0.00 0.00 178.15 178.20 1i33 n LYS 125 N -4.64 0.15 0.00 2.37 5.02 -0.31 0.56 118.16 121.31 1i33 n LYS 125 Ca 0.02 0.59 0.14 0.00 -2.02 0.00 0.00 58.31 57.04 1i33 n LYS 125 Cb 0.08 -1.94 0.46 0.00 -0.02 0.00 0.00 35.03 33.62 1i33 n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i33 n GLY 126 N -1.00 0.09 0.00 0.72 0.00 0.42 -4.88 105.19 100.54 1i33 n GLY 126 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1i33 n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i33 n GLY 127 N 1.21 0.92 3.82 -0.02 0.00 0.19 -1.94 105.19 109.37 1i33 n GLY 127 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1i33 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i33 s ALA 128 N -2.00 3.07 -0.19 4.61 0.00 -0.61 -3.95 121.76 122.70 1i33 s ALA 128 Ca 0.00 0.37 -0.16 0.00 0.00 0.00 0.00 51.96 52.17 1i33 s ALA 128 Cb 0.00 -3.12 -0.12 0.00 0.00 0.00 0.00 23.12 19.88 1i33 s ALA 128 CO 0.00 0.15 -0.01 1.17 0.00 0.00 0.00 175.76 177.07 1i33 n LYS 129 N -0.55 0.52 -4.25 0.00 4.81 0.15 -4.09 118.16 114.74 1i33 n LYS 129 Ca 0.06 0.51 -0.18 0.00 -0.87 0.00 0.00 58.31 57.84 1i33 n LYS 129 Cb 0.54 -1.69 -0.11 0.00 0.02 0.00 0.00 35.03 33.79 1i33 n LYS 129 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1i33 s LYS 130 N -2.36 1.05 -0.06 1.64 -0.14 -0.34 -4.92 119.74 114.62 1i33 s LYS 130 Ca -0.25 -1.28 0.00 0.00 -1.36 0.00 0.00 55.97 53.08 1i33 s LYS 130 Cb 0.05 -0.90 0.02 0.00 -1.68 0.00 0.00 37.83 35.32 1i33 s LYS 130 CO 0.44 0.17 -0.03 0.08 -0.76 0.00 0.00 175.35 175.24 1i33 s VAL 131 N -2.30 0.50 -0.32 3.17 1.01 -0.53 -1.51 120.40 120.42 1i33 s VAL 131 Ca 0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 1i33 s VAL 131 Cb -0.04 -0.57 0.05 0.00 0.00 0.00 0.00 36.38 35.81 1i33 s VAL 131 CO 0.03 0.24 0.06 -0.69 0.00 0.00 0.00 175.10 174.74 1i33 s VAL 132 N 1.30 3.38 -0.18 2.92 1.01 -0.76 -0.06 120.40 128.01 1i33 s VAL 132 Ca -0.05 -1.28 -0.29 0.00 0.00 0.00 0.00 61.98 60.36 1i33 s VAL 132 Cb -0.14 -2.94 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 1i33 s VAL 132 CO -0.02 -0.16 1.09 -0.63 0.00 0.00 0.00 175.10 175.38 1i33 s ILE 133 N 1.32 4.60 -0.08 2.22 1.01 0.30 -2.02 121.20 128.55 1i33 s ILE 133 Ca -0.03 1.91 -0.01 0.00 0.00 0.00 0.00 60.65 62.52 1i33 s ILE 133 Cb -0.20 -4.23 0.02 0.00 0.01 0.00 0.00 42.46 38.06 1i33 s ILE 133 CO 0.01 -0.12 2.18 -1.54 0.00 0.00 0.00 174.94 175.47 1i33 n SER 134 N 6.02 5.62 -3.64 3.58 3.41 -0.83 -1.66 113.62 126.12 1i33 n SER 134 Ca 0.12 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.15 1i33 n SER 134 Cb 0.46 -1.14 -0.01 0.00 -0.26 0.00 0.00 64.21 63.26 1i33 n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i33 s ALA 135 N -0.35 -2.12 0.38 7.33 0.00 -1.25 -4.97 121.76 120.79 1i33 s ALA 135 Ca 0.15 0.66 -0.28 0.00 0.00 0.00 0.00 51.96 52.49 1i33 s ALA 135 Cb 0.09 0.38 -0.10 0.00 0.00 0.00 0.00 23.12 23.49 1i33 s ALA 135 CO -0.01 -1.01 1.43 -2.14 0.00 0.00 0.00 175.76 174.03 1i33 s PRO 136 N -2.59 4.08 0.25 0.00 0.02 -1.25 -4.18 135.00 131.34 1i33 s PRO 136 Ca 0.13 2.45 0.09 0.00 0.02 0.00 0.00 61.00 63.70 1i33 s PRO 136 Cb 0.03 -2.93 -0.05 0.00 0.02 0.00 0.00 34.50 31.58 1i33 s PRO 136 CO -0.03 -0.51 -0.14 0.00 -0.33 0.00 0.00 177.00 175.99 1i33 s ALA 137 N -1.15 2.39 0.00 -1.55 0.00 -1.26 -4.88 121.76 115.31 1i33 s ALA 137 Ca 0.54 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.68 1i33 s ALA 137 Cb -0.44 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1i33 s ALA 137 CO 0.59 0.11 0.00 -1.13 0.00 0.00 0.00 175.76 175.33 1i33 n SER 138 N -0.53 1.27 0.00 0.00 3.41 -0.55 -4.76 113.62 112.47 1i33 n SER 138 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1i33 n SER 138 Cb 0.61 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 1i33 n SER 138 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i33 n GLY 139 N 5.00 0.36 1.16 5.00 0.00 -1.26 -2.69 105.19 112.76 1i33 n GLY 139 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1i33 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i33 n GLY 140 N -1.93 0.82 3.78 -0.02 0.00 -1.26 -4.70 105.19 101.88 1i33 n GLY 140 Ca 0.00 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1i33 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i33 s ALA 141 N -2.82 3.56 -0.04 4.61 0.00 -1.17 -5.00 121.76 120.91 1i33 s ALA 141 Ca 0.00 -0.09 -0.32 0.00 0.00 0.00 0.00 51.96 51.55 1i33 s ALA 141 Cb 0.00 -2.60 -0.10 0.00 0.00 0.00 0.00 23.12 20.42 1i33 s ALA 141 CO 0.00 0.26 1.97 1.17 0.00 0.00 0.00 175.76 179.15 1i33 n LYS 142 N 2.52 2.49 -3.59 0.00 3.00 -1.22 -4.73 118.16 116.63 1i33 n LYS 142 Ca -0.10 0.90 -0.36 0.00 -0.00 0.00 0.00 58.31 58.75 1i33 n LYS 142 Cb 0.51 -2.88 -0.07 0.00 0.00 0.00 0.00 35.03 32.60 1i33 n LYS 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1i33 s THR 143 N 4.72 5.31 0.07 3.15 2.01 -1.26 -1.61 115.64 128.03 1i33 s THR 143 Ca 0.92 0.50 0.06 0.00 0.31 0.00 0.00 61.69 63.48 1i33 s THR 143 Cb -0.54 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 1i33 s THR 143 CO 0.45 0.43 -0.17 -0.63 -0.69 0.00 0.00 174.62 174.02 1i33 s ILE 144 N 0.21 1.34 -0.25 1.82 1.01 0.37 -4.74 121.20 120.96 1i33 s ILE 144 Ca 0.16 -1.26 -0.00 0.00 0.00 0.00 0.00 60.65 59.55 1i33 s ILE 144 Cb -0.13 -1.22 0.07 0.00 0.01 0.00 0.00 42.46 41.19 1i33 s ILE 144 CO 0.04 -0.05 0.02 -0.69 0.00 0.00 0.00 174.94 174.25 1i33 s VAL 145 N -1.05 1.17 -0.09 2.92 1.01 -1.26 -4.06 120.40 119.03 1i33 s VAL 145 Ca 0.02 -1.21 -0.38 0.00 0.00 0.00 0.00 61.98 60.42 1i33 s VAL 145 Cb -0.09 -1.65 -0.16 0.00 0.00 0.00 0.00 36.38 34.48 1i33 s VAL 145 CO 0.02 -0.33 1.59 0.23 0.00 0.00 0.00 175.10 176.61 1i33 n MET 146 N 4.77 1.30 -0.08 2.72 0.00 -1.26 -0.71 117.12 123.86 1i33 n MET 146 Ca -0.07 0.47 0.00 0.00 0.00 0.00 0.00 57.70 58.10 1i33 n MET 146 Cb 0.44 -2.16 0.00 0.00 0.00 0.00 0.00 33.22 31.50 1i33 n MET 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i33 n GLY 147 N 3.50 0.54 0.00 3.03 0.00 -1.26 -4.89 105.19 106.11 1i33 n GLY 147 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1i33 n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1i33 n VAL 148 N -2.00 0.00 -2.07 1.61 0.31 0.11 -4.97 118.33 111.33 1i33 n VAL 148 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1i33 n VAL 148 Cb 0.00 -0.23 -0.02 0.00 -0.91 0.00 0.00 33.84 32.67 1i33 n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1i33 n ASN 149 N -1.79 -0.24 0.27 4.52 6.94 -1.12 -4.90 115.26 118.95 1i33 n ASN 149 Ca 0.00 -1.64 0.13 0.00 -0.02 0.00 0.00 54.58 53.05 1i33 n ASN 149 Cb 0.20 0.05 0.78 0.00 -2.36 0.00 0.00 39.78 38.45 1i33 n ASN 149 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1i33 h GLN 150 N 0.13 0.00 0.00 -3.83 -0.00 -1.94 -0.76 115.11 108.72 1i33 h GLN 150 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 1i33 h GLN 150 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 1i33 h GLN 150 CO -0.09 0.06 0.00 -2.39 -0.00 0.00 0.00 178.83 176.41 1i33 n HIS 151 N -3.89 0.54 1.03 0.06 1.44 -1.26 -1.20 115.22 111.93 1i33 n HIS 151 Ca -0.03 0.25 0.05 0.00 -2.01 0.00 0.00 57.72 55.98 1i33 n HIS 151 Cb 0.15 -0.90 0.13 0.00 0.12 0.00 0.00 29.99 29.50 1i33 n HIS 151 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1i33 n GLU 152 N -2.03 1.71 -2.61 -1.40 1.02 -0.29 -4.87 120.64 112.18 1i33 n GLU 152 Ca 0.01 -1.09 -0.43 0.00 -0.02 0.00 0.00 57.16 55.64 1i33 n GLU 152 Cb 0.11 -1.24 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 1i33 n GLU 152 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1i33 s TYR 153 N -1.60 3.37 -0.39 -0.32 5.04 -0.34 -5.01 117.35 118.10 1i33 s TYR 153 Ca 0.20 1.45 -0.07 0.00 -2.44 0.00 0.00 57.07 56.21 1i33 s TYR 153 Cb 0.11 -3.28 0.08 0.00 0.35 0.00 0.00 41.96 39.22 1i33 s TYR 153 CO 0.14 -0.61 0.20 0.45 -1.34 0.00 0.00 175.55 174.39 1i33 s SER 154 N 1.25 5.46 0.39 4.32 0.15 -1.26 -4.98 113.70 119.04 1i33 s SER 154 Ca 0.50 -1.52 0.15 0.00 0.70 0.00 0.00 55.95 55.78 1i33 s SER 154 Cb -0.20 -1.92 0.99 0.00 -1.71 0.00 0.00 66.02 63.19 1i33 s SER 154 CO 0.17 -0.48 1.85 -0.65 1.20 0.00 0.00 173.24 175.33 1i33 h PRO 155 N 8.28 0.49 0.00 5.44 0.11 -1.92 0.32 132.00 144.71 1i33 h PRO 155 Ca -0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1i33 h PRO 155 Cb 1.07 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1i33 h PRO 155 CO 0.71 0.32 -0.40 0.00 -0.21 0.00 0.00 178.00 178.41 1i33 h ALA 156 N 1.61 0.78 0.00 -0.75 0.00 -1.99 -3.39 119.26 115.52 1i33 h ALA 156 Ca 0.48 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 55.22 1i33 h ALA 156 Cb 1.05 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1i33 h ALA 156 CO -0.21 0.00 -1.61 0.43 0.00 0.00 0.00 179.25 177.86 1i33 n SER 157 N -2.70 3.00 -4.49 0.00 7.64 -0.53 -4.95 113.62 111.60 1i33 n SER 157 Ca 0.03 -0.04 -0.43 0.00 1.01 0.00 0.00 58.87 59.43 1i33 n SER 157 Cb 0.51 -0.18 -0.05 0.00 -1.01 0.00 0.00 64.21 63.48 1i33 n SER 157 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1i33 s HIS 158 N -2.21 2.83 -0.47 1.43 3.76 0.10 -4.83 115.29 115.89 1i33 s HIS 158 Ca -0.15 -0.26 0.11 0.00 -0.15 0.00 0.00 55.06 54.62 1i33 s HIS 158 Cb 0.04 -4.00 -0.13 0.00 1.11 0.00 0.00 32.58 29.60 1i33 s HIS 158 CO 0.24 -1.35 0.45 0.72 -0.85 0.00 0.00 174.74 173.96 1i33 n HIS 159 N 7.21 0.00 -3.71 1.40 -0.00 -1.26 -4.73 115.22 114.14 1i33 n HIS 159 Ca -0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.42 1i33 n HIS 159 Cb 0.46 -0.02 -0.16 0.00 -0.00 0.00 0.00 29.99 30.27 1i33 n HIS 159 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1i33 s VAL 160 N -2.11 0.49 0.12 1.59 1.01 -1.26 -1.46 120.40 118.78 1i33 s VAL 160 Ca 0.03 -0.71 0.07 0.00 0.00 0.00 0.00 61.98 61.37 1i33 s VAL 160 Cb 0.08 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1i33 s VAL 160 CO 0.46 -0.35 -0.06 -0.69 0.00 0.00 0.00 175.10 174.46 1i33 s VAL 161 N 1.85 3.60 -0.16 2.92 1.01 0.91 -3.45 120.40 127.09 1i33 s VAL 161 Ca 0.02 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 60.78 1i33 s VAL 161 Cb -0.17 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1i33 s VAL 161 CO -0.14 0.06 -0.19 -0.55 0.00 0.00 0.00 175.10 174.29 1i33 s SER 162 N -2.39 3.31 -0.01 3.32 0.15 -0.63 0.11 113.70 117.55 1i33 s SER 162 Ca 0.24 -0.58 0.01 0.00 0.70 0.00 0.00 55.95 56.33 1i33 s SER 162 Cb -0.11 -1.50 0.06 0.00 -1.71 0.00 0.00 66.02 62.76 1i33 s SER 162 CO 0.16 0.05 0.75 -3.20 1.20 0.00 0.00 173.24 172.20 1i33 n ASN 163 N 4.28 1.03 -0.14 5.45 4.05 -0.66 -0.48 115.26 128.79 1i33 n ASN 163 Ca -0.20 -2.05 0.00 0.00 0.45 0.00 0.00 54.58 52.78 1i33 n ASN 163 Cb 0.51 -0.35 0.00 0.00 1.23 0.00 0.00 39.78 41.17 1i33 n ASN 163 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1i33 n ALA 164 N -0.08 0.00 -2.71 5.20 0.00 -1.26 -4.83 120.51 116.83 1i33 n ALA 164 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.26 1i33 n ALA 164 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.67 1i33 n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1i33 s SER 165 N -4.00 6.03 0.25 0.00 1.04 -1.26 -3.78 113.70 111.98 1i33 s SER 165 Ca 0.00 -0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.27 1i33 s SER 165 Cb 0.00 -1.49 0.31 0.00 0.10 0.00 0.00 66.02 64.94 1i33 s SER 165 CO 0.00 -0.24 1.91 0.00 0.98 0.00 0.00 173.24 175.89 1i33 h THR 167 N 1.26 1.27 -0.29 0.00 2.02 -1.95 -3.09 112.91 112.13 1i33 h THR 167 Ca 0.39 -1.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1i33 h THR 167 Cb -0.02 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1i33 h THR 167 CO -0.12 0.47 0.17 0.74 0.37 0.00 0.00 175.52 177.15 1i33 h THR 168 N 0.82 1.11 0.00 3.16 2.02 -1.69 -1.16 112.91 117.17 1i33 h THR 168 Ca 0.11 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1i33 h THR 168 Cb 0.77 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1i33 h THR 168 CO 0.06 0.11 0.02 0.59 0.37 0.00 0.00 175.52 176.67 1i33 n ASN 169 N -4.85 0.00 -0.09 4.18 3.02 -0.79 -0.76 115.26 115.97 1i33 n ASN 169 Ca -0.02 0.19 -0.12 0.00 -0.03 0.00 0.00 54.58 54.61 1i33 n ASN 169 Cb 0.06 -0.19 -0.10 0.00 -0.61 0.00 0.00 39.78 38.93 1i33 n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i33 h LEU 171 N 0.00 0.33 -0.51 0.00 5.85 -0.48 -3.36 115.31 117.15 1i33 h LEU 171 Ca -0.43 -0.93 0.09 0.00 0.84 0.00 0.00 57.88 57.45 1i33 h LEU 171 Cb 1.76 -0.11 -0.10 0.00 0.37 0.00 0.00 40.66 42.58 1i33 h LEU 171 CO -0.04 1.35 -0.36 0.00 -0.34 0.00 0.00 178.44 179.05 1i33 h ALA 172 N 0.02 -0.18 -0.26 1.25 0.00 -1.22 0.11 119.26 118.98 1i33 h ALA 172 Ca -0.14 0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1i33 h ALA 172 Cb 1.51 0.80 -0.07 0.00 0.00 0.00 0.00 17.79 20.03 1i33 h ALA 172 CO 0.09 -0.74 -0.28 -1.35 0.00 0.00 0.00 179.25 176.97 1i33 h PRO 173 N -0.22 -0.27 0.20 0.00 0.11 -1.79 1.18 132.00 131.20 1i33 h PRO 173 Ca 0.19 0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.33 1i33 h PRO 173 Cb 0.55 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.70 1i33 h PRO 173 CO -0.63 -0.18 -0.25 0.82 -0.21 0.00 0.00 178.00 177.56 1i33 h ILE 174 N -0.28 0.46 -0.79 4.15 1.08 -1.44 -1.37 117.51 119.33 1i33 h ILE 174 Ca 0.14 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.69 1i33 h ILE 174 Cb 0.50 0.46 -0.05 0.00 -3.07 0.00 0.00 36.82 34.66 1i33 h ILE 174 CO -0.42 0.00 0.52 0.58 -0.69 0.00 0.00 178.15 178.14 1i33 h VAL 175 N -0.50 0.99 0.66 1.67 2.07 -0.22 -0.47 116.25 120.44 1i33 h VAL 175 Ca 0.01 -0.27 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1i33 h VAL 175 Cb 0.49 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1i33 h VAL 175 CO -0.09 0.14 -0.45 -0.74 0.02 0.00 0.00 177.57 176.45 1i33 h HIS 176 N 0.79 -1.22 -0.35 1.57 -0.00 0.23 -1.62 115.15 114.55 1i33 h HIS 176 Ca 0.35 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.73 1i33 h HIS 176 Cb 0.35 0.44 -0.02 0.00 -0.00 0.00 0.00 27.41 28.18 1i33 h HIS 176 CO -0.00 -0.65 0.22 -0.39 -0.00 0.00 0.00 177.93 177.11 1i33 h VAL 177 N -1.05 1.07 -1.11 5.26 -1.51 -0.91 0.49 116.25 118.49 1i33 h VAL 177 Ca -0.09 -0.16 0.31 0.00 -1.23 0.00 0.00 66.70 65.53 1i33 h VAL 177 Cb 0.86 0.57 -0.08 0.00 -2.13 0.00 0.00 31.29 30.51 1i33 h VAL 177 CO 0.06 0.08 0.75 -0.07 -1.23 0.00 0.00 177.57 177.16 1i33 h LEU 178 N 0.46 0.27 0.13 4.19 3.38 -0.95 0.35 115.31 123.14 1i33 h LEU 178 Ca 0.13 0.06 -0.32 0.00 0.09 0.00 0.00 57.88 57.84 1i33 h LEU 178 Cb -0.03 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1i33 h LEU 178 CO -0.04 0.03 -1.67 0.71 0.09 0.00 0.00 178.44 177.55 1i33 h THR 179 N 0.23 0.88 -0.60 0.22 1.35 -0.35 -1.22 112.91 113.40 1i33 h THR 179 Ca 0.60 -2.40 -0.07 0.00 -0.55 0.00 0.00 66.41 63.99 1i33 h THR 179 Cb 1.86 2.64 -0.03 0.00 -1.73 0.00 0.00 68.15 70.90 1i33 h THR 179 CO -0.20 0.79 0.11 0.50 -0.25 0.00 0.00 175.52 176.46 1i33 h LYS 180 N -0.11 0.97 -0.49 4.72 3.64 0.44 -1.25 116.57 124.48 1i33 h LYS 180 Ca -0.35 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1i33 h LYS 180 Cb 1.92 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.61 1i33 h LYS 180 CO 0.09 0.89 0.00 0.39 -2.27 0.00 0.00 179.45 178.55 1i33 n GLU 181 N -4.23 0.89 -3.19 1.90 -0.58 0.11 -4.84 120.64 110.71 1i33 n GLU 181 Ca 0.04 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.55 1i33 n GLU 181 Cb 0.27 -1.24 0.02 0.00 -0.57 0.00 0.00 31.44 29.91 1i33 n GLU 181 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1i33 n ASN 182 N -0.20 -4.96 0.21 1.62 3.02 -0.47 -4.85 115.26 109.64 1i33 n ASN 182 Ca 0.00 -0.33 0.12 0.00 -0.03 0.00 0.00 54.58 54.34 1i33 n ASN 182 Cb 0.12 -4.04 0.18 0.00 -0.61 0.00 0.00 39.78 35.43 1i33 n ASN 182 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1i33 h PHE 183 N -1.19 0.00 -2.10 3.10 0.04 -1.39 -3.46 116.94 111.93 1i33 h PHE 183 Ca -0.48 0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.39 1i33 h PHE 183 Cb 1.33 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.42 1i33 h PHE 183 CO 0.60 0.00 -0.66 0.41 -0.60 0.00 0.00 178.31 178.06 1i33 n GLY 184 N 1.11 -3.31 2.68 -1.45 0.00 -1.17 -2.00 105.19 101.06 1i33 n GLY 184 Ca 0.04 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.77 1i33 n GLY 184 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1i33 s ILE 185 N -4.30 -0.30 0.08 -0.61 2.07 -1.26 -3.73 121.20 113.15 1i33 s ILE 185 Ca 0.00 -1.38 -0.27 0.00 -1.41 0.00 0.00 60.65 57.59 1i33 s ILE 185 Cb 0.00 -0.67 -0.11 0.00 0.13 0.00 0.00 42.46 41.80 1i33 s ILE 185 CO 0.00 -0.63 1.44 -0.08 -1.91 0.00 0.00 174.94 173.76 1i33 h GLU 186 N 6.34 -0.55 -3.74 3.50 4.81 -1.44 -3.46 114.58 120.04 1i33 h GLU 186 Ca 0.11 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.30 1i33 h GLU 186 Cb 1.03 0.12 -0.11 0.00 0.63 0.00 0.00 28.75 30.43 1i33 h GLU 186 CO 0.20 -0.37 -0.20 0.95 -0.73 0.00 0.00 179.01 178.87 1i33 s THR 187 N -5.16 0.03 -0.22 0.32 -4.23 -1.25 -4.80 115.64 100.32 1i33 s THR 187 Ca -0.13 -1.35 -0.28 0.00 -1.18 0.00 0.00 61.69 58.75 1i33 s THR 187 Cb 0.05 -2.01 0.13 0.00 1.34 0.00 0.00 72.50 72.01 1i33 s THR 187 CO 0.48 -0.11 1.05 -0.83 -0.54 0.00 0.00 174.62 174.66 1i33 s GLY 188 N -2.99 -0.18 -0.08 3.99 0.00 0.05 -2.07 107.32 106.03 1i33 s GLY 188 Ca 0.20 2.38 0.02 0.00 0.00 0.00 0.00 44.72 47.32 1i33 s GLY 188 CO 0.05 1.39 -0.14 1.08 0.00 0.00 0.00 173.10 175.48 1i33 s LEU 189 N -0.53 1.67 -0.04 0.66 1.02 -0.07 -2.62 118.68 118.76 1i33 s LEU 189 Ca 0.01 -0.36 0.06 0.00 0.02 0.00 0.00 54.13 53.86 1i33 s LEU 189 Cb -0.02 -0.95 -0.02 0.00 0.02 0.00 0.00 46.19 45.21 1i33 s LEU 189 CO -0.03 0.03 -0.21 0.00 0.02 0.00 0.00 176.35 176.16 1i33 s MET 190 N 0.82 2.34 -0.12 1.70 0.23 -0.51 -1.74 119.30 122.01 1i33 s MET 190 Ca -0.11 -0.83 -0.01 0.00 -1.03 0.00 0.00 55.69 53.71 1i33 s MET 190 Cb -0.15 -2.19 -0.02 0.00 -1.53 0.00 0.00 34.83 30.93 1i33 s MET 190 CO 0.02 0.55 -0.09 0.99 -2.03 0.00 0.00 175.02 174.46 1i33 s THR 191 N -0.58 3.41 -0.16 3.16 2.01 -0.21 -1.69 115.64 121.57 1i33 s THR 191 Ca 0.08 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.56 1i33 s THR 191 Cb -0.11 -2.44 0.01 0.00 0.01 0.00 0.00 72.50 69.98 1i33 s THR 191 CO 0.00 0.53 -0.20 0.28 -0.69 0.00 0.00 174.62 174.54 1i33 s THR 192 N 0.11 2.10 -0.60 -0.82 -1.32 -0.69 -0.18 115.64 114.23 1i33 s THR 192 Ca -0.04 -0.94 -0.23 0.00 -1.21 0.00 0.00 61.69 59.26 1i33 s THR 192 Cb -0.14 -1.86 0.05 0.00 -1.51 0.00 0.00 72.50 69.04 1i33 s THR 192 CO 0.04 0.54 0.95 -0.63 -2.21 0.00 0.00 174.62 173.31 1i33 s ILE 193 N 1.09 4.35 -0.01 5.08 1.09 -0.39 -0.53 121.20 131.88 1i33 s ILE 193 Ca -0.00 -0.02 -0.02 0.00 -1.10 0.00 0.00 60.65 59.51 1i33 s ILE 193 Cb -0.14 -4.61 -0.04 0.00 -1.06 0.00 0.00 42.46 36.61 1i33 s ILE 193 CO -0.08 -1.28 0.12 -2.28 -0.10 0.00 0.00 174.94 171.33 1i33 s HIS 194 N 4.01 3.41 0.51 3.97 2.46 -0.30 -1.51 115.29 127.85 1i33 s HIS 194 Ca 0.26 0.29 -0.19 0.00 0.47 0.00 0.00 55.06 55.89 1i33 s HIS 194 Cb -0.14 -1.79 -0.07 0.00 -0.13 0.00 0.00 32.58 30.44 1i33 s HIS 194 CO 0.15 0.60 1.02 -1.12 -2.47 0.00 0.00 174.74 172.92 1i33 s SER 195 N -1.76 6.31 0.83 9.88 0.01 -1.26 -0.57 113.70 127.14 1i33 s SER 195 Ca 0.24 1.81 -0.12 0.00 1.31 0.00 0.00 55.95 59.19 1i33 s SER 195 Cb -0.12 -2.54 0.09 0.00 0.21 0.00 0.00 66.02 63.66 1i33 s SER 195 CO 0.15 -0.80 1.16 -0.72 0.41 0.00 0.00 173.24 173.43 1i33 s TYR 196 N -2.24 1.94 0.48 2.43 -0.85 -0.63 -4.77 117.35 113.71 1i33 s TYR 196 Ca 0.64 1.69 0.02 0.00 -0.52 0.00 0.00 57.07 58.90 1i33 s TYR 196 Cb -0.14 -3.33 -0.01 0.00 0.38 0.00 0.00 41.96 38.86 1i33 s TYR 196 CO 0.25 -2.55 0.06 0.95 -1.52 0.00 0.00 175.55 172.74 1i33 s THR 197 N -2.48 0.85 0.48 -3.49 -4.23 -1.26 -4.72 115.64 100.78 1i33 s THR 197 Ca 0.68 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.33 1i33 s THR 197 Cb -0.24 -2.15 0.30 0.00 1.34 0.00 0.00 72.50 71.75 1i33 s THR 197 CO 0.53 0.00 2.07 0.00 -0.54 0.00 0.00 174.62 176.69 1i33 h ALA 198 N 1.47 1.99 0.00 3.99 0.00 -1.98 -2.04 119.26 122.69 1i33 h ALA 198 Ca -0.40 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1i33 h ALA 198 Cb 1.31 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1i33 h ALA 198 CO 0.66 -0.04 -0.01 1.79 0.00 0.00 0.00 179.25 181.65 1i33 h THR 199 N 0.23 0.02 -4.30 0.00 1.35 -1.99 -3.45 112.91 104.77 1i33 h THR 199 Ca 0.13 -0.53 -0.47 0.00 -0.55 0.00 0.00 66.41 64.98 1i33 h THR 199 Cb 0.22 1.52 0.12 0.00 -1.73 0.00 0.00 68.15 68.28 1i33 h THR 199 CO -0.02 0.01 0.33 -1.10 -0.25 0.00 0.00 175.52 174.48 1i33 s GLN 200 N -3.67 1.71 -0.03 4.72 -0.21 -0.77 -4.98 119.66 116.43 1i33 s GLN 200 Ca 0.01 0.44 0.01 0.00 0.02 0.00 0.00 55.36 55.84 1i33 s GLN 200 Cb 0.09 -1.89 -0.03 0.00 1.00 0.00 0.00 33.01 32.17 1i33 s GLN 200 CO 0.55 -1.84 -0.03 0.15 -2.12 0.00 0.00 175.29 172.00 1i33 s LYS 201 N -5.25 2.77 0.07 2.91 3.01 -1.26 -4.98 119.74 117.01 1i33 s LYS 201 Ca 0.62 -0.58 -0.21 0.00 -1.01 0.00 0.00 55.97 54.79 1i33 s LYS 201 Cb -0.14 -2.64 -0.11 0.00 -1.01 0.00 0.00 37.83 33.92 1i33 s LYS 201 CO 0.53 0.64 1.52 1.79 0.51 0.00 0.00 175.35 180.35 1i33 h THR 202 N 3.84 1.23 -2.04 2.17 1.35 -1.94 0.54 112.91 118.07 1i33 h THR 202 Ca -0.49 -0.76 -0.61 0.00 -0.55 0.00 0.00 66.41 64.00 1i33 h THR 202 Cb 1.18 1.42 -0.14 0.00 -1.73 0.00 0.00 68.15 68.88 1i33 h THR 202 CO 0.55 0.23 -0.69 0.68 -0.25 0.00 0.00 175.52 176.04 1i33 s VAL 203 N -5.10 2.23 -0.39 6.82 -7.23 -1.26 -3.77 120.40 111.69 1i33 s VAL 203 Ca -0.14 -2.23 -0.39 0.00 -1.81 0.00 0.00 61.98 57.41 1i33 s VAL 203 Cb 0.06 -2.58 -0.15 0.00 0.56 0.00 0.00 36.38 34.28 1i33 s VAL 203 CO 0.72 -0.24 2.11 0.47 -0.31 0.00 0.00 175.10 177.85 1i33 n ASP 204 N -0.75 1.68 -0.93 4.85 8.00 -1.26 -4.25 116.55 123.88 1i33 n ASP 204 Ca -0.05 0.59 0.00 0.00 0.71 0.00 0.00 54.79 56.04 1i33 n ASP 204 Cb 0.63 -1.12 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 1i33 n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i33 n GLY 205 N 6.57 5.48 3.75 0.44 0.00 0.11 -4.94 105.19 116.61 1i33 n GLY 205 Ca 0.44 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 1i33 n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i33 s VAL 206 N -0.52 4.80 -0.49 1.61 1.01 -1.26 -4.70 120.40 120.85 1i33 s VAL 206 Ca 0.00 1.51 0.06 0.00 0.00 0.00 0.00 61.98 63.55 1i33 s VAL 206 Cb 0.00 -4.06 0.24 0.00 0.00 0.00 0.00 36.38 32.56 1i33 s VAL 206 CO 0.00 0.37 0.87 -0.24 0.00 0.00 0.00 175.10 176.10 1i33 n SER 207 N 2.86 -2.95 0.30 3.32 2.88 -1.26 -4.85 113.62 113.92 1i33 n SER 207 Ca -0.04 -3.27 0.18 0.00 -1.33 0.00 0.00 58.87 54.42 1i33 n SER 207 Cb 0.50 1.82 1.00 0.00 -0.75 0.00 0.00 64.21 66.78 1i33 n SER 207 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1i33 h LEU 208 N 4.10 0.00 0.10 2.46 3.38 -1.95 -2.71 115.31 120.69 1i33 h LEU 208 Ca -0.13 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.53 1i33 h LEU 208 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1i33 h LEU 208 CO 0.30 0.00 -1.66 0.11 0.09 0.00 0.00 178.44 177.28 1i33 h LYS 209 N 0.00 0.22 -3.05 1.13 1.57 -2.04 -3.42 116.57 110.97 1i33 h LYS 209 Ca 0.02 -0.37 -0.62 0.00 -1.87 0.00 0.00 60.65 57.81 1i33 h LYS 209 Cb 0.14 0.14 -0.41 0.00 0.08 0.00 0.00 32.23 32.18 1i33 h LYS 209 CO -0.00 1.18 -0.64 0.34 -0.57 0.00 0.00 179.45 179.76 1i33 s ASP 210 N -7.02 4.26 0.20 0.86 2.15 -1.07 -4.99 116.67 111.06 1i33 s ASP 210 Ca -0.22 -3.52 -0.16 0.00 0.43 0.00 0.00 52.55 49.07 1i33 s ASP 210 Cb 0.06 -1.45 0.20 0.00 -0.30 0.00 0.00 42.92 41.42 1i33 s ASP 210 CO 0.74 -0.13 1.61 -0.50 -0.17 0.00 0.00 175.17 176.71 1i33 h TRP 211 N 5.72 -0.59 -0.14 -5.34 4.06 -1.76 -0.53 115.95 117.36 1i33 h TRP 211 Ca 0.11 0.06 -0.00 0.00 2.06 0.00 0.00 58.89 61.12 1i33 h TRP 211 Cb 0.81 0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 29.32 1i33 h TRP 211 CO 0.59 -0.33 0.08 0.00 -3.56 0.00 0.00 178.44 175.23 1i33 h ARG 212 N -0.08 0.20 0.00 0.49 3.08 -1.91 -1.85 114.38 114.31 1i33 h ARG 212 Ca 0.28 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1i33 h ARG 212 Cb 0.52 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1i33 h ARG 212 CO -0.67 0.18 0.24 0.41 -1.07 0.00 0.00 179.97 179.06 1i33 n GLY 213 N -0.99 -0.49 0.73 0.04 0.00 -0.25 -0.37 105.19 103.86 1i33 n GLY 213 Ca -0.04 0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1i33 n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i33 n GLY 214 N -1.29 0.76 3.89 -0.02 0.00 -0.70 -4.11 105.19 103.73 1i33 n GLY 214 Ca -0.01 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 1i33 n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i33 s ARG 215 N -1.62 3.63 -0.39 1.61 1.81 0.50 0.09 118.95 124.58 1i33 s ARG 215 Ca 0.32 -0.07 -0.30 0.00 -1.72 0.00 0.00 55.73 53.96 1i33 s ARG 215 Cb 0.17 -2.87 -0.14 0.00 -0.45 0.00 0.00 34.95 31.66 1i33 s ARG 215 CO 0.25 0.49 1.55 0.00 -0.68 0.00 0.00 175.30 176.90 1i33 n ALA 216 N 0.21 0.16 -0.12 2.13 0.00 -1.26 -4.55 120.51 117.08 1i33 n ALA 216 Ca -0.03 0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.40 1i33 n ALA 216 Cb 0.52 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 1i33 n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i33 h ALA 217 N 6.55 0.48 -0.22 0.00 0.00 -0.97 -3.19 119.26 121.91 1i33 h ALA 217 Ca -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1i33 h ALA 217 Cb 0.99 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1i33 h ALA 217 CO 0.79 0.25 0.00 0.00 0.00 0.00 0.00 179.25 180.29 1i33 n ALA 218 N -2.39 2.47 -1.44 0.00 0.00 -1.26 -3.79 120.51 114.10 1i33 n ALA 218 Ca -0.02 -0.40 0.03 0.00 0.00 0.00 0.00 53.44 53.05 1i33 n ALA 218 Cb 0.27 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 18.77 1i33 n ALA 218 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1i33 n VAL 219 N 0.16 0.65 -3.89 0.00 3.14 -1.21 -4.71 118.33 112.47 1i33 n VAL 219 Ca 0.08 -0.77 -0.09 0.00 -2.96 0.00 0.00 64.34 60.60 1i33 n VAL 219 Cb 0.20 0.34 -0.07 0.00 -1.06 0.00 0.00 33.84 33.24 1i33 n VAL 219 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 1i33 s ASN 220 N -1.45 0.05 -0.36 6.55 0.01 -1.22 -5.06 114.94 113.46 1i33 s ASN 220 Ca 0.10 -0.74 -0.11 0.00 -0.71 0.00 0.00 52.86 51.41 1i33 s ASN 220 Cb 0.09 0.40 0.02 0.00 0.41 0.00 0.00 41.25 42.17 1i33 s ASN 220 CO 0.01 -0.82 0.19 -0.63 -1.51 0.00 0.00 177.10 174.34 1i33 s ILE 221 N -3.91 4.55 -0.32 0.60 1.01 -1.26 -4.01 121.20 117.86 1i33 s ILE 221 Ca 0.11 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 1i33 s ILE 221 Cb 0.04 -3.50 0.05 0.00 0.01 0.00 0.00 42.46 39.06 1i33 s ILE 221 CO -0.06 -0.17 0.06 -0.63 0.00 0.00 0.00 174.94 174.14 1i33 s ILE 222 N 1.56 3.32 0.90 2.92 1.01 0.92 -4.91 121.20 126.92 1i33 s ILE 222 Ca 0.02 -1.34 -0.11 0.00 0.00 0.00 0.00 60.65 59.23 1i33 s ILE 222 Cb -0.19 -2.93 0.13 0.00 0.01 0.00 0.00 42.46 39.49 1i33 s ILE 222 CO 0.06 -0.18 1.11 -2.84 0.00 0.00 0.00 174.94 173.09 1i33 s PRO 223 N 1.30 1.18 -0.05 2.79 0.02 -1.26 -0.26 135.00 138.72 1i33 s PRO 223 Ca -0.03 1.22 -0.31 0.00 0.02 0.00 0.00 61.00 61.91 1i33 s PRO 223 Cb -0.20 -1.77 0.11 0.00 0.02 0.00 0.00 34.50 32.66 1i33 s PRO 223 CO 0.00 -2.42 1.09 -1.54 -0.33 0.00 0.00 177.00 173.80 1i33 s SER 224 N -3.00 -0.20 0.62 2.53 1.04 -0.50 -4.71 113.70 109.48 1i33 s SER 224 Ca 0.65 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.96 1i33 s SER 224 Cb -0.21 0.27 0.04 0.00 0.10 0.00 0.00 66.02 66.23 1i33 s SER 224 CO 0.58 -0.47 0.89 0.42 0.98 0.00 0.00 173.24 175.64 1i33 s THR 225 N -2.77 2.72 -0.30 2.02 -4.23 -1.26 -1.02 115.64 110.79 1i33 s THR 225 Ca 0.09 -0.39 -0.13 0.00 -1.18 0.00 0.00 61.69 60.08 1i33 s THR 225 Cb -0.00 -3.09 0.14 0.00 1.34 0.00 0.00 72.50 70.89 1i33 s THR 225 CO -0.05 -0.08 0.84 0.28 -0.54 0.00 0.00 174.62 175.07 1i33 s THR 226 N -2.99 -0.61 -0.84 3.99 -1.32 -1.26 -4.66 115.64 107.96 1i33 s THR 226 Ca 0.57 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 61.26 1i33 s THR 226 Cb -0.11 -1.00 0.19 0.00 -1.51 0.00 0.00 72.50 70.08 1i33 s THR 226 CO 0.42 0.00 1.65 0.61 -2.21 0.00 0.00 174.62 175.09 1i33 n GLY 227 N 4.99 -1.24 0.39 6.08 0.00 -1.26 -3.70 105.19 110.45 1i33 n GLY 227 Ca -0.12 -0.02 0.36 0.00 0.00 0.00 0.00 46.02 46.24 1i33 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i33 h ALA 228 N 2.53 2.47 0.03 4.61 0.00 -1.94 0.67 119.26 127.63 1i33 h ALA 228 Ca 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1i33 h ALA 228 Cb 0.38 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1i33 h ALA 228 CO 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 179.25 178.02 1i33 h ALA 229 N 1.82 -0.45 -1.11 0.00 0.00 -1.90 -2.93 119.26 114.69 1i33 h ALA 229 Ca 0.86 -0.01 0.31 0.00 0.00 0.00 0.00 54.91 56.07 1i33 h ALA 229 Cb 2.51 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 20.22 1i33 h ALA 229 CO -0.63 -0.45 0.71 1.57 0.00 0.00 0.00 179.25 180.45 1i33 h LYS 230 N -0.09 0.30 -0.71 0.00 2.10 -1.38 0.32 116.57 117.11 1i33 h LYS 230 Ca -0.00 -0.02 0.03 0.00 -2.00 0.00 0.00 60.65 58.66 1i33 h LYS 230 Cb 0.03 -0.07 -0.04 0.00 -0.90 0.00 0.00 32.23 31.26 1i33 h LYS 230 CO 0.01 0.20 0.47 0.00 -2.00 0.00 0.00 179.45 178.12 1i33 h ALA 231 N 1.62 1.57 0.00 0.07 0.00 0.24 0.22 119.26 122.99 1i33 h ALA 231 Ca 0.65 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1i33 h ALA 231 Cb 1.78 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1i33 h ALA 231 CO -0.33 0.36 0.13 -0.24 0.00 0.00 0.00 179.25 179.17 1i33 h VAL 232 N 0.88 0.00 -0.41 0.00 3.04 -0.17 0.12 116.25 119.71 1i33 h VAL 232 Ca 0.28 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.85 1i33 h VAL 232 Cb 0.03 0.64 -0.01 0.00 -2.01 0.00 0.00 31.29 29.93 1i33 h VAL 232 CO -0.08 0.00 -0.22 1.23 -1.01 0.00 0.00 177.57 177.50 1i33 h GLY 233 N 0.00 0.87 2.00 3.17 0.00 -0.63 0.16 103.07 108.64 1i33 h GLY 233 Ca 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 47.33 46.52 1i33 h GLY 233 CO 0.00 0.68 -0.33 -0.33 0.00 0.00 0.00 176.54 176.56 1i33 h MET 234 N 0.70 0.00 0.05 4.80 2.86 -0.88 -1.79 114.93 120.68 1i33 h MET 234 Ca 0.10 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.42 1i33 h MET 234 Cb 0.74 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.36 1i33 h MET 234 CO 0.06 0.33 -1.80 0.28 1.06 0.00 0.00 176.91 176.83 1i33 h VAL 235 N 0.00 0.78 -2.91 -2.22 2.07 -1.52 -3.42 116.25 109.03 1i33 h VAL 235 Ca -0.00 -2.58 -0.61 0.00 0.82 0.00 0.00 66.70 64.32 1i33 h VAL 235 Cb 0.67 2.47 -0.41 0.00 -1.52 0.00 0.00 31.29 32.50 1i33 h VAL 235 CO 0.04 0.65 -0.71 -0.63 0.02 0.00 0.00 177.57 176.94 1i33 s ILE 236 N -2.59 1.94 0.26 4.57 1.01 0.53 -4.80 121.20 122.14 1i33 s ILE 236 Ca -0.11 -3.46 -0.08 0.00 0.00 0.00 0.00 60.65 57.01 1i33 s ILE 236 Cb 0.07 -2.31 0.43 0.00 0.01 0.00 0.00 42.46 40.67 1i33 s ILE 236 CO 0.81 -1.02 1.48 -2.65 0.00 0.00 0.00 174.94 173.55 1i33 n PRO 237 N 2.59 -0.09 0.00 2.79 -0.02 -0.69 -1.22 135.00 138.37 1i33 n PRO 237 Ca 0.19 1.48 0.00 0.00 -2.02 0.00 0.00 63.50 63.14 1i33 n PRO 237 Cb 0.38 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1i33 n PRO 237 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1i33 n SER 238 N -5.54 0.00 -0.24 2.55 3.41 -1.26 -1.24 113.62 111.30 1i33 n SER 238 Ca 0.15 0.07 0.04 0.00 -0.26 0.00 0.00 58.87 58.87 1i33 n SER 238 Cb 0.47 -0.07 0.08 0.00 -0.26 0.00 0.00 64.21 64.44 1i33 n SER 238 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1i33 n THR 239 N -1.01 1.26 -1.96 6.66 -2.24 -0.36 -4.95 114.28 111.68 1i33 n THR 239 Ca 0.00 -1.29 -0.41 0.00 -2.27 0.00 0.00 64.05 60.08 1i33 n THR 239 Cb 0.01 0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 68.53 1i33 n THR 239 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1i33 s LYS 240 N -1.47 4.24 0.00 -0.78 -0.14 -0.38 -1.85 119.74 119.36 1i33 s LYS 240 Ca 0.14 2.37 0.00 0.00 -1.36 0.00 0.00 55.97 57.13 1i33 s LYS 240 Cb 0.10 -3.06 0.00 0.00 -1.68 0.00 0.00 37.83 33.19 1i33 s LYS 240 CO 0.05 -0.42 0.00 0.41 -0.76 0.00 0.00 175.35 174.63 1i33 n GLY 241 N 1.61 0.37 0.04 -3.33 0.00 -1.26 -4.75 105.19 97.88 1i33 n GLY 241 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 1i33 n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i33 n LYS 242 N -1.74 0.82 -4.36 1.61 5.02 -0.77 -5.00 118.16 113.74 1i33 n LYS 242 Ca 0.00 -0.10 -0.28 0.00 -2.02 0.00 0.00 58.31 55.91 1i33 n LYS 242 Cb 0.06 -1.45 -0.11 0.00 -0.02 0.00 0.00 35.03 33.50 1i33 n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1i33 s LEU 243 N -4.75 2.60 -0.19 -0.35 1.02 -1.19 -0.77 118.68 115.05 1i33 s LEU 243 Ca -0.08 -0.72 -0.31 0.00 0.02 0.00 0.00 54.13 53.04 1i33 s LEU 243 Cb 0.09 -1.36 0.15 0.00 0.02 0.00 0.00 46.19 45.08 1i33 s LEU 243 CO 0.76 0.14 1.13 0.28 0.02 0.00 0.00 176.35 178.67 1i33 s THR 244 N -1.48 0.00 0.32 5.49 -1.32 -1.08 -3.96 115.64 113.60 1i33 s THR 244 Ca 0.20 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.49 1i33 s THR 244 Cb -0.09 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.94 1i33 s THR 244 CO 0.11 0.00 0.76 -0.83 -2.21 0.00 0.00 174.62 172.44 1i33 s GLY 245 N -1.42 0.08 0.31 6.08 0.00 -1.26 -1.43 107.32 109.69 1i33 s GLY 245 Ca 0.04 -0.47 0.03 0.00 0.00 0.00 0.00 44.72 44.32 1i33 s GLY 245 CO -0.03 -0.13 0.08 -3.16 0.00 0.00 0.00 173.10 169.85 1i33 s MET 246 N -3.26 1.61 0.15 2.90 0.23 -0.68 -3.99 119.30 116.25 1i33 s MET 246 Ca 0.13 -1.89 0.06 0.00 -1.03 0.00 0.00 55.69 52.95 1i33 s MET 246 Cb -0.05 -0.67 -0.04 0.00 -1.53 0.00 0.00 34.83 32.53 1i33 s MET 246 CO 0.09 -0.24 -0.13 0.45 -2.03 0.00 0.00 175.02 173.15 1i33 s SER 247 N -3.45 2.06 -0.28 -1.18 0.15 -0.19 -1.71 113.70 109.11 1i33 s SER 247 Ca 0.36 -0.92 -0.00 0.00 0.70 0.00 0.00 55.95 56.08 1i33 s SER 247 Cb 0.08 -0.07 0.09 0.00 -1.71 0.00 0.00 66.02 64.41 1i33 s SER 247 CO 0.15 -0.21 0.06 -0.36 1.20 0.00 0.00 173.24 174.08 1i33 s PHE 248 N -2.69 1.89 -0.05 3.44 0.08 0.31 -1.40 117.98 119.55 1i33 s PHE 248 Ca 0.14 -1.70 -0.30 0.00 0.12 0.00 0.00 56.93 55.20 1i33 s PHE 248 Cb -0.02 -1.68 -0.04 0.00 -0.57 0.00 0.00 43.02 40.72 1i33 s PHE 248 CO 0.03 -0.82 1.31 1.03 -0.10 0.00 0.00 175.22 176.67 1i33 s ARG 249 N 1.56 4.30 0.17 0.44 1.81 0.64 -1.15 118.95 126.73 1i33 s ARG 249 Ca 0.05 1.81 0.07 0.00 -1.72 0.00 0.00 55.73 55.95 1i33 s ARG 249 Cb -0.18 -3.61 -0.04 0.00 -0.45 0.00 0.00 34.95 30.67 1i33 s ARG 249 CO -0.17 -0.55 -0.15 0.14 -0.68 0.00 0.00 175.30 173.88 1i33 s VAL 250 N 2.56 1.65 0.00 3.52 -7.23 0.27 -0.06 120.40 121.10 1i33 s VAL 250 Ca 0.60 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 1i33 s VAL 250 Cb -0.27 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.79 1i33 s VAL 250 CO 0.23 -0.49 0.15 -2.65 -0.31 0.00 0.00 175.10 172.03 1i33 n PRO 251 N 0.00 0.00 -4.42 4.82 -0.02 -1.26 -2.90 135.00 131.22 1i33 n PRO 251 Ca -0.11 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.17 1i33 n PRO 251 Cb 0.59 -0.96 -0.14 0.00 -0.02 0.00 0.00 33.50 32.97 1i33 n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1i33 s THR 252 N 1.22 0.92 0.20 3.45 -4.23 -1.26 -4.99 115.64 110.94 1i33 s THR 252 Ca 0.00 -0.65 0.33 0.00 -1.18 0.00 0.00 61.69 60.19 1i33 s THR 252 Cb 0.00 -0.80 0.37 0.00 1.34 0.00 0.00 72.50 73.41 1i33 s THR 252 CO 0.00 0.14 2.01 1.55 -0.54 0.00 0.00 174.62 177.79 1i33 h PRO 253 N 5.54 0.00 -2.09 3.99 0.13 -1.87 -1.67 132.00 136.03 1i33 h PRO 253 Ca -0.34 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.96 1i33 h PRO 253 Cb 1.18 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 1i33 h PRO 253 CO 0.47 0.04 0.57 0.34 -0.23 0.00 0.00 178.00 179.20 1i33 s ASP 254 N -5.75 -0.26 0.00 1.44 2.15 -1.26 -4.79 116.67 108.20 1i33 s ASP 254 Ca 0.00 -0.10 0.00 0.00 0.43 0.00 0.00 52.55 52.88 1i33 s ASP 254 Cb 0.10 0.35 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 1i33 s ASP 254 CO 0.55 -0.59 0.00 0.52 -0.17 0.00 0.00 175.17 175.47 1i33 n VAL 255 N -0.29 -1.48 -4.35 1.11 0.31 -1.26 -4.87 118.33 107.50 1i33 n VAL 255 Ca -0.07 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.08 1i33 n VAL 255 Cb 0.61 -1.48 -0.10 0.00 -0.91 0.00 0.00 33.84 31.96 1i33 n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1i33 s SER 256 N -0.43 2.13 0.03 4.52 0.01 0.11 -4.12 113.70 115.95 1i33 s SER 256 Ca 0.00 -1.17 0.05 0.00 1.31 0.00 0.00 55.95 56.14 1i33 s SER 256 Cb 0.00 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 1i33 s SER 256 CO 0.00 -0.42 -0.15 0.54 0.41 0.00 0.00 173.24 173.62 1i33 s VAL 257 N -3.27 1.19 -0.20 3.43 0.11 -0.57 -0.76 120.40 120.33 1i33 s VAL 257 Ca 0.27 -0.95 -0.04 0.00 -2.93 0.00 0.00 61.98 58.33 1i33 s VAL 257 Cb 0.04 -1.05 -0.02 0.00 -1.53 0.00 0.00 36.38 33.82 1i33 s VAL 257 CO 0.08 0.10 -0.02 -0.69 -3.33 0.00 0.00 175.10 171.24 1i33 s VAL 258 N -0.74 3.75 -0.57 2.04 1.01 0.18 -1.26 120.40 124.82 1i33 s VAL 258 Ca 0.03 -0.38 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 1i33 s VAL 258 Cb -0.07 -2.69 0.15 0.00 0.00 0.00 0.00 36.38 33.76 1i33 s VAL 258 CO 0.01 0.43 0.39 -0.62 0.00 0.00 0.00 175.10 175.31 1i33 s ASP 259 N 1.10 5.35 -0.21 3.32 2.15 0.75 -1.17 116.67 127.95 1i33 s ASP 259 Ca 0.02 -2.57 -0.14 0.00 0.43 0.00 0.00 52.55 50.29 1i33 s ASP 259 Cb -0.14 -1.88 -0.04 0.00 -0.30 0.00 0.00 42.92 40.56 1i33 s ASP 259 CO 0.01 -0.45 0.33 -0.22 -0.17 0.00 0.00 175.17 174.67 1i33 s LEU 260 N 0.36 4.15 -0.18 -1.34 2.96 -0.16 -1.05 118.68 123.43 1i33 s LEU 260 Ca 0.14 0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 54.44 1i33 s LEU 260 Cb -0.21 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.07 1i33 s LEU 260 CO -0.04 -0.03 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.98 1i33 s THR 261 N 1.21 3.19 0.14 3.68 2.01 -0.71 0.35 115.64 125.51 1i33 s THR 261 Ca 0.16 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.44 1i33 s THR 261 Cb -0.14 -2.40 0.02 0.00 0.01 0.00 0.00 72.50 69.99 1i33 s THR 261 CO 0.07 0.48 0.37 0.72 -0.69 0.00 0.00 174.62 175.57 1i33 s PHE 262 N 0.91 -0.04 -0.16 4.92 -0.71 -0.31 -0.90 117.98 121.70 1i33 s PHE 262 Ca -0.02 -0.31 -0.04 0.00 -1.04 0.00 0.00 56.93 55.53 1i33 s PHE 262 Cb -0.15 0.19 -0.03 0.00 -1.21 0.00 0.00 43.02 41.82 1i33 s PHE 262 CO 0.00 -0.72 -0.04 0.50 -1.34 0.00 0.00 175.22 173.62 1i33 s ARG 263 N -3.85 3.64 0.91 1.99 3.52 -0.88 -1.39 118.95 122.89 1i33 s ARG 263 Ca 0.06 -0.53 -0.13 0.00 -0.13 0.00 0.00 55.73 55.01 1i33 s ARG 263 Cb 0.02 -2.91 0.14 0.00 -1.56 0.00 0.00 34.95 30.63 1i33 s ARG 263 CO -0.08 0.21 1.16 0.00 -0.81 0.00 0.00 175.30 175.77 1i33 s ALA 264 N 0.44 1.91 -0.08 6.12 0.00 -0.42 -1.35 121.76 128.38 1i33 s ALA 264 Ca -0.04 -0.61 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 1i33 s ALA 264 Cb -0.14 -3.00 -0.28 0.00 0.00 0.00 0.00 23.12 19.70 1i33 s ALA 264 CO 0.03 -2.24 0.52 1.15 0.00 0.00 0.00 175.76 175.23 1i33 h THR 265 N -1.47 0.78 -2.13 0.00 2.02 -1.48 -3.41 112.91 107.23 1i33 h THR 265 Ca -0.49 -2.44 -0.59 0.00 0.77 0.00 0.00 66.41 63.66 1i33 h THR 265 Cb 1.32 2.63 -0.14 0.00 -1.74 0.00 0.00 68.15 70.23 1i33 h THR 265 CO 0.60 0.87 -0.69 0.00 0.37 0.00 0.00 175.52 176.68 1i33 s ARG 266 N -2.57 1.74 0.31 6.66 1.70 -1.26 -5.07 118.95 120.47 1i33 s ARG 266 Ca -0.19 -1.89 -0.29 0.00 -0.47 0.00 0.00 55.73 52.90 1i33 s ARG 266 Cb 0.06 -1.59 -0.10 0.00 -0.57 0.00 0.00 34.95 32.75 1i33 s ARG 266 CO 0.81 0.14 1.35 -0.51 -1.08 0.00 0.00 175.30 176.01 1i33 s ASP 267 N -3.56 6.71 0.02 -2.89 1.01 -1.26 -4.83 116.67 111.88 1i33 s ASP 267 Ca 0.31 2.70 -0.01 0.00 0.71 0.00 0.00 52.55 56.27 1i33 s ASP 267 Cb 0.02 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1i33 s ASP 267 CO 0.15 -0.60 0.04 1.07 0.21 0.00 0.00 175.17 176.04 1i33 n THR 268 N 1.23 0.00 -4.17 -1.27 5.66 -0.83 -5.07 114.28 109.83 1i33 n THR 268 Ca 0.02 -0.06 -0.11 0.00 -3.05 0.00 0.00 64.05 60.85 1i33 n THR 268 Cb 0.41 0.06 -0.10 0.00 -1.55 0.00 0.00 70.33 69.15 1i33 n THR 268 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1i33 s SER 269 N -1.12 1.07 0.47 1.09 1.04 -1.26 -4.08 113.70 110.91 1i33 s SER 269 Ca 0.01 -1.03 0.16 0.00 0.48 0.00 0.00 55.95 55.57 1i33 s SER 269 Cb -0.00 0.11 1.12 0.00 0.10 0.00 0.00 66.02 67.35 1i33 s SER 269 CO 0.01 -0.50 2.04 -0.29 0.98 0.00 0.00 173.24 175.48 1i33 h ILE 270 N 2.95 1.04 -0.25 -1.02 6.09 -1.93 -1.97 117.51 122.42 1i33 h ILE 270 Ca -0.35 -0.47 -0.10 0.00 -1.37 0.00 0.00 64.86 62.57 1i33 h ILE 270 Cb 1.17 1.26 -0.00 0.00 0.47 0.00 0.00 36.82 39.71 1i33 h ILE 270 CO 0.64 0.13 -0.23 1.56 -3.07 0.00 0.00 178.15 177.19 1i33 h GLN 271 N 0.00 0.60 -0.45 2.19 7.50 -1.97 -0.24 115.11 122.74 1i33 h GLN 271 Ca -0.00 -0.31 0.08 0.00 0.50 0.00 0.00 58.65 58.92 1i33 h GLN 271 Cb 0.25 0.01 -0.06 0.00 0.05 0.00 0.00 27.48 27.72 1i33 h GLN 271 CO 0.02 0.90 0.06 0.93 -1.50 0.00 0.00 178.83 179.24 1i33 h GLU 272 N 0.31 0.18 -0.27 1.46 5.08 -1.78 0.49 114.58 120.05 1i33 h GLU 272 Ca 0.04 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1i33 h GLU 272 Cb 0.78 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1i33 h GLU 272 CO 0.06 0.12 0.15 0.82 -1.00 0.00 0.00 179.01 179.16 1i33 h ILE 273 N 0.19 1.11 -0.73 3.13 2.04 -1.35 -0.08 117.51 121.83 1i33 h ILE 273 Ca 0.22 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.84 1i33 h ILE 273 Cb 0.30 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1i33 h ILE 273 CO -0.31 0.11 0.43 -0.78 0.00 0.00 0.00 178.15 177.60 1i33 h ASP 274 N 0.33 0.68 -0.35 1.72 3.58 -0.19 -0.92 116.42 121.26 1i33 h ASP 274 Ca 0.10 0.02 -0.16 0.00 0.42 0.00 0.00 57.03 57.40 1i33 h ASP 274 Cb 0.05 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 40.97 1i33 h ASP 274 CO -0.02 0.45 -0.42 0.11 -2.88 0.00 0.00 179.24 176.48 1i33 h LYS 275 N 0.81 0.90 -0.82 0.28 1.57 -0.69 -2.81 116.57 115.81 1i33 h LYS 275 Ca 0.31 -0.50 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1i33 h LYS 275 Cb 0.13 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 1i33 h LYS 275 CO -0.16 1.15 0.49 0.00 -0.57 0.00 0.00 179.45 180.36 1i33 h ALA 276 N 0.74 1.31 -0.04 3.86 0.00 -0.48 0.34 119.26 124.98 1i33 h ALA 276 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1i33 h ALA 276 Cb 1.02 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1i33 h ALA 276 CO 0.10 0.59 -0.02 0.82 0.00 0.00 0.00 179.25 180.74 1i33 h ILE 277 N 1.14 1.33 -0.30 0.00 2.04 -1.13 -1.58 117.51 119.01 1i33 h ILE 277 Ca 0.30 -1.02 0.03 0.00 1.00 0.00 0.00 64.86 65.17 1i33 h ILE 277 Cb -0.03 1.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1i33 h ILE 277 CO -0.05 0.27 0.12 0.11 0.00 0.00 0.00 178.15 178.60 1i33 h LYS 278 N -0.32 0.26 -0.68 2.37 1.57 -1.33 0.31 116.57 118.75 1i33 h LYS 278 Ca 0.01 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1i33 h LYS 278 Cb 0.45 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1i33 h LYS 278 CO 0.01 0.17 0.37 -0.22 -0.57 0.00 0.00 179.45 179.21 1i33 h LYS 279 N 0.27 0.65 -0.36 3.15 3.11 -0.93 -0.65 116.57 121.80 1i33 h LYS 279 Ca 0.13 -0.04 -0.13 0.00 -2.81 0.00 0.00 60.65 57.80 1i33 h LYS 279 Cb 0.08 -0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 31.15 1i33 h LYS 279 CO -0.12 0.43 -0.29 0.00 -2.81 0.00 0.00 179.45 176.66 1i33 h ALA 280 N 1.37 0.80 0.00 5.00 0.00 -0.55 -2.64 119.26 123.23 1i33 h ALA 280 Ca 0.31 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1i33 h ALA 280 Cb 0.23 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1i33 h ALA 280 CO -0.20 0.65 -0.09 0.00 0.00 0.00 0.00 179.25 179.60 1i33 h ALA 281 N 1.00 1.30 -0.02 0.00 0.00 0.65 0.15 119.26 122.35 1i33 h ALA 281 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i33 h ALA 281 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1i33 h ALA 281 CO 0.07 0.12 -0.10 1.04 0.00 0.00 0.00 179.25 180.38 1i33 n GLN 282 N -3.64 1.76 0.00 0.00 6.02 -0.35 -2.86 117.38 118.31 1i33 n GLN 282 Ca -0.02 -1.29 0.00 0.00 -0.01 0.00 0.00 57.00 55.68 1i33 n GLN 282 Cb 0.21 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.00 1i33 n GLN 282 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1i33 n THR 283 N 0.51 0.00 0.60 5.09 -2.24 -0.58 -4.77 114.28 112.88 1i33 n THR 283 Ca 0.15 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.98 1i33 n THR 283 Cb 0.47 0.00 0.31 0.00 -2.10 0.00 0.00 70.33 69.00 1i33 n THR 283 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i33 n TYR 284 N 0.00 0.00 0.13 4.78 4.11 -1.21 -2.17 117.16 122.80 1i33 n TYR 284 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 57.92 1i33 n TYR 284 Cb 0.00 -0.21 0.02 0.00 -0.00 0.00 0.00 39.34 39.15 1i33 n TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.86 175.53 1i33 n MET 285 N -1.21 -0.25 -1.73 -3.48 2.81 -0.06 -5.00 117.12 108.21 1i33 n MET 285 Ca 0.06 -0.78 -0.42 0.00 -1.81 0.00 0.00 57.70 54.75 1i33 n MET 285 Cb 0.08 -1.07 -0.02 0.00 -0.71 0.00 0.00 33.22 31.50 1i33 n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1i33 n LYS 286 N 0.17 2.62 0.00 0.03 4.81 -0.92 0.19 118.16 125.05 1i33 n LYS 286 Ca 0.02 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.40 1i33 n LYS 286 Cb 0.10 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.44 1i33 n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i33 n GLY 287 N 2.65 2.92 0.27 3.14 0.00 -1.26 -4.76 105.19 108.15 1i33 n GLY 287 Ca 0.11 -0.44 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 1i33 n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1i33 n ILE 288 N 0.00 1.18 -4.04 -0.61 2.08 -0.37 -4.35 119.36 113.25 1i33 n ILE 288 Ca 0.00 -0.34 -0.31 0.00 0.56 0.00 0.00 62.75 62.66 1i33 n ILE 288 Cb 0.00 -1.65 -0.16 0.00 -0.75 0.00 0.00 39.64 37.09 1i33 n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1i33 s LEU 289 N -6.92 2.32 0.00 1.39 1.98 0.13 -0.86 118.68 116.72 1i33 s LEU 289 Ca -0.29 -0.84 0.01 0.00 -2.89 0.00 0.00 54.13 50.11 1i33 s LEU 289 Cb 0.10 -1.32 0.01 0.00 0.66 0.00 0.00 46.19 45.64 1i33 s LEU 289 CO 0.40 -0.11 0.08 0.61 -1.89 0.00 0.00 176.35 175.44 1i33 n GLY 290 N 4.65 3.43 2.36 7.98 0.00 0.09 -4.25 105.19 119.45 1i33 n GLY 290 Ca -0.16 -2.35 -0.12 0.00 0.00 0.00 0.00 46.02 43.39 1i33 n GLY 290 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1i33 n PHE 291 N -1.30 -0.93 -3.64 1.61 -1.74 -1.26 0.11 117.46 110.32 1i33 n PHE 291 Ca -0.16 -1.81 -0.09 0.00 -0.56 0.00 0.00 57.45 54.83 1i33 n PHE 291 Cb 0.60 0.32 -0.07 0.00 1.52 0.00 0.00 39.48 41.86 1i33 n PHE 291 CO 0.00 0.00 0.00 -0.08 -0.56 0.00 0.00 176.76 176.12 1i33 s THR 292 N -2.81 0.00 -2.31 1.97 -1.32 -0.79 -4.85 115.64 105.55 1i33 s THR 292 Ca 0.24 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.94 1i33 s THR 292 Cb 0.00 -1.00 0.49 0.00 -1.51 0.00 0.00 72.50 70.48 1i33 s THR 292 CO 0.17 0.00 1.45 0.47 -2.21 0.00 0.00 174.62 174.50 1i33 n ASP 293 N 2.93 3.35 -4.92 8.08 8.00 -1.26 -2.46 116.55 130.28 1i33 n ASP 293 Ca -0.15 -1.97 -0.28 0.00 0.71 0.00 0.00 54.79 53.10 1i33 n ASP 293 Cb 0.56 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 1i33 n ASP 293 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1i33 s GLU 294 N -1.39 3.58 -1.21 -1.24 2.02 -1.26 -4.72 118.70 114.47 1i33 s GLU 294 Ca 0.40 -0.16 -0.15 0.00 0.02 0.00 0.00 54.97 55.08 1i33 s GLU 294 Cb 0.23 -2.73 -0.05 0.00 0.10 0.00 0.00 34.13 31.67 1i33 s GLU 294 CO 0.31 0.29 2.23 0.39 0.02 0.00 0.00 175.26 178.50 1i33 n GLU 295 N -0.86 2.48 -2.31 1.61 -0.58 -1.26 -4.85 120.64 114.86 1i33 n GLU 295 Ca -0.03 -2.17 -0.25 0.00 -0.42 0.00 0.00 57.16 54.28 1i33 n GLU 295 Cb 0.54 -3.00 0.06 0.00 -0.57 0.00 0.00 31.44 28.46 1i33 n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1i33 s LEU 296 N 1.33 2.97 0.10 -4.62 1.43 -1.26 -5.11 118.68 113.53 1i33 s LEU 296 Ca 0.53 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.07 1i33 s LEU 296 Cb 0.14 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 1i33 s LEU 296 CO -0.02 -1.42 -0.03 0.68 0.23 0.00 0.00 176.35 175.80 1i33 s VAL 297 N -3.12 0.48 0.13 -1.59 -7.23 -1.26 -5.03 120.40 102.79 1i33 s VAL 297 Ca 0.58 -1.90 -0.19 0.00 -1.81 0.00 0.00 61.98 58.66 1i33 s VAL 297 Cb -0.11 -1.75 0.03 0.00 0.56 0.00 0.00 36.38 35.12 1i33 s VAL 297 CO 0.44 -0.80 1.11 -1.54 -0.31 0.00 0.00 175.10 174.00 1i33 n SER 298 N -0.04 -0.65 -0.35 4.85 3.41 -1.26 0.13 113.62 119.72 1i33 n SER 298 Ca -0.11 1.27 0.23 0.00 -0.26 0.00 0.00 58.87 60.00 1i33 n SER 298 Cb 0.62 -0.21 0.48 0.00 -0.26 0.00 0.00 64.21 64.83 1i33 n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i33 h ALA 299 N 0.59 2.08 0.00 7.33 0.00 -1.97 0.61 119.26 127.91 1i33 h ALA 299 Ca 0.16 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1i33 h ALA 299 Cb 0.34 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1i33 h ALA 299 CO -0.69 -0.59 0.00 -0.25 0.00 0.00 0.00 179.25 177.72 1i33 n ASP 300 N -4.82 0.13 -0.77 0.00 8.00 0.12 -1.81 116.55 117.41 1i33 n ASP 300 Ca 0.29 0.55 0.08 0.00 0.71 0.00 0.00 54.79 56.42 1i33 n ASP 300 Cb 0.92 -0.57 0.15 0.00 -0.02 0.00 0.00 41.12 41.60 1i33 n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1i33 n PHE 301 N -1.67 0.36 -1.80 1.24 3.72 0.21 -4.94 117.46 114.59 1i33 n PHE 301 Ca 0.01 -0.28 -0.41 0.00 -0.05 0.00 0.00 57.45 56.71 1i33 n PHE 301 Cb 0.06 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 38.58 1i33 n PHE 301 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1i33 s ILE 302 N -1.12 2.07 -1.37 4.37 1.01 -0.75 -1.47 121.20 123.94 1i33 s ILE 302 Ca 0.26 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.98 1i33 s ILE 302 Cb 0.15 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.58 1i33 s ILE 302 CO 0.21 0.01 0.00 0.59 0.00 0.00 0.00 174.94 175.75 1i33 n ASN 303 N 1.30 -4.72 -4.49 3.58 3.02 -1.26 -4.95 115.26 107.74 1i33 n ASN 303 Ca 0.04 0.32 -0.43 0.00 -0.03 0.00 0.00 54.58 54.48 1i33 n ASN 303 Cb 0.38 -3.35 -0.04 0.00 -0.61 0.00 0.00 39.78 36.16 1i33 n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1i33 s ASP 304 N -2.78 6.27 0.00 6.41 -1.08 -0.54 -4.91 116.67 120.04 1i33 s ASP 304 Ca 0.00 -0.62 0.11 0.00 -0.52 0.00 0.00 52.55 51.52 1i33 s ASP 304 Cb 0.00 -2.41 0.64 0.00 -1.46 0.00 0.00 42.92 39.69 1i33 s ASP 304 CO 0.00 -1.24 1.30 -0.46 0.52 0.00 0.00 175.17 175.28 1i33 n ASN 305 N 7.36 0.00 -4.76 -0.34 2.04 -1.26 -4.09 115.26 114.21 1i33 n ASN 305 Ca -0.01 -1.37 -0.41 0.00 -0.44 0.00 0.00 54.58 52.35 1i33 n ASN 305 Cb 0.47 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.68 1i33 n ASN 305 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1i33 s ARG 306 N -2.00 4.55 0.30 -3.83 3.00 -1.26 -4.60 118.95 115.10 1i33 s ARG 306 Ca 0.16 1.91 -0.01 0.00 0.00 0.00 0.00 55.73 57.78 1i33 s ARG 306 Cb 0.07 -3.18 0.45 0.00 0.00 0.00 0.00 34.95 32.30 1i33 s ARG 306 CO 0.12 0.06 1.93 0.77 0.00 0.00 0.00 175.30 178.18 1i33 h SER 307 N 4.06 0.88 -2.89 0.23 0.02 -1.20 -3.43 113.55 111.22 1i33 h SER 307 Ca -0.47 -0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.28 1i33 h SER 307 Cb 1.21 -0.22 -0.29 0.00 0.14 0.00 0.00 62.40 63.25 1i33 h SER 307 CO 0.68 0.69 -0.40 -0.55 -1.14 0.00 0.00 176.83 176.12 1i33 s SER 308 N -6.40 -0.20 -0.39 3.07 0.15 -0.66 -4.17 113.70 105.10 1i33 s SER 308 Ca -0.11 0.82 0.00 0.00 0.70 0.00 0.00 55.95 57.37 1i33 s SER 308 Cb 0.17 0.93 0.11 0.00 -1.71 0.00 0.00 66.02 65.52 1i33 s SER 308 CO 0.79 -0.21 0.15 0.54 1.20 0.00 0.00 173.24 175.71 1i33 s VAL 309 N 2.06 2.83 0.16 4.45 0.11 -0.38 -0.73 120.40 128.91 1i33 s VAL 309 Ca -0.04 -2.29 -0.34 0.00 -2.93 0.00 0.00 61.98 56.38 1i33 s VAL 309 Cb -0.11 -2.99 -0.14 0.00 -1.53 0.00 0.00 36.38 31.61 1i33 s VAL 309 CO -0.11 -0.67 1.49 0.00 -3.33 0.00 0.00 175.10 172.48 1i33 n TYR 310 N 4.32 2.10 -3.28 1.54 9.36 0.12 -1.59 117.16 129.73 1i33 n TYR 310 Ca 0.01 0.37 -0.46 0.00 3.32 0.00 0.00 57.90 61.14 1i33 n TYR 310 Cb 0.41 -2.48 -0.03 0.00 -0.63 0.00 0.00 39.34 36.60 1i33 n TYR 310 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1i33 s ASP 311 N 0.69 6.50 0.08 2.98 -1.08 0.45 -1.88 116.67 124.41 1i33 s ASP 311 Ca 0.77 -2.23 -0.34 0.00 -0.52 0.00 0.00 52.55 50.24 1i33 s ASP 311 Cb -0.72 -2.23 -0.17 0.00 -1.46 0.00 0.00 42.92 38.34 1i33 s ASP 311 CO 0.42 -0.75 1.60 -1.28 0.52 0.00 0.00 175.17 175.68 1i33 h SER 312 N 8.36 -1.04 -0.49 -0.34 0.87 -1.77 -0.94 113.55 118.19 1i33 h SER 312 Ca -0.07 0.07 0.07 0.00 -1.23 0.00 0.00 61.79 60.63 1i33 h SER 312 Cb 1.06 0.32 -0.06 0.00 -0.44 0.00 0.00 62.40 63.28 1i33 h SER 312 CO 0.90 -0.61 0.14 0.11 -0.53 0.00 0.00 176.83 176.85 1i33 h LYS 313 N -0.95 0.29 -0.33 2.24 1.79 -1.85 0.20 116.57 117.97 1i33 h LYS 313 Ca -0.07 -0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.40 1i33 h LYS 313 Cb 0.79 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.34 1i33 h LYS 313 CO 0.04 0.19 0.17 0.00 -1.08 0.00 0.00 179.45 178.77 1i33 h ALA 314 N 1.35 0.40 0.48 3.86 0.00 -1.89 -1.17 119.26 122.28 1i33 h ALA 314 Ca 0.24 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1i33 h ALA 314 Cb 0.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1i33 h ALA 314 CO -0.27 -0.21 -0.23 1.15 0.00 0.00 0.00 179.25 179.69 1i33 h THR 315 N 0.35 0.43 -0.99 0.00 2.02 -0.53 -2.67 112.91 111.52 1i33 h THR 315 Ca 0.13 -0.41 0.08 0.00 0.77 0.00 0.00 66.41 66.99 1i33 h THR 315 Cb 0.04 0.58 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 1i33 h THR 315 CO -0.09 0.06 0.63 -0.07 0.37 0.00 0.00 175.52 176.42 1i33 h LEU 316 N -0.92 0.98 -0.08 2.58 3.38 -0.62 -2.62 115.31 118.02 1i33 h LEU 316 Ca -0.07 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1i33 h LEU 316 Cb 0.59 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1i33 h LEU 316 CO 0.11 0.60 0.00 0.00 0.09 0.00 0.00 178.44 179.24 1i33 n GLN 317 N -4.55 0.11 -0.89 1.13 6.02 -0.45 -4.03 117.38 114.73 1i33 n GLN 317 Ca 0.16 0.16 0.03 0.00 -0.01 0.00 0.00 57.00 57.34 1i33 n GLN 317 Cb 0.23 -1.65 0.16 0.00 1.02 0.00 0.00 30.24 30.01 1i33 n GLN 317 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1i33 n ASN 318 N -1.85 1.90 -4.59 1.08 3.02 -0.99 -5.03 115.26 108.81 1i33 n ASN 318 Ca 0.05 -3.60 -0.25 0.00 -0.03 0.00 0.00 54.58 50.76 1i33 n ASN 318 Cb 0.34 -0.48 -0.09 0.00 -0.61 0.00 0.00 39.78 38.94 1i33 n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1i33 s ASN 319 N -3.11 4.02 0.21 6.41 0.01 -1.24 -4.92 114.94 116.32 1i33 s ASN 319 Ca 0.38 -1.01 -0.31 0.00 -0.71 0.00 0.00 52.86 51.22 1i33 s ASN 319 Cb 0.38 -0.49 -0.10 0.00 0.41 0.00 0.00 41.25 41.45 1i33 s ASN 319 CO -0.07 -0.16 1.52 -0.76 -1.51 0.00 0.00 177.10 176.11 1i33 s LEU 320 N -3.66 4.37 0.22 0.60 1.43 -1.26 -4.93 118.68 115.46 1i33 s LEU 320 Ca 0.33 2.66 -0.16 0.00 -1.03 0.00 0.00 54.13 55.93 1i33 s LEU 320 Cb -0.01 -3.61 0.24 0.00 0.03 0.00 0.00 46.19 42.85 1i33 s LEU 320 CO 0.18 -0.78 1.58 1.55 0.23 0.00 0.00 176.35 179.10 1i33 h PRO 321 N 5.94 -0.05 -0.09 1.29 0.13 -1.98 -2.87 132.00 134.36 1i33 h PRO 321 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1i33 h PRO 321 Cb 1.21 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1i33 h PRO 321 CO 0.85 -0.04 -0.02 0.41 -0.23 0.00 0.00 178.00 178.97 1i33 n GLY 322 N -1.49 4.63 3.73 1.56 0.00 -1.26 -5.00 105.19 107.37 1i33 n GLY 322 Ca 0.09 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 1i33 n GLY 322 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1i33 n GLU 323 N -1.12 1.30 0.00 1.61 4.07 -1.09 -4.97 120.64 120.45 1i33 n GLU 323 Ca 0.18 0.50 0.00 0.00 -0.06 0.00 0.00 57.16 57.78 1i33 n GLU 323 Cb 0.74 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 29.59 1i33 n GLU 323 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1i33 n LYS 324 N -1.54 3.61 0.00 5.31 5.02 -1.26 -4.51 118.16 124.79 1i33 n LYS 324 Ca 0.14 -0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1i33 n LYS 324 Cb 0.47 -0.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.96 1i33 n LYS 324 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1i33 n ARG 325 N -0.55 0.00 -2.91 1.97 5.12 -1.26 -1.96 116.66 117.07 1i33 n ARG 325 Ca 0.00 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.49 1i33 n ARG 325 Cb 0.02 -0.49 -0.04 0.00 -1.16 0.00 0.00 32.46 30.79 1i33 n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1i33 s PHE 326 N -1.00 2.80 0.18 -1.55 2.19 -1.26 -1.30 117.98 118.04 1i33 s PHE 326 Ca 0.00 -0.31 0.07 0.00 0.33 0.00 0.00 56.93 57.02 1i33 s PHE 326 Cb 0.00 -4.05 -0.04 0.00 -1.31 0.00 0.00 43.02 37.62 1i33 s PHE 326 CO 0.00 -1.39 -0.15 -0.06 1.83 0.00 0.00 175.22 175.45 1i33 s PHE 327 N 3.72 1.63 -0.09 10.12 0.08 -0.48 -4.78 117.98 128.18 1i33 s PHE 327 Ca 0.24 -0.57 0.03 0.00 0.12 0.00 0.00 56.93 56.75 1i33 s PHE 327 Cb -0.15 -0.79 0.01 0.00 -0.57 0.00 0.00 43.02 41.52 1i33 s PHE 327 CO 0.15 0.29 -0.17 0.21 -0.10 0.00 0.00 175.22 175.59 1i33 s LYS 328 N -3.33 2.30 -0.10 0.44 2.20 -1.26 -1.16 119.74 118.84 1i33 s LYS 328 Ca 0.18 -0.61 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 1i33 s LYS 328 Cb -0.02 -1.84 0.00 0.00 -1.51 0.00 0.00 37.83 34.46 1i33 s LYS 328 CO 0.05 0.05 -0.21 0.08 -0.36 0.00 0.00 175.35 174.97 1i33 s VAL 329 N 0.65 1.85 -0.13 4.02 1.01 0.16 -4.84 120.40 123.10 1i33 s VAL 329 Ca -0.14 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1i33 s VAL 329 Cb -0.16 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1i33 s VAL 329 CO 0.04 0.51 -0.02 -0.69 0.00 0.00 0.00 175.10 174.94 1i33 s VAL 330 N 0.51 4.08 -0.08 2.92 1.01 -1.26 -0.99 120.40 126.59 1i33 s VAL 330 Ca -0.16 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 1i33 s VAL 330 Cb -0.17 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.48 1i33 s VAL 330 CO 0.06 0.53 0.20 -0.55 0.00 0.00 0.00 175.10 175.34 1i33 s SER 331 N -0.08 -0.20 0.38 3.32 0.15 -0.32 -0.41 113.70 116.55 1i33 s SER 331 Ca 0.03 0.41 0.02 0.00 0.70 0.00 0.00 55.95 57.10 1i33 s SER 331 Cb -0.13 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 64.52 1i33 s SER 331 CO 0.02 -0.11 0.58 0.26 1.20 0.00 0.00 173.24 175.19 1i33 s TRP 332 N 0.65 3.30 -0.28 3.44 0.52 -0.62 0.50 118.94 126.46 1i33 s TRP 332 Ca -0.05 0.17 -0.24 0.00 0.02 0.00 0.00 56.10 56.01 1i33 s TRP 332 Cb -0.06 -2.08 0.12 0.00 -1.15 0.00 0.00 33.47 30.30 1i33 s TRP 332 CO -0.04 -0.10 1.00 1.52 0.02 0.00 0.00 176.95 179.35 1i33 s TYR 333 N -2.38 -0.51 -1.06 -1.98 1.13 0.06 -1.25 117.35 111.35 1i33 s TYR 333 Ca 0.44 1.23 -0.18 0.00 -1.41 0.00 0.00 57.07 57.15 1i33 s TYR 333 Cb -0.10 0.36 0.12 0.00 -1.10 0.00 0.00 41.96 41.24 1i33 s TYR 333 CO 0.36 -0.25 1.34 0.34 -2.51 0.00 0.00 175.55 174.82 1i33 s ASP 334 N 0.34 6.75 0.56 -0.18 -1.08 -1.26 0.04 116.67 121.83 1i33 s ASP 334 Ca 0.02 -2.25 0.44 0.00 -0.52 0.00 0.00 52.55 50.24 1i33 s ASP 334 Cb -0.05 -2.45 1.63 0.00 -1.46 0.00 0.00 42.92 40.59 1i33 s ASP 334 CO -0.06 -1.07 1.66 -0.55 0.52 0.00 0.00 175.17 175.67 1i33 h ASN 335 N 8.40 0.00 0.00 -0.34 -1.07 -1.90 -2.42 115.58 118.24 1i33 h ASN 335 Ca 0.24 0.00 -0.06 0.00 0.07 0.00 0.00 56.30 56.55 1i33 h ASN 335 Cb 0.96 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.20 1i33 h ASN 335 CO 1.24 0.00 -0.67 -0.33 0.07 0.00 0.00 177.43 177.74 1i33 h GLU 336 N 0.00 0.00 0.07 4.14 5.08 -1.97 -3.38 114.58 118.52 1i33 h GLU 336 Ca 0.76 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 59.11 1i33 h GLU 336 Cb 3.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.35 1i33 h GLU 336 CO -0.01 0.26 -0.04 2.35 -1.00 0.00 0.00 179.01 180.58 1i33 h TRP 337 N -1.00 -0.09 -0.37 4.33 -0.00 -1.83 -2.94 115.95 114.06 1i33 h TRP 337 Ca -0.09 -0.00 0.06 0.00 -0.00 0.00 0.00 58.89 58.86 1i33 h TRP 337 Cb 0.69 0.03 -0.09 0.00 -0.00 0.00 0.00 29.16 29.80 1i33 h TRP 337 CO -0.12 -0.06 -0.44 0.00 -0.00 0.00 0.00 178.44 177.82 1i33 h ALA 338 N -1.95 -0.49 -0.87 2.65 0.00 -1.60 -0.31 119.26 116.69 1i33 h ALA 338 Ca -0.01 0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.16 1i33 h ALA 338 Cb 0.08 0.90 -0.12 0.00 0.00 0.00 0.00 17.79 18.64 1i33 h ALA 338 CO 0.02 -0.89 0.34 -0.92 0.00 0.00 0.00 179.25 177.79 1i33 h TYR 339 N -0.36 0.55 -0.95 0.00 3.20 -1.70 0.16 116.97 117.87 1i33 h TYR 339 Ca 0.12 0.04 0.04 0.00 3.14 0.00 0.00 58.73 62.08 1i33 h TYR 339 Cb 0.59 -0.10 -0.06 0.00 1.54 0.00 0.00 36.73 38.70 1i33 h TYR 339 CO -0.61 -0.08 0.62 0.77 -1.64 0.00 0.00 178.16 177.22 1i33 h SER 340 N 0.35 1.02 -0.46 -2.11 0.02 -0.87 -1.79 113.55 109.71 1i33 h SER 340 Ca 0.54 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.38 1i33 h SER 340 Cb 1.01 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 1i33 h SER 340 CO -0.54 0.69 -0.13 0.45 -1.14 0.00 0.00 176.83 176.16 1i33 h HIS 341 N 1.18 1.00 -0.90 3.45 3.86 -0.30 -2.94 115.15 120.51 1i33 h HIS 341 Ca 0.39 -0.22 0.01 0.00 -1.16 0.00 0.00 60.37 59.38 1i33 h HIS 341 Cb 0.04 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.22 1i33 h HIS 341 CO -0.01 0.99 0.59 0.00 0.86 0.00 0.00 177.93 180.36 1i33 h ARG 342 N 0.73 1.18 -0.64 2.45 2.47 -0.80 0.15 114.38 119.92 1i33 h ARG 342 Ca 0.11 -0.07 0.08 0.00 -1.26 0.00 0.00 59.98 58.84 1i33 h ARG 342 Cb 0.68 -0.27 -0.07 0.00 -1.65 0.00 0.00 29.97 28.66 1i33 h ARG 342 CO 0.05 0.79 0.30 0.28 0.56 0.00 0.00 179.97 181.94 1i33 h VAL 343 N 1.22 0.85 -0.24 2.04 2.07 -1.20 0.58 116.25 121.57 1i33 h VAL 343 Ca 0.33 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1i33 h VAL 343 Cb -0.14 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 1i33 h VAL 343 CO -0.07 0.10 0.10 0.58 0.02 0.00 0.00 177.57 178.30 1i33 h VAL 344 N 0.53 1.16 -0.51 2.57 2.07 -1.17 -1.81 116.25 119.09 1i33 h VAL 344 Ca 0.31 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 67.40 1i33 h VAL 344 Cb 0.32 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 1i33 h VAL 344 CO -0.25 0.16 0.22 0.44 0.02 0.00 0.00 177.57 178.15 1i33 h ASP 345 N 0.24 0.26 -0.49 0.57 3.32 0.68 -1.06 116.42 119.95 1i33 h ASP 345 Ca 0.08 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.20 1i33 h ASP 345 Cb 0.16 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1i33 h ASP 345 CO -0.01 0.18 0.29 0.25 -1.72 0.00 0.00 179.24 178.23 1i33 h LEU 346 N 0.42 0.46 -0.52 1.55 5.85 0.38 0.94 115.31 124.37 1i33 h LEU 346 Ca 0.24 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1i33 h LEU 346 Cb 0.22 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1i33 h LEU 346 CO -0.21 0.32 0.34 0.58 -0.34 0.00 0.00 178.44 179.13 1i33 h VAL 347 N 0.57 1.14 -0.42 1.05 2.07 -0.69 -0.04 116.25 119.93 1i33 h VAL 347 Ca 0.20 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1i33 h VAL 347 Cb 0.03 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1i33 h VAL 347 CO -0.10 0.14 0.14 0.03 0.02 0.00 0.00 177.57 177.79 1i33 h ARG 348 N 0.71 0.66 0.37 1.57 3.08 -0.75 -0.29 114.38 119.72 1i33 h ARG 348 Ca 0.19 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1i33 h ARG 348 Cb -0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1i33 h ARG 348 CO -0.04 0.64 -0.42 -0.92 -1.07 0.00 0.00 179.97 178.17 1i33 h TYR 349 N 0.54 -1.16 -0.73 3.04 3.20 -0.36 0.16 116.97 121.66 1i33 h TYR 349 Ca 0.14 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.17 1i33 h TYR 349 Cb 0.26 0.46 -0.11 0.00 1.54 0.00 0.00 36.73 38.88 1i33 h TYR 349 CO 0.01 -0.54 0.20 0.52 -1.64 0.00 0.00 178.16 176.71 1i33 h MET 350 N -0.79 0.29 -0.17 1.82 2.86 -0.99 -0.53 114.93 117.42 1i33 h MET 350 Ca -0.05 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1i33 h MET 350 Cb 0.70 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 1i33 h MET 350 CO -0.08 0.19 -0.07 0.00 1.06 0.00 0.00 176.91 178.01 1i33 h ALA 351 N 1.59 0.08 -0.59 6.32 0.00 -0.38 0.91 119.26 127.19 1i33 h ALA 351 Ca 0.41 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.39 1i33 h ALA 351 Cb 0.69 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1i33 h ALA 351 CO -0.49 -0.50 0.35 0.00 0.00 0.00 0.00 179.25 178.61 1i33 h ALA 352 N 1.12 0.76 -0.13 0.00 0.00 0.49 -0.46 119.26 121.04 1i33 h ALA 352 Ca 0.09 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1i33 h ALA 352 Cb 0.18 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1i33 h ALA 352 CO -0.20 0.24 -0.61 -0.22 0.00 0.00 0.00 179.25 178.47 1i33 h LYS 353 N 0.80 0.64 0.00 0.00 3.64 -0.75 -0.86 116.57 120.04 1i33 h LYS 353 Ca 0.21 -0.51 -0.01 0.00 -1.27 0.00 0.00 60.65 59.07 1i33 h LYS 353 Cb -0.01 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1i33 h LYS 353 CO -0.04 1.13 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.80 1i33 h ASP 354 N 0.29 0.00 0.43 4.20 3.32 0.10 -1.46 116.42 123.30 1i33 h ASP 354 Ca -0.04 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.70 1i33 h ASP 354 Cb 1.24 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.82 1i33 h ASP 354 CO 0.13 0.04 -1.39 0.00 -1.72 0.00 0.00 179.24 176.29 1i33 h ALA 355 N 1.96 -0.03 -0.17 3.45 0.00 -0.96 -3.30 119.26 120.21 1i33 h ALA 355 Ca -0.00 -0.89 -0.01 0.00 0.00 0.00 0.00 54.91 54.01 1i33 h ALA 355 Cb 0.07 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1i33 h ALA 355 CO 0.00 0.84 0.05 0.00 0.00 0.00 0.00 179.25 180.15 1i33 h ALA 356 N 0.35 0.23 0.00 0.00 0.00 -0.31 -2.37 119.26 117.16 1i33 h ALA 356 Ca -0.21 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1i33 h ALA 356 Cb 2.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1i33 h ALA 356 CO 0.24 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 1i33 n SER 357 N -4.82 0.00 0.00 0.00 3.41 -0.63 -5.10 113.62 106.48 1i33 n SER 357 Ca -0.04 -1.31 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1i33 n SER 357 Cb 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1i33 n SER 357 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68