#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 0.53 -2.10 0.00 -0.02 -1.26 -4.87 135.00 127.28 1i33 n PRO 2 Ca 0.00 0.19 -0.43 0.00 -2.02 0.00 0.00 63.50 61.25 1i33 n PRO 2 Cb 0.00 -1.77 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 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 2.52 3.70 -0.57 4.25 1.01 -0.40 -4.73 121.20 126.97 1i33 s ILE 3 Ca 0.99 0.81 -0.27 0.00 0.00 0.00 0.00 60.65 62.18 1i33 s ILE 3 Cb -1.26 -3.65 0.03 0.00 0.01 0.00 0.00 42.46 37.59 1i33 s ILE 3 CO 0.69 -0.22 1.09 -0.54 0.00 0.00 0.00 174.94 175.97 1i33 s LYS 4 N 4.45 3.44 0.20 2.79 -0.14 -1.26 -0.63 119.74 128.59 1i33 s LYS 4 Ca 0.71 0.04 0.11 0.00 -1.36 0.00 0.00 55.97 55.47 1i33 s LYS 4 Cb -0.27 -4.03 -0.04 0.00 -1.68 0.00 0.00 37.83 31.80 1i33 s LYS 4 CO 0.28 -1.61 -0.19 0.14 -0.76 0.00 0.00 175.35 173.21 1i33 s VAL 5 N 4.57 2.62 -0.02 3.17 -7.23 -0.51 -0.65 120.40 122.34 1i33 s VAL 5 Ca 0.38 -1.98 0.01 0.00 -1.81 0.00 0.00 61.98 58.58 1i33 s VAL 5 Cb -0.09 -2.28 0.01 0.00 0.56 0.00 0.00 36.38 34.57 1i33 s VAL 5 CO 0.23 -0.16 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.99 1i33 s GLY 6 N -2.84 0.28 -0.28 2.32 0.00 -0.36 -0.74 107.32 105.70 1i33 s GLY 6 Ca 0.23 -0.09 -0.14 0.00 0.00 0.00 0.00 44.72 44.72 1i33 s GLY 6 CO 0.12 0.12 0.32 -0.42 0.00 0.00 0.00 173.10 173.24 1i33 s ILE 7 N 0.34 5.21 -0.35 0.90 -1.09 -0.38 -0.67 121.20 125.15 1i33 s ILE 7 Ca -0.04 0.44 -0.12 0.00 -2.23 0.00 0.00 60.65 58.70 1i33 s ILE 7 Cb -0.07 -3.66 0.00 0.00 -1.58 0.00 0.00 42.46 37.15 1i33 s ILE 7 CO -0.00 0.17 0.22 0.21 -1.23 0.00 0.00 174.94 174.30 1i33 s ASN 8 N 1.68 5.85 0.00 3.58 2.47 -0.23 0.30 114.94 128.58 1i33 s ASN 8 Ca 0.13 -0.66 0.00 0.00 0.42 0.00 0.00 52.86 52.74 1i33 s ASN 8 Cb -0.16 -2.08 0.00 0.00 -1.45 0.00 0.00 41.25 37.56 1i33 s ASN 8 CO 0.10 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 173.80 1i33 n GLY 9 N 5.06 -0.66 2.86 1.21 0.00 0.14 -1.34 105.19 112.46 1i33 n GLY 9 Ca -0.12 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 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 0.29 2.54 -2.34 1.61 7.35 -1.18 -3.98 117.46 121.75 1i33 n PHE 10 Ca 0.00 -2.66 0.00 0.00 -0.76 0.00 0.00 57.45 54.03 1i33 n PHE 10 Cb 0.00 -1.53 0.00 0.00 0.35 0.00 0.00 39.48 38.30 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 1.66 5.08 0.44 7.13 0.00 -1.26 -4.66 105.19 113.58 1i33 n GLY 11 Ca 0.37 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.40 0.18 1.61 2.47 -1.94 0.39 114.38 116.69 1i33 h ARG 12 Ca 0.00 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1i33 h ARG 12 Cb 0.00 0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 1i33 h ARG 12 CO 0.00 -0.27 -0.17 0.82 0.56 0.00 0.00 179.97 180.91 1i33 h ILE 13 N -0.42 0.61 -0.07 2.04 1.08 -1.91 -0.14 117.51 118.71 1i33 h ILE 13 Ca 0.06 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.57 1i33 h ILE 13 Cb 0.59 0.61 -0.06 0.00 -3.07 0.00 0.00 36.82 34.90 1i33 h ILE 13 CO -0.56 0.00 -0.40 1.23 -0.69 0.00 0.00 178.15 177.73 1i33 h GLY 14 N -0.38 -0.70 1.00 5.37 0.00 -1.50 0.21 103.07 107.07 1i33 h GLY 14 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1i33 h GLY 14 CO -0.04 -0.23 0.37 3.21 0.00 0.00 0.00 176.54 179.85 1i33 h ARG 15 N -0.52 0.76 -0.59 4.80 3.08 -0.18 -1.47 114.38 120.26 1i33 h ARG 15 Ca 0.06 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.17 1i33 h ARG 15 Cb 0.63 -0.17 -0.08 0.00 0.08 0.00 0.00 29.97 30.43 1i33 h ARG 15 CO -0.35 0.51 0.16 0.52 -1.07 0.00 0.00 179.97 179.75 1i33 h MET 16 N 0.78 0.30 -0.58 0.04 2.86 -0.43 0.59 114.93 118.49 1i33 h MET 16 Ca 0.21 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.79 1i33 h MET 16 Cb -0.07 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1i33 h MET 16 CO -0.04 0.20 0.18 0.28 1.06 0.00 0.00 176.91 178.59 1i33 h VAL 17 N 0.31 1.24 -0.05 -2.22 2.07 -0.59 0.23 116.25 117.24 1i33 h VAL 17 Ca 0.31 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1i33 h VAL 17 Cb 0.43 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1i33 h VAL 17 CO -0.36 0.30 0.02 0.15 0.02 0.00 0.00 177.57 177.70 1i33 h PHE 18 N 0.82 0.07 -0.35 1.57 3.57 -0.12 -1.17 116.94 121.32 1i33 h PHE 18 Ca 0.19 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1i33 h PHE 18 Cb 0.28 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1i33 h PHE 18 CO 0.02 0.19 0.24 1.96 -2.23 0.00 0.00 178.31 178.48 1i33 h GLN 19 N -0.07 0.31 -0.69 1.11 4.20 0.33 0.89 115.11 121.19 1i33 h GLN 19 Ca 0.02 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 1i33 h GLN 19 Cb 0.14 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1i33 h GLN 19 CO -0.00 0.21 0.26 0.00 -0.67 0.00 0.00 178.83 178.62 1i33 h ALA 20 N 1.80 0.90 -0.08 3.87 0.00 0.19 0.12 119.26 126.06 1i33 h ALA 20 Ca 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1i33 h ALA 20 Cb 0.18 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1i33 h ALA 20 CO -0.03 0.54 0.03 0.82 0.00 0.00 0.00 179.25 180.61 1i33 h ILE 21 N 1.00 1.17 -0.11 0.00 2.04 0.32 -2.42 117.51 119.51 1i33 h ILE 21 Ca 0.23 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1i33 h ILE 21 Cb 0.24 1.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1i33 h ILE 21 CO -0.02 0.15 0.04 0.00 0.00 0.00 0.00 178.15 178.33 1i33 h ASP 23 N 0.02 -0.13 0.00 0.00 3.58 -0.72 0.70 116.42 119.88 1i33 h ASP 23 Ca 0.04 0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1i33 h ASP 23 Cb 0.17 0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.45 1i33 h ASP 23 CO -0.00 -0.07 0.00 0.00 -2.88 0.00 0.00 179.24 176.28 1i33 n GLN 24 N -5.22 0.67 -2.19 0.28 6.02 -0.92 -4.85 117.38 111.17 1i33 n GLN 24 Ca 0.12 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.96 1i33 n GLN 24 Cb 0.41 -1.43 -0.01 0.00 1.02 0.00 0.00 30.24 30.23 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 0.31 -0.05 0.11 1.08 0.00 0.25 -4.90 105.19 101.98 1i33 n GLY 25 Ca 0.14 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.94 1i33 n GLY 25 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1i33 h LEU 26 N 0.00 0.00 -9.07 0.99 4.07 -1.59 -3.45 115.31 106.26 1i33 h LEU 26 Ca -0.35 0.00 -0.69 0.00 0.08 0.00 0.00 57.88 56.92 1i33 h LEU 26 Cb 1.23 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.98 1i33 h LEU 26 CO 0.42 0.35 1.07 0.00 -1.08 0.00 0.00 178.44 179.20 1i33 n ILE 27 N -2.82 0.37 0.00 1.22 0.13 -1.24 -1.78 119.36 115.24 1i33 n ILE 27 Ca -0.05 -0.11 0.00 0.00 -1.10 0.00 0.00 62.75 61.49 1i33 n ILE 27 Cb 0.72 -1.51 0.00 0.00 -0.84 0.00 0.00 39.64 38.01 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 4.74 2.45 0.00 4.50 0.00 0.23 -4.80 105.19 112.30 1i33 n GLY 28 Ca 0.28 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.08 2.61 -2.24 -0.97 -4.63 114.28 108.96 1i33 n THR 29 Ca 0.00 0.80 -0.17 0.00 -2.27 0.00 0.00 64.05 62.41 1i33 n THR 29 Cb 0.00 -1.63 -0.12 0.00 -2.10 0.00 0.00 70.33 66.47 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 0.00 -6.03 -0.78 4.39 -1.66 -3.40 114.58 107.09 1i33 h GLU 30 Ca 0.00 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 59.02 1i33 h GLU 30 Cb 0.00 0.00 -0.19 0.00 -0.10 0.00 0.00 28.75 28.46 1i33 h GLU 30 CO 0.00 1.00 -0.68 0.42 -1.16 0.00 0.00 179.01 178.59 1i33 s ILE 31 N -2.27 3.82 -0.46 3.13 1.01 -0.79 -1.28 121.20 124.37 1i33 s ILE 31 Ca -0.23 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.00 1i33 s ILE 31 Cb 0.00 -2.58 0.12 0.00 0.01 0.00 0.00 42.46 40.02 1i33 s ILE 31 CO 0.65 0.59 0.22 -0.62 0.00 0.00 0.00 174.94 175.78 1i33 s ASP 32 N -0.71 4.88 -0.81 3.58 -1.08 0.20 -0.60 116.67 122.12 1i33 s ASP 32 Ca 0.11 -2.49 -0.25 0.00 -0.52 0.00 0.00 52.55 49.40 1i33 s ASP 32 Cb -0.11 -1.73 -0.00 0.00 -1.46 0.00 0.00 42.92 39.62 1i33 s ASP 32 CO 0.02 -0.38 1.66 -0.69 0.52 0.00 0.00 175.17 176.30 1i33 s VAL 33 N 0.46 3.59 0.17 1.11 1.01 -1.26 -1.43 120.40 124.05 1i33 s VAL 33 Ca 0.13 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 1i33 s VAL 33 Cb -0.22 -4.43 0.06 0.00 0.00 0.00 0.00 36.38 31.80 1i33 s VAL 33 CO -0.04 -1.36 1.74 0.58 0.00 0.00 0.00 175.10 176.01 1i33 h VAL 34 N 6.78 1.21 -2.44 2.92 2.07 -1.27 -3.42 116.25 122.10 1i33 h VAL 34 Ca -0.06 -0.63 0.12 0.00 0.82 0.00 0.00 66.70 66.94 1i33 h VAL 34 Cb 1.06 0.59 -0.11 0.00 -1.52 0.00 0.00 31.29 31.31 1i33 h VAL 34 CO 1.28 0.25 0.44 0.00 0.02 0.00 0.00 177.57 179.55 1i33 s ALA 35 N -5.63 -1.69 0.04 1.67 0.00 -1.25 -2.15 121.76 112.75 1i33 s ALA 35 Ca -0.13 0.50 0.07 0.00 0.00 0.00 0.00 51.96 52.41 1i33 s ALA 35 Cb 0.12 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1i33 s ALA 35 CO 0.78 -0.86 -0.21 0.14 0.00 0.00 0.00 175.76 175.61 1i33 s VAL 36 N -3.32 1.67 -0.07 0.00 -7.23 -0.15 -1.25 120.40 110.05 1i33 s VAL 36 Ca 0.08 -1.21 0.05 0.00 -1.81 0.00 0.00 61.98 59.10 1i33 s VAL 36 Cb -0.02 -1.45 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 1i33 s VAL 36 CO -0.04 0.20 -0.24 -0.69 -0.31 0.00 0.00 175.10 174.02 1i33 s VAL 37 N -0.81 2.01 0.15 1.32 1.01 0.15 -0.64 120.40 123.59 1i33 s VAL 37 Ca 0.07 -1.03 -0.24 0.00 0.00 0.00 0.00 61.98 60.78 1i33 s VAL 37 Cb -0.09 -1.71 0.06 0.00 0.00 0.00 0.00 36.38 34.64 1i33 s VAL 37 CO 0.02 0.56 0.80 -0.62 0.00 0.00 0.00 175.10 175.85 1i33 s ASP 38 N -0.02 -0.34 0.00 3.32 -1.08 -1.09 0.29 116.67 117.75 1i33 s ASP 38 Ca -0.08 -0.25 0.00 0.00 -0.52 0.00 0.00 52.55 51.70 1i33 s ASP 38 Cb -0.15 0.55 0.00 0.00 -1.46 0.00 0.00 42.92 41.86 1i33 s ASP 38 CO 0.05 -0.95 0.82 0.23 0.52 0.00 0.00 175.17 175.83 1i33 n MET 39 N -0.39 0.00 -4.10 4.34 2.81 -1.26 -2.33 117.12 116.19 1i33 n MET 39 Ca -0.09 0.33 -0.12 0.00 -1.81 0.00 0.00 57.70 56.01 1i33 n MET 39 Cb 0.62 -1.63 -0.11 0.00 -0.71 0.00 0.00 33.22 31.39 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 -2.63 0.97 -0.11 7.83 0.15 -1.26 -4.86 113.70 113.79 1i33 s SER 40 Ca 0.00 -0.71 0.16 0.00 0.70 0.00 0.00 55.95 56.09 1i33 s SER 40 Cb 0.00 0.06 0.24 0.00 -1.71 0.00 0.00 66.02 64.60 1i33 s SER 40 CO 0.00 -0.29 1.12 0.35 1.20 0.00 0.00 173.24 175.62 1i33 n THR 41 N 0.92 1.55 -2.45 6.45 -2.24 -1.26 -4.86 114.28 112.39 1i33 n THR 41 Ca -0.19 -1.87 -0.38 0.00 -2.27 0.00 0.00 64.05 59.34 1i33 n THR 41 Cb 0.57 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 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 -2.55 6.20 0.54 3.42 3.84 -1.26 -4.19 114.94 120.95 1i33 s ASN 42 Ca 0.26 -1.32 0.27 0.00 0.21 0.00 0.00 52.86 52.28 1i33 s ASN 42 Cb 0.23 -2.57 1.43 0.00 -0.55 0.00 0.00 41.25 39.80 1i33 s ASN 42 CO 0.02 -1.78 1.98 0.00 -2.79 0.00 0.00 177.10 174.53 1i33 h ALA 43 N 10.05 2.48 -0.55 1.71 0.00 -1.76 -0.76 119.26 130.43 1i33 h ALA 43 Ca 0.19 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1i33 h ALA 43 Cb 1.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1i33 h ALA 43 CO 1.38 -0.70 -0.08 0.93 0.00 0.00 0.00 179.25 180.78 1i33 h GLU 44 N 0.00 1.01 0.23 0.00 5.08 -1.88 0.23 114.58 119.26 1i33 h GLU 44 Ca 0.26 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1i33 h GLU 44 Cb 1.10 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1i33 h GLU 44 CO -0.00 1.04 -0.11 -0.92 -1.00 0.00 0.00 179.01 178.01 1i33 h TYR 45 N 0.91 -0.29 -0.99 4.33 3.20 -1.54 -1.57 116.97 121.01 1i33 h TYR 45 Ca 0.15 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.15 1i33 h TYR 45 Cb 0.63 0.10 -0.09 0.00 1.54 0.00 0.00 36.73 38.91 1i33 h TYR 45 CO 0.04 -0.03 0.62 0.74 -1.64 0.00 0.00 178.16 177.89 1i33 h PHE 46 N -0.52 1.09 -0.21 -3.82 0.04 -1.40 0.26 116.94 112.39 1i33 h PHE 46 Ca -0.03 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.81 1i33 h PHE 46 Cb 0.39 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 1i33 h PHE 46 CO -0.00 0.38 -0.04 0.00 -0.60 0.00 0.00 178.31 178.05 1i33 h ALA 47 N 1.57 0.15 -0.74 2.45 0.00 -0.69 0.79 119.26 122.78 1i33 h ALA 47 Ca 0.51 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.48 1i33 h ALA 47 Cb 0.62 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1i33 h ALA 47 CO -0.29 -0.47 0.38 -0.92 0.00 0.00 0.00 179.25 177.96 1i33 h TYR 48 N 0.01 1.05 0.00 0.00 3.20 0.03 -0.83 116.97 120.43 1i33 h TYR 48 Ca 0.10 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1i33 h TYR 48 Cb 0.15 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.09 1i33 h TYR 48 CO -0.21 0.76 0.00 1.96 -1.64 0.00 0.00 178.16 179.02 1i33 h GLN 49 N 1.04 0.00 0.00 1.82 4.20 0.29 -2.84 115.11 119.62 1i33 h GLN 49 Ca 0.26 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.63 1i33 h GLN 49 Cb 0.08 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.80 1i33 h GLN 49 CO -0.04 0.00 -2.26 -1.33 -0.67 0.00 0.00 178.83 174.53 1i33 n MET 50 N -2.80 0.68 0.18 1.46 2.81 0.19 -4.30 117.12 115.33 1i33 n MET 50 Ca 0.01 0.03 0.13 0.00 -1.81 0.00 0.00 57.70 56.06 1i33 n MET 50 Cb 0.24 -1.56 0.36 0.00 -0.71 0.00 0.00 33.22 31.55 1i33 n MET 50 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1i33 h LYS 51 N 0.00 0.00 -3.76 0.03 1.57 -1.06 -3.40 116.57 109.94 1i33 h LYS 51 Ca -0.48 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 57.88 1i33 h LYS 51 Cb 2.16 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 34.10 1i33 h LYS 51 CO 0.04 0.00 -0.76 -1.01 -0.57 0.00 0.00 179.45 177.14 1i33 s HIS 52 N -3.24 0.61 -0.06 -1.35 3.76 -1.08 -4.47 115.29 109.46 1i33 s HIS 52 Ca 0.07 -0.14 0.01 0.00 -0.15 0.00 0.00 55.06 54.86 1i33 s HIS 52 Cb 0.09 -0.70 0.02 0.00 1.11 0.00 0.00 32.58 33.09 1i33 s HIS 52 CO 0.60 -0.26 -0.07 0.34 -0.85 0.00 0.00 174.74 174.50 1i33 s ASP 53 N 1.60 1.37 0.30 1.40 2.15 -1.23 -4.76 116.67 117.50 1i33 s ASP 53 Ca -0.01 -0.19 -0.02 0.00 0.43 0.00 0.00 52.55 52.76 1i33 s ASP 53 Cb -0.13 -0.60 0.44 0.00 -0.30 0.00 0.00 42.92 42.33 1i33 s ASP 53 CO -0.03 -0.05 1.96 0.74 -0.17 0.00 0.00 175.17 177.62 1i33 h THR 54 N 6.11 1.20 0.01 1.71 2.02 -1.98 -2.73 112.91 119.25 1i33 h THR 54 Ca -0.33 -0.39 -0.40 0.00 0.77 0.00 0.00 66.41 66.06 1i33 h THR 54 Cb 1.16 -0.03 -0.06 0.00 -1.74 0.00 0.00 68.15 67.47 1i33 h THR 54 CO 0.45 0.21 -2.43 0.52 0.37 0.00 0.00 175.52 174.64 1i33 n VAL 55 N -4.42 1.52 1.14 3.16 0.31 -1.26 -4.61 118.33 114.17 1i33 n VAL 55 Ca 0.10 -0.52 0.12 0.00 -0.01 0.00 0.00 64.34 64.03 1i33 n VAL 55 Cb 0.05 -1.57 0.19 0.00 -0.91 0.00 0.00 33.84 31.60 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 -3.54 0.00 -3.82 3.52 8.25 -1.25 -4.96 115.22 113.42 1i33 n HIS 56 Ca -0.47 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 56.99 1i33 n HIS 56 Cb 0.96 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 32.03 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 1.36 -1.92 3.79 -1.41 0.00 -1.03 -4.89 105.19 101.10 1i33 n GLY 57 Ca 0.12 -1.42 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 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 4.49 0.54 1.61 6.06 -1.26 -3.53 118.95 126.85 1i33 s ARG 58 Ca 0.00 1.21 -0.18 0.00 -2.50 0.00 0.00 55.73 54.26 1i33 s ARG 58 Cb 0.00 -2.77 -0.06 0.00 0.06 0.00 0.00 34.95 32.18 1i33 s ARG 58 CO 0.00 0.28 1.05 -1.25 -2.50 0.00 0.00 175.30 172.88 1i33 s PRO 59 N -2.12 3.56 0.00 5.12 0.04 -1.26 -4.95 135.00 135.38 1i33 s PRO 59 Ca 0.50 1.31 0.31 0.00 0.04 0.00 0.00 61.00 63.15 1i33 s PRO 59 Cb -0.17 -2.06 1.67 0.00 0.04 0.00 0.00 34.50 33.97 1i33 s PRO 59 CO 0.22 -0.62 2.11 1.63 0.04 0.00 0.00 177.00 180.38 1i33 n LYS 60 N -1.46 0.75 -4.34 4.56 4.76 -1.26 -4.83 118.16 116.34 1i33 n LYS 60 Ca 0.09 -0.04 -0.24 0.00 -2.87 0.00 0.00 58.31 55.25 1i33 n LYS 60 Cb 0.53 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 32.13 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 -2.28 2.55 -0.09 2.13 -0.85 -1.26 -5.12 117.35 112.42 1i33 s TYR 61 Ca 0.38 -0.39 -0.14 0.00 -0.52 0.00 0.00 57.07 56.39 1i33 s TYR 61 Cb 0.21 -1.40 -0.05 0.00 0.38 0.00 0.00 41.96 41.10 1i33 s TYR 61 CO 0.42 0.52 0.35 0.95 -1.52 0.00 0.00 175.55 176.27 1i33 s THR 62 N -2.49 5.20 -0.08 -3.49 -4.23 -1.26 -4.99 115.64 104.31 1i33 s THR 62 Ca 0.34 0.70 0.04 0.00 -1.18 0.00 0.00 61.69 61.59 1i33 s THR 62 Cb -0.02 -3.67 -0.00 0.00 1.34 0.00 0.00 72.50 70.15 1i33 s THR 62 CO 0.19 0.47 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.84 1i33 s VAL 63 N -0.18 1.80 -0.01 2.29 1.01 -1.26 -2.29 120.40 121.75 1i33 s VAL 63 Ca 0.21 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.27 1i33 s VAL 63 Cb -0.15 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.68 1i33 s VAL 63 CO 0.08 0.50 0.06 -0.70 0.00 0.00 0.00 175.10 175.04 1i33 s GLU 64 N 0.24 0.19 -0.15 2.72 2.12 -0.43 -4.99 118.70 118.40 1i33 s GLU 64 Ca -0.13 -0.14 -0.10 0.00 0.36 0.00 0.00 54.97 54.97 1i33 s GLU 64 Cb -0.16 0.08 -0.05 0.00 0.26 0.00 0.00 34.13 34.27 1i33 s GLU 64 CO 0.06 -0.03 0.17 0.00 -0.54 0.00 0.00 175.26 174.92 1i33 s ALA 65 N -0.51 3.76 0.16 6.30 0.00 -1.26 0.02 121.76 130.22 1i33 s ALA 65 Ca -0.06 -0.61 -0.02 0.00 0.00 0.00 0.00 51.96 51.27 1i33 s ALA 65 Cb -0.04 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 1i33 s ALA 65 CO 0.00 0.37 0.12 0.14 0.00 0.00 0.00 175.76 176.38 1i33 s VAL 66 N -0.31 0.06 -0.01 0.00 -7.23 -0.36 -4.97 120.40 107.59 1i33 s VAL 66 Ca 0.13 -1.86 -0.07 0.00 -1.81 0.00 0.00 61.98 58.37 1i33 s VAL 66 Cb -0.12 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.61 1i33 s VAL 66 CO 0.02 -0.29 0.26 -0.54 -0.31 0.00 0.00 175.10 174.24 1i33 s LYS 67 N -4.07 3.58 0.19 4.82 1.02 -1.26 -0.97 119.74 123.04 1i33 s LYS 67 Ca 0.28 -0.06 -0.02 0.00 0.02 0.00 0.00 55.97 56.19 1i33 s LYS 67 Cb 0.07 -3.10 0.11 0.00 -0.52 0.00 0.00 37.83 34.39 1i33 s LYS 67 CO 0.05 0.67 1.49 0.66 -0.92 0.00 0.00 175.35 177.29 1i33 h SER 68 N 4.15 0.52 -3.44 2.83 4.64 -1.92 -3.43 113.55 116.90 1i33 h SER 68 Ca -0.51 -0.30 -0.39 0.00 -0.47 0.00 0.00 61.79 60.12 1i33 h SER 68 Cb 1.20 -0.15 -0.35 0.00 -0.31 0.00 0.00 62.40 62.79 1i33 h SER 68 CO 0.65 1.02 -0.76 -0.44 -0.87 0.00 0.00 176.83 176.42 1i33 s SER 69 N -6.94 0.90 0.11 4.97 0.01 -1.26 -4.99 113.70 106.50 1i33 s SER 69 Ca -0.06 -0.09 0.03 0.00 1.31 0.00 0.00 55.95 57.14 1i33 s SER 69 Cb 0.11 -0.38 0.18 0.00 0.21 0.00 0.00 66.02 66.14 1i33 s SER 69 CO 0.83 -0.09 0.88 -0.81 0.41 0.00 0.00 173.24 174.46 1i33 n PRO 70 N 4.25 0.02 -0.07 12.44 -0.04 -1.26 -0.53 135.00 149.81 1i33 n PRO 70 Ca -0.22 0.33 -0.14 0.00 -0.04 0.00 0.00 63.50 63.43 1i33 n PRO 70 Cb 0.51 -1.90 -0.05 0.00 -0.04 0.00 0.00 33.50 32.02 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 0.78 -4.04 3.54 0.02 -1.97 -3.46 113.55 108.42 1i33 h SER 71 Ca 0.00 -0.53 -0.54 0.00 -0.84 0.00 0.00 61.79 59.88 1i33 h SER 71 Cb 0.64 -0.22 0.13 0.00 0.14 0.00 0.00 62.40 63.08 1i33 h SER 71 CO 0.00 1.15 0.59 0.68 -1.14 0.00 0.00 176.83 178.12 1i33 s VAL 72 N -4.14 2.21 -0.06 2.27 -7.23 0.31 -4.97 120.40 108.80 1i33 s VAL 72 Ca -0.12 0.16 -0.26 0.00 -1.81 0.00 0.00 61.98 59.95 1i33 s VAL 72 Cb 0.08 -3.08 -0.23 0.00 0.56 0.00 0.00 36.38 33.72 1i33 s VAL 72 CO 0.84 -0.00 1.06 1.05 -0.31 0.00 0.00 175.10 177.74 1i33 h GLU 73 N 1.54 0.08 -6.56 4.82 9.09 -1.89 -3.46 114.58 118.20 1i33 h GLU 73 Ca -0.51 -0.07 -0.69 0.00 0.05 0.00 0.00 59.36 58.13 1i33 h GLU 73 Cb 1.29 0.02 -0.26 0.00 -1.65 0.00 0.00 28.75 28.15 1i33 h GLU 73 CO 0.58 0.78 -0.84 0.95 0.05 0.00 0.00 179.01 180.52 1i33 s THR 74 N -3.35 2.44 0.37 -1.06 -4.23 -1.26 -5.10 115.64 103.46 1i33 s THR 74 Ca -0.17 -1.09 -0.24 0.00 -1.18 0.00 0.00 61.69 59.01 1i33 s THR 74 Cb 0.00 -1.93 -0.13 0.00 1.34 0.00 0.00 72.50 71.78 1i33 s THR 74 CO 0.71 0.50 0.67 0.00 -0.54 0.00 0.00 174.62 175.95 1i33 n ALA 75 N 2.11 -1.29 -2.20 3.99 0.00 -1.26 -4.90 120.51 116.96 1i33 n ALA 75 Ca -0.16 0.24 0.01 0.00 0.00 0.00 0.00 53.44 53.53 1i33 n ALA 75 Cb 0.52 -1.82 0.01 0.00 0.00 0.00 0.00 19.45 18.15 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 1.29 0.36 -3.91 0.00 5.75 -0.68 -2.21 116.55 117.16 1i33 n ASP 76 Ca 0.12 -1.95 -0.13 0.00 -0.01 0.00 0.00 54.79 52.82 1i33 n ASP 76 Cb 0.36 -0.21 -0.14 0.00 -1.03 0.00 0.00 41.12 40.10 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 0.14 -0.14 2.12 1.01 -0.15 -2.49 120.40 120.90 1i33 s VAL 77 Ca 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 1i33 s VAL 77 Cb 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.38 1i33 s VAL 77 CO -0.07 -0.03 -0.12 -0.22 0.00 0.00 0.00 175.10 174.67 1i33 s LEU 78 N -0.22 2.79 -0.26 3.92 2.96 0.54 -1.23 118.68 127.20 1i33 s LEU 78 Ca -0.01 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 53.58 1i33 s LEU 78 Cb -0.02 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 45.07 1i33 s LEU 78 CO -0.00 0.16 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.45 1i33 s VAL 79 N 0.39 2.90 -0.19 1.68 1.01 0.10 0.15 120.40 126.44 1i33 s VAL 79 Ca -0.09 -1.11 -0.01 0.00 0.00 0.00 0.00 61.98 60.77 1i33 s VAL 79 Cb -0.16 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.71 1i33 s VAL 79 CO 0.05 0.13 -0.15 -0.69 0.00 0.00 0.00 175.10 174.44 1i33 s VAL 80 N 1.31 2.52 -1.67 2.92 1.01 0.41 -1.32 120.40 125.57 1i33 s VAL 80 Ca -0.01 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 61.00 1i33 s VAL 80 Cb -0.17 -2.09 0.15 0.00 0.00 0.00 0.00 36.38 34.27 1i33 s VAL 80 CO -0.04 0.50 0.79 0.59 0.00 0.00 0.00 175.10 176.95 1i33 n ASN 81 N 4.61 -3.46 0.00 3.32 3.02 -0.97 -0.72 115.26 121.06 1i33 n ASN 81 Ca -0.20 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.39 1i33 n ASN 81 Cb 0.50 -2.83 0.00 0.00 -0.61 0.00 0.00 39.78 36.85 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 -1.39 2.66 3.77 7.41 0.00 -1.26 -5.03 105.19 111.36 1i33 n GLY 82 Ca 0.08 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 1i33 n GLY 82 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1i33 s HIS 83 N -1.20 2.80 -0.22 1.61 5.04 0.10 -4.97 115.29 118.44 1i33 s HIS 83 Ca 0.00 1.28 -0.09 0.00 -1.54 0.00 0.00 55.06 54.71 1i33 s HIS 83 Cb 0.00 -3.87 -0.05 0.00 0.04 0.00 0.00 32.58 28.71 1i33 s HIS 83 CO 0.00 -2.48 0.12 1.03 -2.34 0.00 0.00 174.74 171.07 1i33 s ARG 84 N -1.95 4.00 -0.16 2.88 0.52 -1.26 -0.45 118.95 122.53 1i33 s ARG 84 Ca 0.51 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.42 1i33 s ARG 84 Cb -0.43 -3.42 0.01 0.00 0.52 0.00 0.00 34.95 31.63 1i33 s ARG 84 CO 0.58 0.10 -0.20 0.42 0.02 0.00 0.00 175.30 176.23 1i33 s ILE 85 N 0.90 2.19 0.26 1.52 1.09 0.39 -4.87 121.20 122.68 1i33 s ILE 85 Ca 0.06 -0.92 -0.30 0.00 -1.10 0.00 0.00 60.65 58.40 1i33 s ILE 85 Cb -0.13 -1.91 -0.09 0.00 -1.06 0.00 0.00 42.46 39.27 1i33 s ILE 85 CO 0.03 0.54 1.13 -0.54 -0.10 0.00 0.00 174.94 175.99 1i33 s LYS 86 N 1.05 4.60 -0.86 2.79 -0.14 -0.91 -0.34 119.74 125.92 1i33 s LYS 86 Ca -0.01 1.83 -0.11 0.00 -1.36 0.00 0.00 55.97 56.33 1i33 s LYS 86 Cb -0.14 -3.20 0.22 0.00 -1.68 0.00 0.00 37.83 33.03 1i33 s LYS 86 CO -0.07 0.13 0.79 0.00 -0.76 0.00 0.00 175.35 175.45 1i33 s VAL 88 N -0.28 3.80 0.27 0.00 1.01 0.19 -4.75 120.40 120.64 1i33 s VAL 88 Ca 0.21 1.53 -0.29 0.00 0.00 0.00 0.00 61.98 63.43 1i33 s VAL 88 Cb -0.11 -3.86 -0.10 0.00 0.00 0.00 0.00 36.38 32.31 1i33 s VAL 88 CO -0.08 0.15 1.32 -0.75 0.00 0.00 0.00 175.10 175.74 1i33 s LYS 89 N -2.06 4.37 0.61 2.72 2.47 -1.26 -2.67 119.74 123.91 1i33 s LYS 89 Ca 0.52 2.16 -0.17 0.00 -1.56 0.00 0.00 55.97 56.92 1i33 s LYS 89 Cb -0.24 -3.12 -0.03 0.00 -1.46 0.00 0.00 37.83 32.98 1i33 s LYS 89 CO 0.30 -0.22 1.12 0.00 0.16 0.00 0.00 175.35 176.70 1i33 s ALA 90 N -0.56 2.57 0.16 3.13 0.00 -0.98 -4.73 121.76 121.35 1i33 s ALA 90 Ca 0.53 0.66 0.06 0.00 0.00 0.00 0.00 51.96 53.21 1i33 s ALA 90 Cb -0.39 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 1i33 s ALA 90 CO 0.46 -1.05 -0.14 -0.65 0.00 0.00 0.00 175.76 174.38 1i33 s GLN 91 N -3.76 1.15 -0.03 0.00 -1.52 -1.26 -4.96 119.66 109.28 1i33 s GLN 91 Ca 0.69 -1.42 -0.17 0.00 -1.95 0.00 0.00 55.36 52.52 1i33 s GLN 91 Cb -0.22 -0.95 -0.10 0.00 -0.22 0.00 0.00 33.01 31.52 1i33 s GLN 91 CO 0.35 0.17 0.69 0.00 -0.25 0.00 0.00 175.29 176.25 1i33 h ARG 92 N 3.02 -0.50 -5.21 2.91 3.08 -1.97 -3.43 114.38 112.28 1i33 h ARG 92 Ca -0.39 0.03 -0.62 0.00 0.07 0.00 0.00 59.98 59.08 1i33 h ARG 92 Cb 1.20 0.11 -0.14 0.00 0.08 0.00 0.00 29.97 31.23 1i33 h ARG 92 CO 0.57 -0.29 -0.34 1.21 -1.07 0.00 0.00 179.97 180.05 1i33 s ASN 93 N -4.98 6.26 0.42 7.04 2.47 -1.26 -4.97 114.94 119.91 1i33 s ASN 93 Ca -0.09 0.29 0.21 0.00 0.42 0.00 0.00 52.86 53.69 1i33 s ASN 93 Cb 0.01 -2.17 1.18 0.00 -1.45 0.00 0.00 41.25 38.82 1i33 s ASN 93 CO 0.28 -0.04 1.76 -0.65 -3.72 0.00 0.00 177.10 174.73 1i33 h PRO 94 N 7.64 0.31 0.00 0.43 0.11 -1.86 0.11 132.00 138.74 1i33 h PRO 94 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1i33 h PRO 94 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1i33 h PRO 94 CO 0.67 0.21 0.07 0.00 -0.21 0.00 0.00 178.00 178.73 1i33 h ALA 95 N 1.60 1.06 -0.42 -0.75 0.00 -1.85 0.59 119.26 119.48 1i33 h ALA 95 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1i33 h ALA 95 Cb 1.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1i33 h ALA 95 CO -0.28 -0.06 0.00 -0.25 0.00 0.00 0.00 179.25 178.66 1i33 n ASP 96 N -2.63 2.28 -4.75 0.00 8.00 0.38 -4.20 116.55 115.63 1i33 n ASP 96 Ca -0.02 -1.99 -0.39 0.00 0.71 0.00 0.00 54.79 53.09 1i33 n ASP 96 Cb 0.11 -0.28 -0.05 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.01 4.42 0.00 0.64 1.43 0.20 -4.95 118.68 119.41 1i33 s LEU 97 Ca 0.29 1.27 -0.01 0.00 -1.03 0.00 0.00 54.13 54.65 1i33 s LEU 97 Cb 0.15 -3.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.28 1i33 s LEU 97 CO 0.20 0.05 1.69 -0.81 0.23 0.00 0.00 176.35 177.71 1i33 n PRO 98 N 2.83 0.86 0.05 1.29 -0.04 -1.26 -4.47 135.00 134.27 1i33 n PRO 98 Ca -0.05 -0.16 -0.11 0.00 -0.04 0.00 0.00 63.50 63.14 1i33 n PRO 98 Cb 0.51 -1.31 -0.06 0.00 -0.04 0.00 0.00 33.50 32.60 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 2.36 -0.18 -0.10 0.54 -0.00 -1.83 0.31 115.95 117.05 1i33 h TRP 99 Ca 0.03 0.00 0.02 0.00 -0.00 0.00 0.00 58.89 58.95 1i33 h TRP 99 Cb 0.78 0.08 -0.02 0.00 -0.00 0.00 0.00 29.16 29.99 1i33 h TRP 99 CO 0.59 -0.11 -0.05 0.78 -0.00 0.00 0.00 178.44 179.66 1i33 h GLY 100 N -0.13 0.04 2.00 1.49 0.00 -1.30 0.14 103.07 105.32 1i33 h GLY 100 Ca 0.02 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1i33 h GLY 100 CO -0.06 -0.06 0.00 1.70 0.00 0.00 0.00 176.54 178.12 1i33 h LYS 101 N -0.04 0.00 0.00 4.80 3.64 -1.78 -2.27 116.57 120.92 1i33 h LYS 101 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1i33 h LYS 101 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1i33 h LYS 101 CO -0.12 0.00 -1.47 1.28 -2.27 0.00 0.00 179.45 176.86 1i33 n LEU 102 N -2.83 0.41 0.00 5.20 4.77 0.08 -4.98 117.00 119.64 1i33 n LEU 102 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1i33 n LEU 102 Cb 0.15 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1i33 n LEU 102 CO 0.20 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1i33 n GLY 103 N 1.28 0.66 3.67 -0.72 0.00 0.36 -5.04 105.19 105.40 1i33 n GLY 103 Ca -0.01 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.00 4.91 -0.25 1.61 1.01 -0.73 -4.78 120.40 120.17 1i33 s VAL 104 Ca 0.00 1.53 -0.09 0.00 0.00 0.00 0.00 61.98 63.43 1i33 s VAL 104 Cb 0.00 -4.09 -0.15 0.00 0.00 0.00 0.00 36.38 32.13 1i33 s VAL 104 CO 0.00 0.05 -0.20 0.47 0.00 0.00 0.00 175.10 175.42 1i33 n ASP 105 N 5.15 1.97 -4.47 3.32 8.00 0.17 -4.15 116.55 126.53 1i33 n ASP 105 Ca 0.03 0.18 -0.36 0.00 0.71 0.00 0.00 54.79 55.35 1i33 n ASP 105 Cb 0.49 -0.70 -0.12 0.00 -0.02 0.00 0.00 41.12 40.76 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 -2.50 3.10 -0.21 1.24 1.51 -0.42 -0.61 117.35 119.46 1i33 s TYR 106 Ca -0.35 -0.35 -0.06 0.00 -1.01 0.00 0.00 57.07 55.30 1i33 s TYR 106 Cb 0.11 -2.24 -0.03 0.00 -0.11 0.00 0.00 41.96 39.70 1i33 s TYR 106 CO 0.56 -0.31 0.02 0.08 -1.11 0.00 0.00 175.55 174.79 1i33 s VAL 107 N 1.54 4.13 -0.62 0.71 1.01 -0.16 -1.23 120.40 125.79 1i33 s VAL 107 Ca 0.06 -0.25 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 1i33 s VAL 107 Cb -0.15 -2.88 0.08 0.00 0.00 0.00 0.00 36.38 33.43 1i33 s VAL 107 CO 0.04 0.41 0.83 -0.63 0.00 0.00 0.00 175.10 175.76 1i33 s ILE 108 N 1.03 4.57 -0.67 2.22 1.01 0.15 -0.94 121.20 128.58 1i33 s ILE 108 Ca 0.03 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 59.83 1i33 s ILE 108 Cb -0.14 -4.57 0.05 0.00 0.01 0.00 0.00 42.46 37.80 1i33 s ILE 108 CO 0.02 -1.26 1.11 -0.70 0.00 0.00 0.00 174.94 174.11 1i33 s GLU 109 N 3.40 3.21 -0.31 2.79 2.56 0.24 -1.06 118.70 129.53 1i33 s GLU 109 Ca 0.18 -0.41 0.14 0.00 0.00 0.00 0.00 54.97 54.88 1i33 s GLU 109 Cb -0.20 -4.16 0.47 0.00 2.00 0.00 0.00 34.13 32.24 1i33 s GLU 109 CO 0.09 -1.89 1.11 -1.13 -0.56 0.00 0.00 175.26 172.88 1i33 n SER 110 N 8.43 3.19 -0.02 -1.70 3.41 -0.45 -1.51 113.62 124.97 1i33 n SER 110 Ca 0.01 -3.00 0.05 0.00 -0.26 0.00 0.00 58.87 55.67 1i33 n SER 110 Cb 0.47 -0.44 -0.15 0.00 -0.26 0.00 0.00 64.21 63.84 1i33 n SER 110 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1i33 n THR 111 N -0.52 0.47 -1.00 6.66 -2.24 -1.16 -4.50 114.28 111.99 1i33 n THR 111 Ca 0.25 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1i33 n THR 111 Cb 0.84 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 1i33 n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i33 n GLY 112 N 1.38 0.68 0.38 3.38 0.00 -1.26 -4.85 105.19 104.90 1i33 n GLY 112 Ca -0.11 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 1.77 -2.81 0.99 4.77 -1.26 -4.61 117.00 115.85 1i33 n LEU 113 Ca 0.00 -0.99 -0.17 0.00 -0.03 0.00 0.00 56.01 54.83 1i33 n LEU 113 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1i33 n LEU 113 CO 0.00 0.34 -0.07 0.49 -1.33 0.00 0.00 177.39 176.83 1i33 n PHE 114 N 0.50 1.58 0.93 -1.77 3.72 -1.26 -4.85 117.46 116.31 1i33 n PHE 114 Ca 0.06 -3.27 0.04 0.00 -0.05 0.00 0.00 57.45 54.23 1i33 n PHE 114 Cb 0.24 -0.35 0.13 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.06 0.52 -4.00 4.37 -2.24 -1.26 -4.29 114.28 107.32 1i33 n THR 115 Ca 0.21 -0.42 -0.35 0.00 -2.27 0.00 0.00 64.05 61.23 1i33 n THR 115 Cb 0.70 0.07 -0.13 0.00 -2.10 0.00 0.00 70.33 68.87 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 -0.86 4.54 0.17 3.42 2.15 -1.26 -0.84 116.67 123.98 1i33 s ASP 116 Ca 0.20 -0.31 -0.09 0.00 0.43 0.00 0.00 52.55 52.78 1i33 s ASP 116 Cb 0.11 -1.78 0.23 0.00 -0.30 0.00 0.00 42.92 41.19 1i33 s ASP 116 CO 0.12 0.02 1.04 1.17 -0.17 0.00 0.00 175.17 177.34 1i33 n LYS 117 N 4.56 -0.11 0.51 4.34 3.00 -0.39 -0.18 118.16 129.88 1i33 n LYS 117 Ca -0.18 1.03 -0.20 0.00 -0.00 0.00 0.00 58.31 58.97 1i33 n LYS 117 Cb 0.51 -1.54 -0.10 0.00 0.00 0.00 0.00 35.03 33.91 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 -1.09 -1.43 3.14 4.07 -1.87 -1.83 115.31 116.30 1i33 h LEU 118 Ca 0.28 0.04 0.07 0.00 0.08 0.00 0.00 57.88 58.34 1i33 h LEU 118 Cb 0.44 0.28 -0.04 0.00 1.08 0.00 0.00 40.66 42.42 1i33 h LEU 118 CO -0.67 -0.76 0.45 0.11 -1.08 0.00 0.00 178.44 176.49 1i33 h LYS 119 N -1.33 0.67 -0.18 1.13 1.57 -1.44 -1.10 116.57 115.89 1i33 h LYS 119 Ca -0.13 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.53 1i33 h LYS 119 Cb 0.99 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 1i33 h LYS 119 CO 0.22 0.45 -0.24 0.00 -0.57 0.00 0.00 179.45 179.30 1i33 h ALA 120 N 1.63 1.26 0.00 3.86 0.00 -0.43 -2.69 119.26 122.89 1i33 h ALA 120 Ca 0.30 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i33 h ALA 120 Cb 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1i33 h ALA 120 CO -0.10 0.49 0.00 0.39 0.00 0.00 0.00 179.25 180.03 1i33 n GLU 121 N -4.15 0.00 0.26 0.00 1.02 -0.42 -2.03 120.64 115.32 1i33 n GLU 121 Ca -0.01 0.42 0.10 0.00 -0.02 0.00 0.00 57.16 57.66 1i33 n GLU 121 Cb 0.37 -1.50 0.68 0.00 -0.02 0.00 0.00 31.44 30.97 1i33 n GLU 121 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1i33 h GLY 122 N 0.58 0.00 1.56 0.62 0.00 -1.55 -1.51 103.07 102.76 1i33 h GLY 122 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1i33 h GLY 122 CO 0.00 0.00 -0.01 0.45 0.00 0.00 0.00 176.54 176.98 1i33 h HIS 123 N 0.00 0.57 -0.04 5.60 3.86 -1.63 -0.50 115.15 123.01 1i33 h HIS 123 Ca -0.00 -0.06 -0.16 0.00 -1.16 0.00 0.00 60.37 58.98 1i33 h HIS 123 Cb 0.22 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 1i33 h HIS 123 CO 0.00 0.57 -0.70 0.82 0.86 0.00 0.00 177.93 179.48 1i33 h ILE 124 N 0.53 1.43 0.00 2.45 2.04 -1.45 0.39 117.51 122.89 1i33 h ILE 124 Ca 0.11 -2.21 0.00 0.00 1.00 0.00 0.00 64.86 63.76 1i33 h ILE 124 Cb 0.36 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1i33 h ILE 124 CO 0.01 0.65 0.00 0.29 0.00 0.00 0.00 178.15 179.10 1i33 n LYS 125 N -3.79 0.09 -0.15 2.37 5.02 -0.80 -2.19 118.16 118.71 1i33 n LYS 125 Ca -0.03 0.21 0.12 0.00 -2.02 0.00 0.00 58.31 56.59 1i33 n LYS 125 Cb 0.68 -1.63 0.24 0.00 -0.02 0.00 0.00 35.03 34.30 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 0.68 1.37 0.00 0.72 0.00 -0.26 -4.91 105.19 102.78 1i33 n GLY 126 Ca 0.05 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 1.42 1.39 3.83 -0.02 0.00 -0.93 -1.19 105.19 109.69 1i33 n GLY 127 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.03 2.70 -0.20 4.61 0.00 0.07 -4.12 121.76 122.78 1i33 s ALA 128 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 51.96 51.90 1i33 s ALA 128 Cb 0.00 -3.14 -0.11 0.00 0.00 0.00 0.00 23.12 19.87 1i33 s ALA 128 CO 0.00 -1.20 -0.22 1.17 0.00 0.00 0.00 175.76 175.51 1i33 n LYS 129 N -3.11 0.46 -4.12 0.00 4.81 0.22 -4.21 118.16 112.21 1i33 n LYS 129 Ca 0.07 0.16 -0.14 0.00 -0.87 0.00 0.00 58.31 57.52 1i33 n LYS 129 Cb 0.54 -1.30 -0.11 0.00 0.02 0.00 0.00 35.03 34.18 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 -2.38 0.70 -0.07 1.64 -0.14 -0.26 -4.92 119.74 114.31 1i33 s LYS 130 Ca -0.27 -0.94 0.01 0.00 -1.36 0.00 0.00 55.97 53.40 1i33 s LYS 130 Cb 0.09 -0.47 0.02 0.00 -1.68 0.00 0.00 37.83 35.79 1i33 s LYS 130 CO 0.40 0.08 -0.09 0.08 -0.76 0.00 0.00 175.35 175.07 1i33 s VAL 131 N -1.77 0.90 -0.27 3.17 1.01 0.20 -0.99 120.40 122.65 1i33 s VAL 131 Ca -0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 1i33 s VAL 131 Cb -0.07 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.45 1i33 s VAL 131 CO 0.00 0.31 0.03 -0.69 0.00 0.00 0.00 175.10 174.75 1i33 s VAL 132 N 0.96 3.56 -0.34 2.92 1.01 -0.11 -0.06 120.40 128.33 1i33 s VAL 132 Ca -0.10 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 60.86 1i33 s VAL 132 Cb -0.15 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.42 1i33 s VAL 132 CO 0.00 0.14 0.74 -0.63 0.00 0.00 0.00 175.10 175.35 1i33 s ILE 133 N 1.44 4.80 0.00 2.22 1.01 0.49 -0.59 121.20 130.56 1i33 s ILE 133 Ca 0.02 0.89 -0.04 0.00 0.00 0.00 0.00 60.65 61.51 1i33 s ILE 133 Cb -0.17 -4.15 -0.20 0.00 0.01 0.00 0.00 42.46 37.96 1i33 s ILE 133 CO -0.00 -0.34 2.97 -1.54 0.00 0.00 0.00 174.94 176.03 1i33 n SER 134 N 6.25 4.57 -3.72 3.58 3.41 -0.57 -2.49 113.62 124.64 1i33 n SER 134 Ca 0.02 -2.33 0.02 0.00 -0.26 0.00 0.00 58.87 56.31 1i33 n SER 134 Cb 0.48 -1.19 0.01 0.00 -0.26 0.00 0.00 64.21 63.25 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 1.09 -2.30 0.14 7.33 0.00 -1.23 -4.97 121.76 121.82 1i33 s ALA 135 Ca 0.48 0.07 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 1i33 s ALA 135 Cb 0.23 0.79 -0.07 0.00 0.00 0.00 0.00 23.12 24.07 1i33 s ALA 135 CO 0.00 -1.12 1.22 -2.14 0.00 0.00 0.00 175.76 173.72 1i33 s PRO 136 N -2.11 4.45 0.26 0.00 0.02 -1.22 -3.88 135.00 132.52 1i33 s PRO 136 Ca 0.26 1.87 0.09 0.00 0.02 0.00 0.00 61.00 63.23 1i33 s PRO 136 Cb -0.00 -3.27 -0.04 0.00 0.02 0.00 0.00 34.50 31.20 1i33 s PRO 136 CO -0.00 -0.19 0.06 0.00 -0.33 0.00 0.00 177.00 176.54 1i33 s ALA 137 N 0.44 3.30 0.34 -1.55 0.00 -1.26 -4.88 121.76 118.15 1i33 s ALA 137 Ca 0.56 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1i33 s ALA 137 Cb -0.32 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 21.86 1i33 s ALA 137 CO 0.33 0.26 0.00 -1.13 0.00 0.00 0.00 175.76 175.23 1i33 n SER 138 N -0.99 2.93 0.00 0.00 3.41 -0.02 -4.77 113.62 114.18 1i33 n SER 138 Ca -0.07 -2.48 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 1i33 n SER 138 Cb 0.59 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 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 0.98 0.99 1.12 5.00 0.00 -1.26 -1.27 105.19 110.75 1i33 n GLY 139 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 0.96 3.81 -0.02 0.00 -1.26 -4.72 105.19 101.96 1i33 n GLY 140 Ca 0.00 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.37 3.44 0.01 4.61 0.00 -1.25 -4.99 121.76 121.22 1i33 s ALA 141 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 1i33 s ALA 141 Cb 0.00 -2.83 -0.08 0.00 0.00 0.00 0.00 23.12 20.22 1i33 s ALA 141 CO 0.00 0.33 1.76 0.21 0.00 0.00 0.00 175.76 178.06 1i33 s LYS 142 N -1.68 4.17 -0.18 0.00 2.47 -1.21 -4.76 119.74 118.55 1i33 s LYS 142 Ca 0.40 2.38 -0.13 0.00 -1.56 0.00 0.00 55.97 57.05 1i33 s LYS 142 Cb -0.18 -3.92 -0.05 0.00 -1.46 0.00 0.00 37.83 32.21 1i33 s LYS 142 CO 0.22 -0.85 0.26 0.99 0.16 0.00 0.00 175.35 176.13 1i33 s THR 143 N 3.75 5.32 -0.00 3.43 2.01 -1.26 -0.74 115.64 128.15 1i33 s THR 143 Ca 0.79 0.46 0.06 0.00 0.31 0.00 0.00 61.69 63.30 1i33 s THR 143 Cb -0.38 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 1i33 s THR 143 CO 0.34 0.38 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.85 1i33 s ILE 144 N 0.58 1.41 -0.50 1.82 1.01 0.12 -4.77 121.20 120.87 1i33 s ILE 144 Ca 0.14 -0.82 0.04 0.00 0.00 0.00 0.00 60.65 60.01 1i33 s ILE 144 Cb -0.13 -1.19 0.13 0.00 0.01 0.00 0.00 42.46 41.28 1i33 s ILE 144 CO 0.03 0.35 0.25 -0.69 0.00 0.00 0.00 174.94 174.88 1i33 s VAL 145 N -0.49 2.48 -0.10 2.92 1.01 -1.26 -4.19 120.40 120.78 1i33 s VAL 145 Ca 0.07 -3.21 -0.31 0.00 0.00 0.00 0.00 61.98 58.52 1i33 s VAL 145 Cb -0.07 -2.73 -0.15 0.00 0.00 0.00 0.00 36.38 33.43 1i33 s VAL 145 CO -0.00 -0.79 0.90 0.23 0.00 0.00 0.00 175.10 175.44 1i33 n MET 146 N 3.20 0.00 0.00 2.72 0.00 -1.26 -0.37 117.12 121.41 1i33 n MET 146 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.75 1i33 n MET 146 Cb 0.33 -1.12 0.00 0.00 0.00 0.00 0.00 33.22 32.42 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 1.61 0.44 0.00 3.03 0.00 -1.26 -4.86 105.19 104.15 1i33 n GLY 147 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.94 0.00 -2.64 1.61 0.31 0.50 -4.96 118.33 111.21 1i33 n VAL 148 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 1i33 n VAL 148 Cb 0.00 -0.33 0.07 0.00 -0.91 0.00 0.00 33.84 32.66 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 -2.15 -0.02 0.14 4.52 6.94 -1.21 -4.90 115.26 118.58 1i33 n ASN 149 Ca 0.00 -2.10 -0.01 0.00 -0.02 0.00 0.00 54.58 52.46 1i33 n ASN 149 Cb 0.33 0.10 0.18 0.00 -2.36 0.00 0.00 39.78 38.03 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 1.48 0.00 -0.12 -3.83 -0.00 -1.93 -2.85 115.11 107.86 1i33 h GLN 150 Ca -0.33 0.00 0.04 0.00 -0.00 0.00 0.00 58.65 58.36 1i33 h GLN 150 Cb 1.37 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.84 1i33 h GLN 150 CO -0.03 0.60 0.09 1.12 -0.00 0.00 0.00 178.83 180.61 1i33 h HIS 151 N 0.00 0.00 0.00 0.06 2.07 -1.98 0.61 115.15 115.91 1i33 h HIS 151 Ca -0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1i33 h HIS 151 Cb 1.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.07 1i33 h HIS 151 CO 0.00 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 175.25 1i33 n GLU 152 N -4.47 0.43 -2.44 5.12 1.02 -1.07 -4.74 120.64 114.49 1i33 n GLU 152 Ca -0.00 0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.76 1i33 n GLU 152 Cb 0.21 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 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 -2.20 3.16 -0.28 -0.32 5.04 0.20 -5.01 117.35 117.94 1i33 s TYR 153 Ca 0.22 1.18 -0.05 0.00 -2.44 0.00 0.00 57.07 55.99 1i33 s TYR 153 Cb 0.12 -3.44 0.02 0.00 0.35 0.00 0.00 41.96 39.00 1i33 s TYR 153 CO 0.22 -1.40 0.03 0.45 -1.34 0.00 0.00 175.55 173.51 1i33 s SER 154 N 1.51 4.87 0.58 4.32 0.15 -1.26 -4.99 113.70 118.88 1i33 s SER 154 Ca 0.56 -0.83 0.27 0.00 0.70 0.00 0.00 55.95 56.66 1i33 s SER 154 Cb -0.25 -1.80 1.60 0.00 -1.71 0.00 0.00 66.02 63.86 1i33 s SER 154 CO 0.22 -0.19 2.10 -0.65 1.20 0.00 0.00 173.24 175.93 1i33 h PRO 155 N 8.15 0.00 0.00 5.44 0.11 -1.89 -0.19 132.00 143.62 1i33 h PRO 155 Ca -0.30 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.63 1i33 h PRO 155 Cb 1.11 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1i33 h PRO 155 CO 0.59 0.00 -1.60 0.00 -0.21 0.00 0.00 178.00 176.78 1i33 n ALA 156 N -2.39 1.95 -0.09 -0.75 0.00 -1.26 -4.55 120.51 113.42 1i33 n ALA 156 Ca 0.02 -0.65 -0.12 0.00 0.00 0.00 0.00 53.44 52.70 1i33 n ALA 156 Cb 0.32 -0.84 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 1i33 n ALA 156 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1i33 n SER 157 N -2.81 2.01 -4.52 0.00 7.64 -0.95 -4.93 113.62 110.06 1i33 n SER 157 Ca -0.12 -0.07 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 1i33 n SER 157 Cb 0.86 0.11 -0.08 0.00 -1.01 0.00 0.00 64.21 64.08 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 -2.39 3.17 -0.05 1.43 3.76 -0.13 -4.89 115.29 116.20 1i33 s HIS 158 Ca -0.20 -0.09 0.08 0.00 -0.15 0.00 0.00 55.06 54.69 1i33 s HIS 158 Cb 0.06 -2.91 -0.11 0.00 1.11 0.00 0.00 32.58 30.73 1i33 s HIS 158 CO 0.52 -0.61 0.10 0.72 -0.85 0.00 0.00 174.74 174.61 1i33 n HIS 159 N 5.67 0.00 -3.99 1.40 -0.00 -1.26 -4.71 115.22 112.32 1i33 n HIS 159 Ca -0.06 0.00 -0.31 0.00 -0.00 0.00 0.00 57.72 57.34 1i33 n HIS 159 Cb 0.48 -0.30 -0.15 0.00 -0.00 0.00 0.00 29.99 30.03 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 -2.36 2.40 0.05 1.59 1.01 -1.26 -0.63 120.40 121.20 1i33 s VAL 160 Ca -0.03 -2.47 -0.02 0.00 0.00 0.00 0.00 61.98 59.46 1i33 s VAL 160 Cb 0.04 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1i33 s VAL 160 CO 0.33 -0.64 0.23 -0.69 0.00 0.00 0.00 175.10 174.33 1i33 s VAL 161 N 0.75 5.37 -0.09 2.92 1.01 0.92 -3.31 120.40 127.96 1i33 s VAL 161 Ca 0.12 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1i33 s VAL 161 Cb -0.20 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1i33 s VAL 161 CO -0.07 0.19 -0.20 -0.55 0.00 0.00 0.00 175.10 174.47 1i33 s SER 162 N -2.31 3.45 0.00 3.32 0.15 0.08 -0.38 113.70 118.02 1i33 s SER 162 Ca 0.33 -0.44 0.10 0.00 0.70 0.00 0.00 55.95 56.64 1i33 s SER 162 Cb -0.13 -1.24 0.31 0.00 -1.71 0.00 0.00 66.02 63.25 1i33 s SER 162 CO 0.25 0.21 1.24 -3.20 1.20 0.00 0.00 173.24 172.93 1i33 n ASN 163 N 3.22 1.36 0.00 5.45 4.05 -1.04 0.14 115.26 128.44 1i33 n ASN 163 Ca -0.18 -1.95 0.00 0.00 0.45 0.00 0.00 54.58 52.90 1i33 n ASN 163 Cb 0.53 -0.16 0.00 0.00 1.23 0.00 0.00 39.78 41.37 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 0.23 0.00 -2.63 5.20 0.00 -1.25 -4.76 120.51 117.29 1i33 n ALA 164 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.31 1i33 n ALA 164 Cb 0.22 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.61 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 4.78 0.25 0.00 1.04 -1.26 -3.41 113.70 111.10 1i33 s SER 165 Ca 0.00 -0.61 -0.03 0.00 0.48 0.00 0.00 55.95 55.79 1i33 s SER 165 Cb 0.00 -0.91 0.44 0.00 0.10 0.00 0.00 66.02 65.65 1i33 s SER 165 CO 0.00 -0.11 1.79 0.00 0.98 0.00 0.00 173.24 175.90 1i33 h THR 167 N 0.70 1.11 -0.78 0.00 2.02 -1.95 -2.88 112.91 111.13 1i33 h THR 167 Ca 0.42 -0.32 0.07 0.00 0.77 0.00 0.00 66.41 67.35 1i33 h THR 167 Cb 0.48 1.29 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1i33 h THR 167 CO -0.29 0.08 0.51 0.74 0.37 0.00 0.00 175.52 176.93 1i33 h THR 168 N -0.11 1.03 0.00 3.16 2.02 -1.72 -0.12 112.91 117.18 1i33 h THR 168 Ca 0.01 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1i33 h THR 168 Cb 0.13 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1i33 h THR 168 CO -0.00 0.15 0.00 0.59 0.37 0.00 0.00 175.52 176.63 1i33 n ASN 169 N -4.48 0.00 -0.10 4.18 3.02 -0.77 -1.00 115.26 116.10 1i33 n ASN 169 Ca 0.12 -0.13 -0.14 0.00 -0.03 0.00 0.00 54.58 54.39 1i33 n ASN 169 Cb 0.23 -0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.13 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 -0.03 -0.66 0.00 5.85 -1.22 -3.34 115.31 115.91 1i33 h LEU 171 Ca -0.47 -0.69 0.13 0.00 0.84 0.00 0.00 57.88 57.69 1i33 h LEU 171 Cb 1.76 0.01 -0.13 0.00 0.37 0.00 0.00 40.66 42.67 1i33 h LEU 171 CO -0.07 0.71 -0.16 0.00 -0.34 0.00 0.00 178.44 178.58 1i33 h ALA 172 N 0.09 0.44 -0.21 1.25 0.00 -1.34 0.10 119.26 119.59 1i33 h ALA 172 Ca -0.00 0.26 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1i33 h ALA 172 Cb 0.72 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1i33 h ALA 172 CO 0.01 -0.42 -0.08 -1.35 0.00 0.00 0.00 179.25 177.41 1i33 h PRO 173 N 0.00 -0.04 0.03 0.00 0.11 -1.79 0.54 132.00 130.86 1i33 h PRO 173 Ca 0.32 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.45 1i33 h PRO 173 Cb 0.48 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 1i33 h PRO 173 CO -0.68 -0.03 -0.19 0.82 -0.21 0.00 0.00 178.00 177.72 1i33 h ILE 174 N -0.04 0.56 -0.65 4.15 1.08 -1.32 -1.54 117.51 119.76 1i33 h ILE 174 Ca 0.11 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.63 1i33 h ILE 174 Cb 0.20 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.48 1i33 h ILE 174 CO -0.24 0.00 0.43 0.58 -0.69 0.00 0.00 178.15 178.23 1i33 h VAL 175 N -0.32 1.03 0.37 1.67 2.07 -0.65 -0.28 116.25 120.14 1i33 h VAL 175 Ca 0.05 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1i33 h VAL 175 Cb 0.37 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1i33 h VAL 175 CO -0.15 0.13 -0.18 -0.74 0.02 0.00 0.00 177.57 176.65 1i33 h HIS 176 N 0.69 -0.47 -0.05 1.57 -0.00 0.11 -0.91 115.15 116.09 1i33 h HIS 176 Ca 0.27 -0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.58 1i33 h HIS 176 Cb 0.21 0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.76 1i33 h HIS 176 CO -0.00 -0.28 -0.24 -0.39 -0.00 0.00 0.00 177.93 177.02 1i33 h VAL 177 N -0.52 1.20 -0.72 5.26 -1.51 -0.89 0.17 116.25 119.23 1i33 h VAL 177 Ca -0.05 -0.92 -0.02 0.00 -1.23 0.00 0.00 66.70 64.48 1i33 h VAL 177 Cb 0.40 1.43 -0.03 0.00 -2.13 0.00 0.00 31.29 30.96 1i33 h VAL 177 CO 0.08 0.27 0.38 -0.07 -1.23 0.00 0.00 177.57 177.01 1i33 h LEU 178 N 0.07 0.91 0.16 4.19 3.38 -0.49 -0.10 115.31 123.43 1i33 h LEU 178 Ca 0.01 -0.11 -0.31 0.00 0.09 0.00 0.00 57.88 57.56 1i33 h LEU 178 Cb 0.47 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.00 1i33 h LEU 178 CO 0.03 0.76 -1.46 0.71 0.09 0.00 0.00 178.44 178.57 1i33 h THR 179 N 1.00 1.26 -0.31 0.22 1.35 -0.67 -0.41 112.91 115.35 1i33 h THR 179 Ca 0.25 -2.82 -0.08 0.00 -0.55 0.00 0.00 66.41 63.21 1i33 h THR 179 Cb 0.06 2.88 -0.02 0.00 -1.73 0.00 0.00 68.15 69.35 1i33 h THR 179 CO -0.04 0.84 -0.13 0.50 -0.25 0.00 0.00 175.52 176.44 1i33 h LYS 180 N 0.09 0.55 -0.71 4.72 3.64 -0.62 -2.00 116.57 122.24 1i33 h LYS 180 Ca -0.23 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1i33 h LYS 180 Cb 2.05 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1i33 h LYS 180 CO 0.20 0.67 0.00 0.39 -2.27 0.00 0.00 179.45 178.45 1i33 n GLU 181 N -4.19 2.22 -2.73 1.90 -0.58 -0.06 -4.89 120.64 112.31 1i33 n GLU 181 Ca 0.01 -1.09 -0.19 0.00 -0.42 0.00 0.00 57.16 55.47 1i33 n GLU 181 Cb 0.34 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 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 0.24 -4.90 0.12 1.62 3.02 -0.75 -4.84 115.26 109.77 1i33 n ASN 182 Ca 0.10 -0.07 -0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1i33 n ASN 182 Cb 0.50 -4.06 0.06 0.00 -0.61 0.00 0.00 39.78 35.67 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 -0.50 0.00 -0.47 3.10 0.04 -1.28 -3.46 116.94 114.37 1i33 h PHE 183 Ca -0.42 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.39 1i33 h PHE 183 Cb 1.30 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.43 1i33 h PHE 183 CO 0.62 0.65 -0.17 0.41 -0.60 0.00 0.00 178.31 179.22 1i33 n GLY 184 N 0.93 -2.73 2.82 -1.45 0.00 -1.18 -2.26 105.19 101.32 1i33 n GLY 184 Ca 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 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 -3.21 -0.56 0.08 -0.61 2.07 -1.26 -4.03 121.20 113.67 1i33 s ILE 185 Ca 0.00 -0.99 -0.24 0.00 -1.41 0.00 0.00 60.65 58.00 1i33 s ILE 185 Cb 0.00 -0.42 -0.10 0.00 0.13 0.00 0.00 42.46 42.07 1i33 s ILE 185 CO 0.00 -0.39 1.39 -0.08 -1.91 0.00 0.00 174.94 173.95 1i33 h GLU 186 N 6.32 -0.48 -3.84 3.50 4.81 -1.52 -3.45 114.58 119.91 1i33 h GLU 186 Ca 0.09 0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.25 1i33 h GLU 186 Cb 1.08 0.11 -0.13 0.00 0.63 0.00 0.00 28.75 30.44 1i33 h GLU 186 CO 0.15 -0.32 -0.32 0.95 -0.73 0.00 0.00 179.01 178.74 1i33 s THR 187 N -4.94 0.09 -0.27 0.32 -4.23 -1.26 -4.82 115.64 100.52 1i33 s THR 187 Ca -0.11 -1.30 -0.25 0.00 -1.18 0.00 0.00 61.69 58.84 1i33 s THR 187 Cb 0.04 -1.69 0.10 0.00 1.34 0.00 0.00 72.50 72.30 1i33 s THR 187 CO 0.43 -0.39 0.90 -0.83 -0.54 0.00 0.00 174.62 174.20 1i33 s GLY 188 N -2.93 -0.31 -0.03 3.99 0.00 0.31 -2.17 107.32 106.17 1i33 s GLY 188 Ca 0.13 2.40 0.07 0.00 0.00 0.00 0.00 44.72 47.32 1i33 s GLY 188 CO -0.03 1.78 -0.24 1.08 0.00 0.00 0.00 173.10 175.70 1i33 s LEU 189 N 0.26 2.04 0.00 0.66 1.02 0.31 -2.68 118.68 120.30 1i33 s LEU 189 Ca 0.02 -0.44 0.04 0.00 0.02 0.00 0.00 54.13 53.77 1i33 s LEU 189 Cb -0.05 -1.24 -0.01 0.00 0.02 0.00 0.00 46.19 44.91 1i33 s LEU 189 CO -0.03 0.27 -0.13 0.00 0.02 0.00 0.00 176.35 176.48 1i33 s MET 190 N -0.43 1.03 -0.06 1.70 0.23 -0.72 -1.04 119.30 120.00 1i33 s MET 190 Ca 0.06 -0.56 0.03 0.00 -1.03 0.00 0.00 55.69 54.19 1i33 s MET 190 Cb -0.10 -1.01 -0.02 0.00 -1.53 0.00 0.00 34.83 32.16 1i33 s MET 190 CO 0.00 0.27 -0.14 0.99 -2.03 0.00 0.00 175.02 174.11 1i33 s THR 191 N -0.47 3.05 -0.15 3.16 2.01 -0.72 -0.96 115.64 121.56 1i33 s THR 191 Ca 0.04 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1i33 s THR 191 Cb -0.06 -2.21 0.02 0.00 0.01 0.00 0.00 72.50 70.27 1i33 s THR 191 CO 0.00 0.58 -0.13 0.28 -0.69 0.00 0.00 174.62 174.66 1i33 s THR 192 N -0.52 1.53 -0.51 -0.82 -1.32 -0.62 -0.98 115.64 112.40 1i33 s THR 192 Ca 0.07 -0.65 -0.25 0.00 -1.21 0.00 0.00 61.69 59.65 1i33 s THR 192 Cb -0.12 -1.47 0.03 0.00 -1.51 0.00 0.00 72.50 69.44 1i33 s THR 192 CO 0.02 0.42 0.95 -0.63 -2.21 0.00 0.00 174.62 173.16 1i33 s ILE 193 N 1.50 4.41 0.09 5.08 1.09 -0.66 -0.34 121.20 132.37 1i33 s ILE 193 Ca 0.04 0.50 0.05 0.00 -1.10 0.00 0.00 60.65 60.15 1i33 s ILE 193 Cb -0.13 -4.50 -0.04 0.00 -1.06 0.00 0.00 42.46 36.73 1i33 s ILE 193 CO -0.10 -1.01 -0.02 -2.28 -0.10 0.00 0.00 174.94 171.43 1i33 s HIS 194 N 3.91 2.94 0.46 3.97 2.46 -0.20 -1.12 115.29 127.72 1i33 s HIS 194 Ca 0.34 -0.05 -0.20 0.00 0.47 0.00 0.00 55.06 55.61 1i33 s HIS 194 Cb -0.11 -1.51 -0.09 0.00 -0.13 0.00 0.00 32.58 30.73 1i33 s HIS 194 CO 0.22 0.47 0.99 -1.12 -2.47 0.00 0.00 174.74 172.84 1i33 s SER 195 N -2.30 6.64 0.71 9.88 0.01 -1.26 -0.68 113.70 126.70 1i33 s SER 195 Ca 0.25 1.78 -0.15 0.00 1.31 0.00 0.00 55.95 59.14 1i33 s SER 195 Cb -0.12 -2.55 0.03 0.00 0.21 0.00 0.00 66.02 63.60 1i33 s SER 195 CO 0.17 -0.57 1.17 -0.72 0.41 0.00 0.00 173.24 173.70 1i33 s TYR 196 N -2.14 2.23 0.30 2.43 -0.85 -0.69 -4.79 117.35 113.84 1i33 s TYR 196 Ca 0.64 1.59 0.00 0.00 -0.52 0.00 0.00 57.07 58.78 1i33 s TYR 196 Cb -0.12 -3.37 0.00 0.00 0.38 0.00 0.00 41.96 38.86 1i33 s TYR 196 CO 0.18 -2.30 0.03 0.25 -1.52 0.00 0.00 175.55 172.18 1i33 n THR 197 N -2.66 0.00 0.30 -3.49 -2.24 -1.26 -4.73 114.28 100.19 1i33 n THR 197 Ca 0.12 -1.40 0.17 0.00 -2.27 0.00 0.00 64.05 60.67 1i33 n THR 197 Cb 0.51 0.23 0.69 0.00 -2.10 0.00 0.00 70.33 69.65 1i33 n THR 197 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i33 h ALA 198 N 1.10 1.00 0.00 6.98 0.00 -1.98 -2.52 119.26 123.85 1i33 h ALA 198 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1i33 h ALA 198 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1i33 h ALA 198 CO 0.40 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.90 1i33 n THR 199 N -2.96 0.15 -2.22 0.00 -2.24 -1.26 -4.84 114.28 100.91 1i33 n THR 199 Ca 0.01 -0.01 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 1i33 n THR 199 Cb 0.28 -0.55 0.07 0.00 -2.10 0.00 0.00 70.33 68.02 1i33 n THR 199 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1i33 s GLN 200 N -3.01 2.24 0.00 -0.78 -0.21 -0.95 -4.97 119.66 111.98 1i33 s GLN 200 Ca 0.13 -0.25 0.05 0.00 0.02 0.00 0.00 55.36 55.30 1i33 s GLN 200 Cb 0.17 -2.18 -0.03 0.00 1.00 0.00 0.00 33.01 31.97 1i33 s GLN 200 CO 0.52 -1.20 -0.12 0.15 -2.12 0.00 0.00 175.29 172.51 1i33 s LYS 201 N -5.22 2.38 0.08 2.91 3.01 -1.26 -5.00 119.74 116.64 1i33 s LYS 201 Ca 0.60 -0.80 -0.19 0.00 -1.01 0.00 0.00 55.97 54.57 1i33 s LYS 201 Cb -0.11 -2.37 -0.08 0.00 -1.01 0.00 0.00 37.83 34.26 1i33 s LYS 201 CO 0.45 0.59 1.54 1.79 0.51 0.00 0.00 175.35 180.22 1i33 h THR 202 N 3.95 1.24 -3.04 2.17 1.35 -1.94 0.42 112.91 117.06 1i33 h THR 202 Ca -0.48 -0.83 -0.63 0.00 -0.55 0.00 0.00 66.41 63.92 1i33 h THR 202 Cb 1.16 1.33 -0.18 0.00 -1.73 0.00 0.00 68.15 68.73 1i33 h THR 202 CO 0.51 0.26 -0.81 0.68 -0.25 0.00 0.00 175.52 175.91 1i33 s VAL 203 N -5.08 2.31 -0.63 6.82 -7.23 -1.26 -3.75 120.40 111.58 1i33 s VAL 203 Ca -0.14 -2.08 -0.39 0.00 -1.81 0.00 0.00 61.98 57.56 1i33 s VAL 203 Cb 0.07 -2.12 -0.19 0.00 0.56 0.00 0.00 36.38 34.70 1i33 s VAL 203 CO 0.74 -0.19 2.31 0.47 -0.31 0.00 0.00 175.10 178.12 1i33 n ASP 204 N 0.12 0.76 0.00 4.85 8.00 -1.26 -4.31 116.55 124.71 1i33 n ASP 204 Ca -0.11 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.87 1i33 n ASP 204 Cb 0.57 -0.95 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 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 7.10 5.91 3.89 0.44 0.00 0.23 -4.91 105.19 117.86 1i33 n GLY 205 Ca 0.57 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 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 1.69 5.45 -0.43 1.61 1.01 -1.26 -4.71 120.40 123.76 1i33 s VAL 206 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1i33 s VAL 206 Cb 0.00 -3.49 0.21 0.00 0.00 0.00 0.00 36.38 33.10 1i33 s VAL 206 CO 0.00 0.45 0.93 -0.24 0.00 0.00 0.00 175.10 176.24 1i33 n SER 207 N 1.39 -2.43 0.21 3.32 2.88 -1.26 -4.82 113.62 112.90 1i33 n SER 207 Ca -0.15 -1.96 0.10 0.00 -1.33 0.00 0.00 58.87 55.54 1i33 n SER 207 Cb 0.54 1.24 0.65 0.00 -0.75 0.00 0.00 64.21 65.89 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 4.52 0.00 0.14 2.46 3.38 -1.96 -2.78 115.31 121.08 1i33 h LEU 208 Ca 0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 1i33 h LEU 208 Cb 1.14 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.91 1i33 h LEU 208 CO -0.04 0.00 -0.94 0.11 0.09 0.00 0.00 178.44 177.66 1i33 h LYS 209 N 0.00 0.30 -2.99 1.13 1.57 -2.04 -3.41 116.57 111.12 1i33 h LYS 209 Ca 0.05 -0.51 -0.62 0.00 -1.87 0.00 0.00 60.65 57.71 1i33 h LYS 209 Cb 0.20 0.19 -0.41 0.00 0.08 0.00 0.00 32.23 32.29 1i33 h LYS 209 CO -0.00 1.24 -0.65 0.34 -0.57 0.00 0.00 179.45 179.81 1i33 s ASP 210 N -7.00 4.20 0.21 0.86 2.15 -1.11 -4.99 116.67 110.99 1i33 s ASP 210 Ca -0.15 -3.60 -0.17 0.00 0.43 0.00 0.00 52.55 49.07 1i33 s ASP 210 Cb 0.02 -1.42 0.21 0.00 -0.30 0.00 0.00 42.92 41.42 1i33 s ASP 210 CO 0.82 -0.12 1.59 -0.50 -0.17 0.00 0.00 175.17 176.79 1i33 h TRP 211 N 5.60 -0.77 -0.80 -5.34 4.06 -1.75 0.10 115.95 117.05 1i33 h TRP 211 Ca 0.14 0.08 0.00 0.00 2.06 0.00 0.00 58.89 61.16 1i33 h TRP 211 Cb 0.80 0.45 -0.04 0.00 -1.00 0.00 0.00 29.16 29.37 1i33 h TRP 211 CO 0.60 -0.37 0.51 0.00 -3.56 0.00 0.00 178.44 175.61 1i33 h ARG 212 N -0.08 1.07 0.00 0.49 3.08 -1.92 -1.80 114.38 115.21 1i33 h ARG 212 Ca 0.30 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1i33 h ARG 212 Cb 0.56 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1i33 h ARG 212 CO -0.76 0.73 0.00 0.41 -1.07 0.00 0.00 179.97 179.27 1i33 n GLY 213 N -1.26 -0.72 0.66 0.04 0.00 0.32 -1.55 105.19 102.68 1i33 n GLY 213 Ca 0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.96 0.58 3.91 -0.02 0.00 -0.68 -4.21 105.19 103.81 1i33 n GLY 214 Ca 0.01 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.69 3.58 -0.54 1.61 1.81 -0.60 0.77 118.95 123.89 1i33 s ARG 215 Ca 0.32 -0.18 -0.26 0.00 -1.72 0.00 0.00 55.73 53.89 1i33 s ARG 215 Cb 0.17 -2.77 -0.15 0.00 -0.45 0.00 0.00 34.95 31.76 1i33 s ARG 215 CO 0.25 0.35 1.73 0.00 -0.68 0.00 0.00 175.30 176.95 1i33 n ALA 216 N -0.63 0.18 -0.08 2.13 0.00 -1.26 -4.51 120.51 116.34 1i33 n ALA 216 Ca -0.03 -0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 1i33 n ALA 216 Cb 0.53 -1.55 -0.04 0.00 0.00 0.00 0.00 19.45 18.40 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 7.51 0.33 0.00 0.00 0.00 -0.99 -3.07 119.26 123.03 1i33 h ALA 217 Ca -0.05 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1i33 h ALA 217 Cb 0.97 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1i33 h ALA 217 CO 0.89 0.03 0.00 0.00 0.00 0.00 0.00 179.25 180.17 1i33 n ALA 218 N -2.33 2.51 -1.99 0.00 0.00 -1.26 -3.52 120.51 113.92 1i33 n ALA 218 Ca -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 53.44 53.32 1i33 n ALA 218 Cb 0.22 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.42 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 -0.80 0.34 -3.82 0.00 3.14 -1.17 -4.73 118.33 111.29 1i33 n VAL 219 Ca 0.13 -0.68 -0.10 0.00 -2.96 0.00 0.00 64.34 60.73 1i33 n VAL 219 Cb 0.06 0.50 -0.08 0.00 -1.06 0.00 0.00 33.84 33.26 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 -1.58 0.00 -0.42 6.55 0.01 -1.18 -5.04 114.94 113.27 1i33 s ASN 220 Ca 0.14 -0.38 -0.16 0.00 -0.71 0.00 0.00 52.86 51.75 1i33 s ASN 220 Cb 0.15 0.33 0.02 0.00 0.41 0.00 0.00 41.25 42.16 1i33 s ASN 220 CO -0.04 -0.62 0.37 -0.63 -1.51 0.00 0.00 177.10 174.67 1i33 s ILE 221 N -2.90 5.18 -0.36 0.60 1.01 -1.26 -4.05 121.20 119.42 1i33 s ILE 221 Ca -0.02 -0.54 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 1i33 s ILE 221 Cb 0.00 -4.00 0.05 0.00 0.01 0.00 0.00 42.46 38.53 1i33 s ILE 221 CO -0.06 -0.38 0.15 -0.63 0.00 0.00 0.00 174.94 174.02 1i33 s ILE 222 N 1.90 3.91 1.02 2.92 1.01 0.23 -4.90 121.20 127.29 1i33 s ILE 222 Ca 0.08 -1.20 -0.12 0.00 0.00 0.00 0.00 60.65 59.41 1i33 s ILE 222 Cb -0.18 -3.27 0.20 0.00 0.01 0.00 0.00 42.46 39.22 1i33 s ILE 222 CO 0.11 -0.27 1.08 -2.84 0.00 0.00 0.00 174.94 173.02 1i33 s PRO 223 N 1.41 0.26 -0.16 2.79 0.02 -1.26 -0.73 135.00 137.32 1i33 s PRO 223 Ca -0.00 0.90 -0.34 0.00 0.02 0.00 0.00 61.00 61.57 1i33 s PRO 223 Cb -0.20 -1.69 0.13 0.00 0.02 0.00 0.00 34.50 32.76 1i33 s PRO 223 CO 0.03 -2.95 1.19 -1.54 -0.33 0.00 0.00 177.00 173.41 1i33 s SER 224 N -2.97 -0.14 0.67 2.53 1.04 0.06 -4.72 113.70 110.17 1i33 s SER 224 Ca 0.66 -0.01 -0.06 0.00 0.48 0.00 0.00 55.95 57.02 1i33 s SER 224 Cb -0.21 0.16 0.05 0.00 0.10 0.00 0.00 66.02 66.11 1i33 s SER 224 CO 0.60 -0.27 0.97 0.42 0.98 0.00 0.00 173.24 175.95 1i33 s THR 225 N -2.47 2.63 -0.27 2.02 -4.23 -1.26 -0.72 115.64 111.34 1i33 s THR 225 Ca 0.10 -0.23 -0.13 0.00 -1.18 0.00 0.00 61.69 60.25 1i33 s THR 225 Cb -0.01 -3.11 0.09 0.00 1.34 0.00 0.00 72.50 70.82 1i33 s THR 225 CO -0.05 -0.11 0.63 0.28 -0.54 0.00 0.00 174.62 174.83 1i33 s THR 226 N -3.15 -0.34 -1.37 3.99 -1.32 -1.26 -4.64 115.64 107.54 1i33 s THR 226 Ca 0.58 0.02 0.29 0.00 -1.21 0.00 0.00 61.69 61.37 1i33 s THR 226 Cb -0.11 -0.94 0.40 0.00 -1.51 0.00 0.00 72.50 70.34 1i33 s THR 226 CO 0.44 0.01 1.91 0.61 -2.21 0.00 0.00 174.62 175.38 1i33 n GLY 227 N 4.72 -1.22 0.42 6.08 0.00 -1.26 -3.86 105.19 110.07 1i33 n GLY 227 Ca -0.17 -0.19 0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 3.36 2.43 0.17 4.61 0.00 -1.94 0.43 119.26 128.31 1i33 h ALA 228 Ca 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1i33 h ALA 228 Cb 0.37 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1i33 h ALA 228 CO 0.00 -0.97 -0.08 0.00 0.00 0.00 0.00 179.25 178.20 1i33 h ALA 229 N 1.65 -0.84 -0.62 0.00 0.00 -1.91 -2.71 119.26 114.82 1i33 h ALA 229 Ca 0.72 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.70 1i33 h ALA 229 Cb 2.03 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 19.83 1i33 h ALA 229 CO -0.40 -0.83 0.16 1.57 0.00 0.00 0.00 179.25 179.75 1i33 h LYS 230 N -0.28 0.28 -0.96 0.00 2.10 -1.49 -1.57 116.57 114.66 1i33 h LYS 230 Ca -0.02 -0.02 0.28 0.00 -2.00 0.00 0.00 60.65 58.89 1i33 h LYS 230 Cb 0.18 -0.06 -0.14 0.00 -0.90 0.00 0.00 32.23 31.30 1i33 h LYS 230 CO 0.04 0.19 0.45 0.00 -2.00 0.00 0.00 179.45 178.13 1i33 h ALA 231 N 1.49 1.69 0.00 0.07 0.00 -0.22 2.07 119.26 124.36 1i33 h ALA 231 Ca 0.33 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1i33 h ALA 231 Cb 0.49 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1i33 h ALA 231 CO -0.40 -0.50 0.18 -0.24 0.00 0.00 0.00 179.25 178.29 1i33 h VAL 232 N 0.31 0.00 -0.24 0.00 3.04 -0.94 0.68 116.25 119.10 1i33 h VAL 232 Ca 0.66 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 66.23 1i33 h VAL 232 Cb 1.42 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 1i33 h VAL 232 CO -0.61 0.00 -0.33 1.23 -1.01 0.00 0.00 177.57 176.85 1i33 h GLY 233 N 0.00 0.56 1.66 3.17 0.00 0.33 0.30 103.07 109.10 1i33 h GLY 233 Ca 0.00 -0.51 -0.14 0.00 0.00 0.00 0.00 47.33 46.67 1i33 h GLY 233 CO 0.00 0.47 -0.53 -0.33 0.00 0.00 0.00 176.54 176.14 1i33 h MET 234 N 0.44 0.36 0.00 4.80 2.86 -0.94 -2.85 114.93 119.60 1i33 h MET 234 Ca 0.05 -0.22 -0.22 0.00 -2.06 0.00 0.00 59.70 57.25 1i33 h MET 234 Cb 0.79 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.44 1i33 h MET 234 CO 0.06 0.80 -1.14 0.28 1.06 0.00 0.00 176.91 177.98 1i33 h VAL 235 N 0.28 1.50 -2.66 -2.22 2.07 -1.47 -3.40 116.25 110.36 1i33 h VAL 235 Ca 0.01 -3.23 -0.60 0.00 0.82 0.00 0.00 66.70 63.69 1i33 h VAL 235 Cb 1.03 2.74 -0.40 0.00 -1.52 0.00 0.00 31.29 33.14 1i33 h VAL 235 CO 0.09 0.86 -0.81 -0.38 0.02 0.00 0.00 177.57 177.35 1i33 n ILE 236 N -3.28 -0.03 -0.22 4.57 5.41 0.08 -4.81 119.36 121.08 1i33 n ILE 236 Ca -0.04 -4.03 0.13 0.00 1.00 0.00 0.00 62.75 59.82 1i33 n ILE 236 Cb 0.96 -1.87 0.25 0.00 -0.71 0.00 0.00 39.64 38.27 1i33 n ILE 236 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1i33 n PRO 237 N 2.46 -0.05 0.00 0.38 -0.02 -1.08 -0.05 135.00 136.64 1i33 n PRO 237 Ca 0.26 0.97 0.03 0.00 -2.02 0.00 0.00 63.50 62.74 1i33 n PRO 237 Cb 0.43 -1.60 0.16 0.00 -0.02 0.00 0.00 33.50 32.47 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 -4.77 0.00 -0.86 2.55 3.41 -1.26 -2.08 113.62 110.62 1i33 n SER 238 Ca 0.18 0.33 0.08 0.00 -0.26 0.00 0.00 58.87 59.20 1i33 n SER 238 Cb 0.61 -0.38 0.20 0.00 -0.26 0.00 0.00 64.21 64.38 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 -1.38 0.87 -1.71 6.66 -2.24 0.93 -4.93 114.28 112.48 1i33 n THR 239 Ca 0.02 -0.94 -0.43 0.00 -2.27 0.00 0.00 64.05 60.44 1i33 n THR 239 Cb 0.07 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 1i33 n THR 239 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1i33 n LYS 240 N 0.92 2.60 -1.15 -0.78 4.76 -0.88 -1.80 118.16 121.83 1i33 n LYS 240 Ca 0.15 0.93 -0.05 0.00 -2.87 0.00 0.00 58.31 56.48 1i33 n LYS 240 Cb 0.48 -2.74 -0.02 0.00 -1.84 0.00 0.00 35.03 30.91 1i33 n LYS 240 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i33 n GLY 241 N 3.38 0.59 0.00 0.72 0.00 -1.26 -4.77 105.19 103.85 1i33 n GLY 241 Ca 0.14 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.76 1.09 -4.46 1.61 5.02 -0.74 -5.02 118.16 114.90 1i33 n LYS 242 Ca -0.05 -0.08 -0.24 0.00 -2.02 0.00 0.00 58.31 55.92 1i33 n LYS 242 Cb 0.43 -1.23 -0.10 0.00 -0.02 0.00 0.00 35.03 34.11 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 -3.51 2.59 -0.30 -0.35 1.02 -1.23 -0.53 118.68 116.37 1i33 s LEU 243 Ca -0.02 -1.03 -0.27 0.00 0.02 0.00 0.00 54.13 52.83 1i33 s LEU 243 Cb 0.08 -1.07 0.20 0.00 0.02 0.00 0.00 46.19 45.42 1i33 s LEU 243 CO 0.50 0.02 1.43 0.28 0.02 0.00 0.00 176.35 178.61 1i33 s THR 244 N -2.55 0.00 0.37 5.49 -1.32 -1.09 -4.33 115.64 112.22 1i33 s THR 244 Ca 0.29 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 60.72 1i33 s THR 244 Cb -0.05 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.97 1i33 s THR 244 CO 0.14 0.00 0.59 0.61 -2.21 0.00 0.00 174.62 173.75 1i33 n GLY 245 N 1.02 1.74 3.36 6.08 0.00 -1.26 -1.76 105.19 114.38 1i33 n GLY 245 Ca -0.05 -1.51 -0.19 0.00 0.00 0.00 0.00 46.02 44.27 1i33 n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1i33 s MET 246 N -2.60 1.57 0.06 1.61 0.23 -0.13 -4.19 119.30 115.85 1i33 s MET 246 Ca 0.26 -1.89 0.05 0.00 -1.03 0.00 0.00 55.69 53.08 1i33 s MET 246 Cb -0.02 -0.28 -0.03 0.00 -1.53 0.00 0.00 34.83 32.97 1i33 s MET 246 CO 0.18 -0.38 -0.15 0.45 -2.03 0.00 0.00 175.02 173.10 1i33 s SER 247 N -3.39 1.76 -0.31 -1.18 0.15 0.10 -1.59 113.70 109.24 1i33 s SER 247 Ca 0.35 -0.55 0.01 0.00 0.70 0.00 0.00 55.95 56.47 1i33 s SER 247 Cb 0.06 -0.09 0.09 0.00 -1.71 0.00 0.00 66.02 64.38 1i33 s SER 247 CO 0.16 -0.01 0.06 -0.36 1.20 0.00 0.00 173.24 174.29 1i33 s PHE 248 N -1.06 2.52 -0.05 3.44 0.08 0.54 -0.76 117.98 122.70 1i33 s PHE 248 Ca 0.01 -2.17 -0.30 0.00 0.12 0.00 0.00 56.93 54.59 1i33 s PHE 248 Cb -0.09 -2.11 -0.04 0.00 -0.57 0.00 0.00 43.02 40.22 1i33 s PHE 248 CO 0.02 -0.88 1.24 1.03 -0.10 0.00 0.00 175.22 176.52 1i33 s ARG 249 N 1.34 4.34 0.09 0.44 1.81 0.09 -1.03 118.95 126.02 1i33 s ARG 249 Ca 0.08 1.72 0.05 0.00 -1.72 0.00 0.00 55.73 55.86 1i33 s ARG 249 Cb -0.18 -3.57 -0.03 0.00 -0.45 0.00 0.00 34.95 30.72 1i33 s ARG 249 CO -0.16 -0.48 -0.14 0.14 -0.68 0.00 0.00 175.30 173.98 1i33 s VAL 250 N 2.28 1.18 0.00 3.52 -7.23 0.15 0.76 120.40 121.06 1i33 s VAL 250 Ca 0.57 -1.44 -0.02 0.00 -1.81 0.00 0.00 61.98 59.28 1i33 s VAL 250 Cb -0.26 -1.23 -0.03 0.00 0.56 0.00 0.00 36.38 35.43 1i33 s VAL 250 CO 0.22 -0.29 0.42 -2.65 -0.31 0.00 0.00 175.10 172.49 1i33 n PRO 251 N 1.03 0.00 -3.72 4.82 -0.02 -1.26 -3.30 135.00 132.55 1i33 n PRO 251 Ca -0.19 -0.18 -0.12 0.00 -2.02 0.00 0.00 63.50 60.99 1i33 n PRO 251 Cb 0.55 -1.33 -0.12 0.00 -0.02 0.00 0.00 33.50 32.58 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 2.64 -0.03 0.48 3.45 -4.23 -1.26 -5.01 115.64 111.68 1i33 s THR 252 Ca 0.05 0.13 0.18 0.00 -1.18 0.00 0.00 61.69 60.86 1i33 s THR 252 Cb 0.01 -0.46 0.34 0.00 1.34 0.00 0.00 72.50 73.73 1i33 s THR 252 CO 0.02 0.05 2.02 1.55 -0.54 0.00 0.00 174.62 177.72 1i33 h PRO 253 N 7.13 0.18 -1.92 3.99 0.13 -1.87 -1.84 132.00 137.81 1i33 h PRO 253 Ca -0.39 -0.01 0.06 0.00 -0.87 0.00 0.00 66.00 64.79 1i33 h PRO 253 Cb 1.17 -0.04 -0.19 0.00 0.13 0.00 0.00 31.00 32.06 1i33 h PRO 253 CO 0.35 0.12 0.45 0.34 -0.23 0.00 0.00 178.00 179.03 1i33 s ASP 254 N -6.40 -0.43 0.00 1.44 2.15 -1.26 -4.67 116.67 107.50 1i33 s ASP 254 Ca -0.06 0.32 0.00 0.00 0.43 0.00 0.00 52.55 53.24 1i33 s ASP 254 Cb 0.19 0.38 0.00 0.00 -0.30 0.00 0.00 42.92 43.19 1i33 s ASP 254 CO 0.73 -0.50 0.00 0.52 -0.17 0.00 0.00 175.17 175.75 1i33 n VAL 255 N 0.42 -0.40 -4.37 1.11 0.31 -1.26 -4.88 118.33 109.26 1i33 n VAL 255 Ca -0.12 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.02 1i33 n VAL 255 Cb 0.59 -0.40 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 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 -0.05 2.54 0.14 4.52 0.01 0.29 -4.08 113.70 117.06 1i33 s SER 256 Ca 0.00 -1.09 0.08 0.00 1.31 0.00 0.00 55.95 56.25 1i33 s SER 256 Cb 0.00 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 1i33 s SER 256 CO 0.00 -0.26 -0.19 0.54 0.41 0.00 0.00 173.24 173.74 1i33 s VAL 257 N -3.04 1.78 -0.09 3.43 0.11 -0.27 -1.11 120.40 121.21 1i33 s VAL 257 Ca 0.25 -1.76 0.03 0.00 -2.93 0.00 0.00 61.98 57.57 1i33 s VAL 257 Cb 0.01 -1.73 0.00 0.00 -1.53 0.00 0.00 36.38 33.14 1i33 s VAL 257 CO 0.08 -0.20 -0.21 -0.69 -3.33 0.00 0.00 175.10 170.76 1i33 s VAL 258 N -1.66 1.80 -0.64 2.04 1.01 0.95 -1.65 120.40 122.24 1i33 s VAL 258 Ca 0.12 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1i33 s VAL 258 Cb -0.08 -1.58 0.17 0.00 0.00 0.00 0.00 36.38 34.89 1i33 s VAL 258 CO 0.06 0.50 0.46 -0.62 0.00 0.00 0.00 175.10 175.50 1i33 s ASP 259 N 0.48 5.29 -0.07 3.32 2.15 -0.15 -1.47 116.67 126.22 1i33 s ASP 259 Ca -0.17 -2.88 -0.23 0.00 0.43 0.00 0.00 52.55 49.70 1i33 s ASP 259 Cb -0.17 -1.87 -0.04 0.00 -0.30 0.00 0.00 42.92 40.54 1i33 s ASP 259 CO 0.07 -0.37 0.68 -0.22 -0.17 0.00 0.00 175.17 175.16 1i33 s LEU 260 N -0.11 4.31 -0.20 -1.34 2.96 0.55 -1.76 118.68 123.09 1i33 s LEU 260 Ca 0.17 1.15 0.01 0.00 -0.22 0.00 0.00 54.13 55.24 1i33 s LEU 260 Cb -0.20 -3.05 0.04 0.00 0.50 0.00 0.00 46.19 43.49 1i33 s LEU 260 CO -0.04 -0.11 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.89 1i33 s THR 261 N 0.80 1.69 0.14 3.68 2.01 -0.21 0.99 115.64 124.75 1i33 s THR 261 Ca 0.36 -1.04 -0.04 0.00 0.31 0.00 0.00 61.69 61.29 1i33 s THR 261 Cb -0.17 -1.76 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1i33 s THR 261 CO 0.17 0.18 0.13 0.72 -0.69 0.00 0.00 174.62 175.13 1i33 s PHE 262 N 1.37 0.70 -0.18 4.92 -0.71 -0.10 -0.53 117.98 123.45 1i33 s PHE 262 Ca -0.01 -1.07 -0.02 0.00 -1.04 0.00 0.00 56.93 54.79 1i33 s PHE 262 Cb -0.16 -0.33 -0.01 0.00 -1.21 0.00 0.00 43.02 41.31 1i33 s PHE 262 CO -0.08 -0.58 -0.09 0.50 -1.34 0.00 0.00 175.22 173.62 1i33 s ARG 263 N -4.02 3.33 0.93 1.99 3.52 -0.92 -0.42 118.95 123.36 1i33 s ARG 263 Ca 0.21 -0.67 -0.12 0.00 -0.13 0.00 0.00 55.73 55.02 1i33 s ARG 263 Cb 0.06 -2.82 0.15 0.00 -1.56 0.00 0.00 34.95 30.78 1i33 s ARG 263 CO 0.01 -0.06 1.10 0.00 -0.81 0.00 0.00 175.30 175.54 1i33 s ALA 264 N 1.08 1.44 -0.05 6.12 0.00 0.02 -1.56 121.76 128.82 1i33 s ALA 264 Ca 0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 51.96 51.55 1i33 s ALA 264 Cb -0.15 -3.11 -0.30 0.00 0.00 0.00 0.00 23.12 19.57 1i33 s ALA 264 CO -0.02 -2.46 0.67 1.15 0.00 0.00 0.00 175.76 175.10 1i33 h THR 265 N -1.62 0.94 -2.11 0.00 2.02 -1.59 -3.41 112.91 107.14 1i33 h THR 265 Ca -0.52 -2.54 -0.61 0.00 0.77 0.00 0.00 66.41 63.51 1i33 h THR 265 Cb 1.31 2.73 -0.14 0.00 -1.74 0.00 0.00 68.15 70.32 1i33 h THR 265 CO 0.58 0.85 -0.73 0.00 0.37 0.00 0.00 175.52 176.60 1i33 s ARG 266 N -2.58 1.73 0.55 6.66 1.70 -1.26 -5.07 118.95 120.68 1i33 s ARG 266 Ca -0.15 -1.84 -0.21 0.00 -0.47 0.00 0.00 55.73 53.05 1i33 s ARG 266 Cb 0.06 -1.73 -0.05 0.00 -0.57 0.00 0.00 34.95 32.66 1i33 s ARG 266 CO 0.85 0.25 1.34 -0.51 -1.08 0.00 0.00 175.30 176.14 1i33 s ASP 267 N -3.55 5.29 0.00 -2.89 1.01 -1.26 -4.82 116.67 110.45 1i33 s ASP 267 Ca 0.31 2.71 0.00 0.00 0.71 0.00 0.00 52.55 56.28 1i33 s ASP 267 Cb -0.02 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.28 1i33 s ASP 267 CO 0.15 -1.55 0.00 1.07 0.21 0.00 0.00 175.17 175.05 1i33 n THR 268 N -1.06 0.00 -4.11 -1.27 5.66 -0.55 -5.05 114.28 107.90 1i33 n THR 268 Ca 0.11 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.01 1i33 n THR 268 Cb 0.46 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.14 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 -0.16 0.24 0.35 1.09 1.04 -1.26 -4.12 113.70 110.88 1i33 s SER 269 Ca 0.00 -1.15 0.15 0.00 0.48 0.00 0.00 55.95 55.43 1i33 s SER 269 Cb 0.00 0.33 0.65 0.00 0.10 0.00 0.00 66.02 67.10 1i33 s SER 269 CO 0.00 -0.78 1.75 -0.29 0.98 0.00 0.00 173.24 174.90 1i33 h ILE 270 N 2.78 1.15 -0.19 -1.02 6.09 -1.93 -2.61 117.51 121.77 1i33 h ILE 270 Ca -0.34 -1.56 -0.16 0.00 -1.37 0.00 0.00 64.86 61.43 1i33 h ILE 270 Cb 1.21 1.88 -0.01 0.00 0.47 0.00 0.00 36.82 40.37 1i33 h ILE 270 CO 0.56 0.42 -0.53 1.56 -3.07 0.00 0.00 178.15 177.10 1i33 h GLN 271 N 0.00 0.56 -0.54 2.19 7.50 -1.97 0.50 115.11 123.35 1i33 h GLN 271 Ca -0.00 -0.34 -0.02 0.00 0.50 0.00 0.00 58.65 58.79 1i33 h GLN 271 Cb 0.85 0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.39 1i33 h GLN 271 CO 0.06 0.95 0.26 0.93 -1.50 0.00 0.00 178.83 179.53 1i33 h GLU 272 N 0.43 0.77 -0.12 1.46 5.08 -1.91 -1.01 114.58 119.29 1i33 h GLU 272 Ca 0.01 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1i33 h GLU 272 Cb 1.07 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1i33 h GLU 272 CO 0.10 0.63 0.05 0.82 -1.00 0.00 0.00 179.01 179.60 1i33 h ILE 273 N 0.72 1.15 -0.58 3.13 2.04 -1.31 -1.67 117.51 120.99 1i33 h ILE 273 Ca 0.18 -0.44 0.09 0.00 1.00 0.00 0.00 64.86 65.69 1i33 h ILE 273 Cb 0.11 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.34 1i33 h ILE 273 CO -0.02 0.13 0.20 -0.78 0.00 0.00 0.00 178.15 177.68 1i33 h ASP 274 N 0.04 0.19 -0.33 1.72 3.58 -0.72 -1.42 116.42 119.47 1i33 h ASP 274 Ca 0.04 0.08 -0.16 0.00 0.42 0.00 0.00 57.03 57.41 1i33 h ASP 274 Cb 0.17 0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.28 1i33 h ASP 274 CO -0.00 0.12 -0.40 0.11 -2.88 0.00 0.00 179.24 176.19 1i33 h LYS 275 N 0.38 0.89 0.40 0.28 1.57 -1.05 -2.68 116.57 116.35 1i33 h LYS 275 Ca 0.29 -0.47 -0.02 0.00 -1.87 0.00 0.00 60.65 58.58 1i33 h LYS 275 Cb 0.36 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1i33 h LYS 275 CO -0.30 1.12 -0.19 0.00 -0.57 0.00 0.00 179.45 179.50 1i33 h ALA 276 N 0.81 -0.54 -0.38 3.86 0.00 -0.81 0.11 119.26 122.31 1i33 h ALA 276 Ca 0.06 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1i33 h ALA 276 Cb 0.98 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1i33 h ALA 276 CO 0.10 -0.80 -0.02 0.82 0.00 0.00 0.00 179.25 179.34 1i33 h ILE 277 N -0.54 0.69 -0.49 0.00 2.04 -1.31 0.53 117.51 118.43 1i33 h ILE 277 Ca -0.05 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1i33 h ILE 277 Cb 0.41 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1i33 h ILE 277 CO 0.09 0.01 0.29 0.11 0.00 0.00 0.00 178.15 178.65 1i33 h LYS 278 N 0.08 0.57 0.09 2.37 1.57 -1.29 0.24 116.57 120.20 1i33 h LYS 278 Ca 0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1i33 h LYS 278 Cb 0.27 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1i33 h LYS 278 CO -0.33 0.37 -0.08 -0.22 -0.57 0.00 0.00 179.45 178.62 1i33 h LYS 279 N 0.58 -0.18 -0.86 3.15 3.11 0.35 -1.19 116.57 121.54 1i33 h LYS 279 Ca 0.20 0.01 0.02 0.00 -2.81 0.00 0.00 60.65 58.07 1i33 h LYS 279 Cb 0.02 0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.25 1i33 h LYS 279 CO -0.09 -0.12 0.57 0.00 -2.81 0.00 0.00 179.45 177.00 1i33 h ALA 280 N 0.72 1.41 0.00 5.00 0.00 0.28 -0.19 119.26 126.48 1i33 h ALA 280 Ca 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1i33 h ALA 280 Cb 0.17 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1i33 h ALA 280 CO -0.01 0.53 -0.12 0.00 0.00 0.00 0.00 179.25 179.65 1i33 h ALA 281 N 1.47 1.31 -0.38 0.00 0.00 0.12 -0.48 119.26 121.29 1i33 h ALA 281 Ca 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1i33 h ALA 281 Cb -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1i33 h ALA 281 CO -0.08 0.15 0.00 1.04 0.00 0.00 0.00 179.25 180.36 1i33 n GLN 282 N -3.67 2.32 0.00 0.00 6.02 -0.13 -2.93 117.38 118.98 1i33 n GLN 282 Ca -0.02 -2.01 0.00 0.00 -0.01 0.00 0.00 57.00 54.97 1i33 n GLN 282 Cb 0.24 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.02 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 1.20 0.00 0.56 5.09 -2.24 -0.61 -4.83 114.28 113.45 1i33 n THR 283 Ca 0.19 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 62.03 1i33 n THR 283 Cb 0.53 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 69.06 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 0.32 4.78 4.11 -1.20 -2.02 117.16 123.15 1i33 n TYR 284 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 57.93 1i33 n TYR 284 Cb 0.00 -0.33 -0.00 0.00 -0.00 0.00 0.00 39.34 39.01 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 -1.33 2.52 -1.57 -3.48 2.81 -0.29 -5.00 117.12 110.78 1i33 n MET 285 Ca 0.05 -0.46 -0.53 0.00 -1.81 0.00 0.00 57.70 54.96 1i33 n MET 285 Cb 0.11 -0.97 -0.06 0.00 -0.71 0.00 0.00 33.22 31.58 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 -0.40 0.96 0.00 0.03 4.81 -0.86 -0.26 118.16 122.45 1i33 n LYS 286 Ca 0.03 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1i33 n LYS 286 Cb 0.14 -1.96 0.00 0.00 0.02 0.00 0.00 35.03 33.24 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 2.33 3.04 0.13 3.14 0.00 -1.26 -4.75 105.19 107.83 1i33 n GLY 287 Ca 0.18 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.40 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 1.54 -4.79 -0.61 2.08 0.65 -4.45 119.36 113.78 1i33 n ILE 288 Ca 0.00 -0.35 -0.33 0.00 0.56 0.00 0.00 62.75 62.64 1i33 n ILE 288 Cb 0.00 -1.84 -0.16 0.00 -0.75 0.00 0.00 39.64 36.89 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 -7.42 2.32 0.42 1.39 1.98 -0.09 -0.55 118.68 116.73 1i33 s LEU 289 Ca -0.35 -0.50 0.04 0.00 -2.89 0.00 0.00 54.13 50.43 1i33 s LEU 289 Cb 0.11 -1.50 -0.02 0.00 0.66 0.00 0.00 46.19 45.44 1i33 s LEU 289 CO 0.55 0.12 0.13 -0.83 -1.89 0.00 0.00 176.35 174.43 1i33 s GLY 290 N 0.61 2.68 0.33 7.98 0.00 0.03 -4.35 107.32 114.59 1i33 s GLY 290 Ca -0.10 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.51 1i33 s GLY 290 CO 0.03 -1.85 0.35 -0.11 0.00 0.00 0.00 173.10 171.51 1i33 s PHE 291 N -3.17 1.45 -0.07 1.90 -0.71 -1.26 -0.17 117.98 115.95 1i33 s PHE 291 Ca 0.22 -1.50 -0.14 0.00 -1.04 0.00 0.00 56.93 54.46 1i33 s PHE 291 Cb 0.02 -0.46 0.03 0.00 -1.21 0.00 0.00 43.02 41.40 1i33 s PHE 291 CO 0.14 -0.96 0.34 -0.08 -1.34 0.00 0.00 175.22 173.32 1i33 s THR 292 N -3.34 0.03 -1.40 -4.49 -1.32 -0.64 -4.86 115.64 99.63 1i33 s THR 292 Ca 0.37 -0.26 0.13 0.00 -1.21 0.00 0.00 61.69 60.71 1i33 s THR 292 Cb 0.02 -0.58 0.06 0.00 -1.51 0.00 0.00 72.50 70.49 1i33 s THR 292 CO 0.24 -0.14 0.82 0.47 -2.21 0.00 0.00 174.62 173.80 1i33 n ASP 293 N 1.96 1.77 -4.93 8.08 8.00 -1.26 -2.37 116.55 127.80 1i33 n ASP 293 Ca -0.18 -1.38 -0.25 0.00 0.71 0.00 0.00 54.79 53.69 1i33 n ASP 293 Cb 0.57 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 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 -1.27 3.35 -1.37 -1.24 2.02 -1.26 -4.74 118.70 114.19 1i33 s GLU 294 Ca 0.13 -0.17 -0.14 0.00 0.02 0.00 0.00 54.97 54.81 1i33 s GLU 294 Cb 0.10 -2.51 0.08 0.00 0.10 0.00 0.00 34.13 31.91 1i33 s GLU 294 CO 0.22 -0.15 1.99 0.39 0.02 0.00 0.00 175.26 177.74 1i33 n GLU 295 N -2.09 3.13 -3.18 1.61 -0.58 -1.26 -4.82 120.64 113.45 1i33 n GLU 295 Ca -0.01 -3.04 -0.23 0.00 -0.42 0.00 0.00 57.16 53.46 1i33 n GLU 295 Cb 0.56 -3.23 -0.00 0.00 -0.57 0.00 0.00 31.44 28.20 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 2.05 3.84 0.21 -4.62 1.43 -1.26 -5.12 118.68 115.21 1i33 s LEU 296 Ca 0.46 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.99 1i33 s LEU 296 Cb 0.10 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 43.02 1i33 s LEU 296 CO -0.03 -0.49 -0.08 0.68 0.23 0.00 0.00 176.35 176.67 1i33 s VAL 297 N -2.43 1.38 0.17 -1.59 -7.23 -1.26 -5.03 120.40 104.40 1i33 s VAL 297 Ca 0.44 -2.11 -0.12 0.00 -1.81 0.00 0.00 61.98 58.39 1i33 s VAL 297 Cb -0.10 -2.16 0.19 0.00 0.56 0.00 0.00 36.38 34.87 1i33 s VAL 297 CO 0.37 -0.50 1.10 -1.54 -0.31 0.00 0.00 175.10 174.22 1i33 n SER 298 N -0.38 -0.44 0.24 4.85 3.41 -1.26 0.70 113.62 120.73 1i33 n SER 298 Ca -0.07 1.24 0.18 0.00 -0.26 0.00 0.00 58.87 59.95 1i33 n SER 298 Cb 0.62 -0.29 0.86 0.00 -0.26 0.00 0.00 64.21 65.14 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 1.03 1.63 0.00 7.33 0.00 -1.96 -0.26 119.26 127.03 1i33 h ALA 299 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1i33 h ALA 299 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1i33 h ALA 299 CO -0.71 -0.34 0.00 -0.25 0.00 0.00 0.00 179.25 177.95 1i33 n ASP 300 N -3.43 0.00 -0.42 0.00 8.00 0.22 -2.45 116.55 118.46 1i33 n ASP 300 Ca 0.01 -0.02 0.07 0.00 0.71 0.00 0.00 54.79 55.56 1i33 n ASP 300 Cb 0.37 -0.29 0.03 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.29 0.00 -1.68 1.24 3.72 -0.11 -4.91 117.46 114.44 1i33 n PHE 301 Ca 0.10 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 57.04 1i33 n PHE 301 Cb 0.18 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.67 1i33 n PHE 301 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1i33 n ILE 302 N 0.28 0.33 -1.09 4.37 5.41 -1.02 -0.25 119.36 127.39 1i33 n ILE 302 Ca 0.07 -0.06 -0.03 0.00 1.00 0.00 0.00 62.75 63.73 1i33 n ILE 302 Cb 0.31 -1.80 -0.01 0.00 -0.71 0.00 0.00 39.64 37.43 1i33 n ILE 302 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1i33 n ASN 303 N 5.27 -3.42 -4.62 4.38 3.02 -1.26 -5.01 115.26 113.63 1i33 n ASN 303 Ca 0.20 0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 54.40 1i33 n ASN 303 Cb 0.31 -1.18 -0.05 0.00 -0.61 0.00 0.00 39.78 38.25 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 -2.83 6.66 -0.11 6.41 -1.08 0.65 -4.94 116.67 121.43 1i33 s ASP 304 Ca 0.00 0.68 0.08 0.00 -0.52 0.00 0.00 52.55 52.78 1i33 s ASP 304 Cb 0.00 -2.40 0.41 0.00 -1.46 0.00 0.00 42.92 39.47 1i33 s ASP 304 CO 0.00 -0.59 1.15 -0.46 0.52 0.00 0.00 175.17 175.80 1i33 n ASN 305 N 6.14 3.28 -4.79 -0.34 2.04 -1.26 -4.05 115.26 116.29 1i33 n ASN 305 Ca 0.03 -2.43 -0.39 0.00 -0.44 0.00 0.00 54.58 51.36 1i33 n ASN 305 Cb 0.48 -0.56 -0.06 0.00 -2.53 0.00 0.00 39.78 37.11 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 -1.86 4.47 0.39 -3.83 3.00 -1.26 -4.74 118.95 115.12 1i33 s ARG 306 Ca 0.28 1.05 0.07 0.00 0.00 0.00 0.00 55.73 57.12 1i33 s ARG 306 Cb 0.20 -3.20 0.81 0.00 0.00 0.00 0.00 34.95 32.76 1i33 s ARG 306 CO 0.09 0.56 2.01 0.77 0.00 0.00 0.00 175.30 178.73 1i33 h SER 307 N 4.22 0.46 -2.87 0.23 0.02 -1.04 -3.43 113.55 111.14 1i33 h SER 307 Ca -0.48 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 60.35 1i33 h SER 307 Cb 1.21 -0.12 -0.26 0.00 0.14 0.00 0.00 62.40 63.37 1i33 h SER 307 CO 0.65 0.39 -0.30 -0.55 -1.14 0.00 0.00 176.83 175.89 1i33 s SER 308 N -6.71 -0.47 -0.32 3.07 0.15 -1.00 -3.94 113.70 104.48 1i33 s SER 308 Ca -0.08 1.01 0.03 0.00 0.70 0.00 0.00 55.95 57.61 1i33 s SER 308 Cb 0.17 1.11 0.09 0.00 -1.71 0.00 0.00 66.02 65.68 1i33 s SER 308 CO 0.74 -0.21 0.03 0.54 1.20 0.00 0.00 173.24 175.54 1i33 s VAL 309 N 1.97 1.94 0.19 4.45 0.11 0.06 -0.79 120.40 128.33 1i33 s VAL 309 Ca -0.06 -2.00 -0.33 0.00 -2.93 0.00 0.00 61.98 56.66 1i33 s VAL 309 Cb -0.10 -2.38 -0.14 0.00 -1.53 0.00 0.00 36.38 32.24 1i33 s VAL 309 CO -0.14 -0.51 1.48 0.00 -3.33 0.00 0.00 175.10 172.61 1i33 n TYR 310 N 4.42 2.16 -3.19 1.54 9.36 0.76 -0.88 117.16 131.33 1i33 n TYR 310 Ca -0.00 0.37 -0.46 0.00 3.32 0.00 0.00 57.90 61.13 1i33 n TYR 310 Cb 0.42 -2.49 -0.03 0.00 -0.63 0.00 0.00 39.34 36.61 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 0.60 6.49 0.08 2.98 -1.08 0.20 -1.61 116.67 124.33 1i33 s ASP 311 Ca 0.75 -2.08 -0.31 0.00 -0.52 0.00 0.00 52.55 50.39 1i33 s ASP 311 Cb -0.69 -2.27 -0.17 0.00 -1.46 0.00 0.00 42.92 38.33 1i33 s ASP 311 CO 0.44 -0.87 1.64 -1.28 0.52 0.00 0.00 175.17 175.62 1i33 h SER 312 N 8.55 -0.70 -0.03 -0.34 0.87 -1.75 -0.72 113.55 119.42 1i33 h SER 312 Ca -0.06 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1i33 h SER 312 Cb 1.06 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 63.20 1i33 h SER 312 CO 0.96 -0.46 -0.06 0.11 -0.53 0.00 0.00 176.83 176.86 1i33 h LYS 313 N -0.73 -0.09 -0.51 2.24 1.79 -1.85 0.17 116.57 117.59 1i33 h LYS 313 Ca -0.06 0.01 0.07 0.00 -2.18 0.00 0.00 60.65 58.49 1i33 h LYS 313 Cb 0.59 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.20 1i33 h LYS 313 CO 0.07 -0.06 0.18 0.00 -1.08 0.00 0.00 179.45 178.57 1i33 h ALA 314 N 0.93 0.63 0.33 3.86 0.00 -1.90 -0.68 119.26 122.43 1i33 h ALA 314 Ca 0.04 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1i33 h ALA 314 Cb 0.14 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1i33 h ALA 314 CO -0.09 -0.21 -0.16 1.15 0.00 0.00 0.00 179.25 179.94 1i33 h THR 315 N 0.36 0.62 -0.97 0.00 2.02 -0.69 -2.57 112.91 111.68 1i33 h THR 315 Ca 0.25 -0.60 0.12 0.00 0.77 0.00 0.00 66.41 66.94 1i33 h THR 315 Cb 0.27 0.91 -0.08 0.00 -1.74 0.00 0.00 68.15 67.50 1i33 h THR 315 CO -0.25 0.11 0.60 -0.07 0.37 0.00 0.00 175.52 176.27 1i33 h LEU 316 N -0.81 0.87 -0.64 2.58 3.38 -0.56 -2.40 115.31 117.71 1i33 h LEU 316 Ca -0.05 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i33 h LEU 316 Cb 0.52 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1i33 h LEU 316 CO 0.08 0.45 -0.00 1.56 0.09 0.00 0.00 178.44 180.61 1i33 h GLN 317 N 0.94 0.00 -0.24 1.13 4.20 -1.10 -3.33 115.11 116.71 1i33 h GLN 317 Ca 0.49 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 59.09 1i33 h GLN 317 Cb 0.50 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.22 1i33 h GLN 317 CO -0.28 0.00 -0.17 0.09 -0.67 0.00 0.00 178.83 177.81 1i33 n ASN 318 N -3.10 2.39 -4.47 1.46 3.02 -0.91 -4.99 115.26 108.67 1i33 n ASN 318 Ca 0.02 -3.71 -0.30 0.00 -0.03 0.00 0.00 54.58 50.57 1i33 n ASN 318 Cb 0.43 -0.59 -0.12 0.00 -0.61 0.00 0.00 39.78 38.89 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 -2.68 3.81 0.17 6.41 0.01 -1.23 -4.94 114.94 116.49 1i33 s ASN 319 Ca 0.42 -0.54 -0.33 0.00 -0.71 0.00 0.00 52.86 51.70 1i33 s ASN 319 Cb 0.38 -0.53 -0.15 0.00 0.41 0.00 0.00 41.25 41.36 1i33 s ASN 319 CO -0.01 0.20 1.28 0.18 -1.51 0.00 0.00 177.10 177.24 1i33 n LEU 320 N 1.04 1.98 -0.22 0.60 4.77 -1.26 -4.88 117.00 119.03 1i33 n LEU 320 Ca -0.16 1.13 -0.05 0.00 -0.03 0.00 0.00 56.01 56.91 1i33 n LEU 320 Cb 0.53 -1.27 0.01 0.00 -2.33 0.00 0.00 43.42 40.36 1i33 n LEU 320 CO 0.27 -1.01 0.63 1.55 -1.33 0.00 0.00 177.39 177.50 1i33 h PRO 321 N 3.99 -0.13 -0.20 3.23 0.13 -1.98 -3.00 132.00 134.04 1i33 h PRO 321 Ca -0.45 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1i33 h PRO 321 Cb 1.32 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1i33 h PRO 321 CO 0.74 -0.09 0.00 0.41 -0.23 0.00 0.00 178.00 178.83 1i33 n GLY 322 N -1.44 4.07 3.69 1.56 0.00 -1.26 -4.98 105.19 106.84 1i33 n GLY 322 Ca 0.05 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.61 1.07 0.00 1.61 4.07 -1.14 -4.96 120.64 120.68 1i33 n GLU 323 Ca 0.19 0.42 0.00 0.00 -0.06 0.00 0.00 57.16 57.70 1i33 n GLU 323 Cb 0.77 -2.42 0.00 0.00 -0.06 0.00 0.00 31.44 29.73 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 -1.60 2.66 0.00 5.31 5.02 -1.26 -4.55 118.16 123.74 1i33 n LYS 324 Ca 0.15 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1i33 n LYS 324 Cb 0.48 -0.49 0.00 0.00 -0.02 0.00 0.00 35.03 35.00 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 -0.41 0.00 -2.83 1.97 5.12 -1.26 -1.48 116.66 117.76 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 0.03 -0.37 -0.04 0.00 -1.16 0.00 0.00 32.46 30.92 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 -1.43 2.94 0.24 -1.55 2.19 -1.26 -0.80 117.98 118.32 1i33 s PHE 326 Ca 0.00 0.40 0.04 0.00 0.33 0.00 0.00 56.93 57.70 1i33 s PHE 326 Cb 0.00 -3.90 -0.05 0.00 -1.31 0.00 0.00 43.02 37.75 1i33 s PHE 326 CO 0.00 -1.06 -0.01 -0.06 1.83 0.00 0.00 175.22 175.92 1i33 s PHE 327 N 3.68 1.65 -0.11 10.12 0.08 0.44 -4.85 117.98 128.99 1i33 s PHE 327 Ca 0.36 -0.89 -0.02 0.00 0.12 0.00 0.00 56.93 56.51 1i33 s PHE 327 Cb -0.10 -0.96 0.04 0.00 -0.57 0.00 0.00 43.02 41.42 1i33 s PHE 327 CO 0.25 0.02 -0.00 0.21 -0.10 0.00 0.00 175.22 175.60 1i33 s LYS 328 N -3.84 0.75 -0.08 0.44 2.20 -1.26 -0.93 119.74 117.02 1i33 s LYS 328 Ca 0.29 -0.09 0.02 0.00 -0.36 0.00 0.00 55.97 55.83 1i33 s LYS 328 Cb 0.06 -1.36 -0.02 0.00 -1.51 0.00 0.00 37.83 34.99 1i33 s LYS 328 CO 0.10 -0.39 -0.12 0.08 -0.36 0.00 0.00 175.35 174.65 1i33 s VAL 329 N 1.90 3.17 -0.16 4.02 1.01 0.28 -4.83 120.40 125.80 1i33 s VAL 329 Ca 0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 1i33 s VAL 329 Cb -0.14 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1i33 s VAL 329 CO -0.06 0.56 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 1i33 s VAL 330 N -0.31 3.08 0.01 2.92 1.01 -1.26 -0.33 120.40 125.51 1i33 s VAL 330 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.38 1i33 s VAL 330 Cb -0.13 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1i33 s VAL 330 CO 0.03 0.50 -0.02 -0.55 0.00 0.00 0.00 175.10 175.06 1i33 s SER 331 N 0.68 0.15 0.35 3.32 0.15 -0.54 0.61 113.70 118.42 1i33 s SER 331 Ca -0.06 -0.14 0.07 0.00 0.70 0.00 0.00 55.95 56.53 1i33 s SER 331 Cb -0.15 0.01 -0.01 0.00 -1.71 0.00 0.00 66.02 64.16 1i33 s SER 331 CO 0.02 -0.06 0.41 0.26 1.20 0.00 0.00 173.24 175.07 1i33 s TRP 332 N -0.37 2.98 -0.28 3.44 0.52 -0.06 -0.04 118.94 125.13 1i33 s TRP 332 Ca -0.03 -0.29 -0.25 0.00 0.02 0.00 0.00 56.10 55.55 1i33 s TRP 332 Cb -0.03 -1.99 0.10 0.00 -1.15 0.00 0.00 33.47 30.40 1i33 s TRP 332 CO -0.00 0.00 0.88 1.52 0.02 0.00 0.00 176.95 179.37 1i33 s TYR 333 N -2.26 -0.63 -1.14 -1.98 1.13 -0.27 -0.76 117.35 111.44 1i33 s TYR 333 Ca 0.45 1.53 -0.17 0.00 -1.41 0.00 0.00 57.07 57.47 1i33 s TYR 333 Cb -0.08 0.32 0.12 0.00 -1.10 0.00 0.00 41.96 41.22 1i33 s TYR 333 CO 0.30 -0.30 1.44 0.34 -2.51 0.00 0.00 175.55 174.82 1i33 s ASP 334 N 0.32 6.83 0.27 -0.18 -1.08 -1.26 -0.55 116.67 121.03 1i33 s ASP 334 Ca 0.01 -2.42 0.17 0.00 -0.52 0.00 0.00 52.55 49.79 1i33 s ASP 334 Cb -0.05 -2.47 0.99 0.00 -1.46 0.00 0.00 42.92 39.93 1i33 s ASP 334 CO -0.03 -1.03 1.13 -0.46 0.52 0.00 0.00 175.17 175.30 1i33 n ASN 335 N 7.00 0.23 -0.05 -0.34 6.94 -1.26 -2.07 115.26 125.72 1i33 n ASN 335 Ca 0.36 1.16 -0.02 0.00 -0.02 0.00 0.00 54.58 56.06 1i33 n ASN 335 Cb 0.46 -0.56 -0.01 0.00 -2.36 0.00 0.00 39.78 37.31 1i33 n ASN 335 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 1i33 h GLU 336 N 0.00 0.00 0.46 -3.83 5.08 -1.97 -3.34 114.58 110.98 1i33 h GLU 336 Ca 0.61 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.96 1i33 h GLU 336 Cb 1.69 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.92 1i33 h GLU 336 CO -0.51 0.00 -0.48 2.35 -1.00 0.00 0.00 179.01 179.37 1i33 h TRP 337 N -0.82 -1.31 0.43 4.33 2.91 -1.76 -2.42 115.95 117.31 1i33 h TRP 337 Ca 0.00 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.02 1i33 h TRP 337 Cb 0.19 0.51 -0.03 0.00 -0.51 0.00 0.00 29.16 29.33 1i33 h TRP 337 CO -0.08 -0.64 -0.49 0.00 -1.03 0.00 0.00 178.44 176.20 1i33 h ALA 338 N -0.73 -1.06 -0.98 2.65 0.00 -1.57 -2.37 119.26 115.19 1i33 h ALA 338 Ca -0.05 -0.17 0.25 0.00 0.00 0.00 0.00 54.91 54.94 1i33 h ALA 338 Cb 0.83 0.72 -0.13 0.00 0.00 0.00 0.00 17.79 19.21 1i33 h ALA 338 CO -0.07 -1.14 0.56 -0.92 0.00 0.00 0.00 179.25 177.67 1i33 h TYR 339 N -0.94 0.94 -0.04 0.00 3.20 -1.68 0.23 116.97 118.69 1i33 h TYR 339 Ca -0.05 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.88 1i33 h TYR 339 Cb 0.83 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 1i33 h TYR 339 CO -0.27 0.02 -0.13 0.77 -1.64 0.00 0.00 178.16 176.92 1i33 h SER 340 N 0.53 -0.37 -0.72 -2.11 0.02 -0.93 -1.49 113.55 108.48 1i33 h SER 340 Ca 0.64 0.06 0.02 0.00 -0.84 0.00 0.00 61.79 61.67 1i33 h SER 340 Cb 1.24 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.90 1i33 h SER 340 CO -0.50 -0.17 0.47 0.45 -1.14 0.00 0.00 176.83 175.94 1i33 h HIS 341 N -0.19 0.87 -0.54 3.45 3.86 -0.60 -2.21 115.15 119.79 1i33 h HIS 341 Ca 0.06 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 1i33 h HIS 341 Cb 0.27 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1i33 h HIS 341 CO -0.20 0.53 0.21 0.00 0.86 0.00 0.00 177.93 179.33 1i33 h ARG 342 N 0.93 0.82 -0.41 2.45 2.47 -0.81 -0.21 114.38 119.61 1i33 h ARG 342 Ca 0.27 -0.15 0.08 0.00 -1.26 0.00 0.00 59.98 58.92 1i33 h ARG 342 Cb -0.04 -0.13 -0.08 0.00 -1.65 0.00 0.00 29.97 28.07 1i33 h ARG 342 CO -0.07 0.72 -0.08 0.28 0.56 0.00 0.00 179.97 181.38 1i33 h VAL 343 N 0.74 0.61 -0.22 2.04 2.07 -0.66 0.20 116.25 121.02 1i33 h VAL 343 Ca 0.18 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 1i33 h VAL 343 Cb 0.21 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1i33 h VAL 343 CO -0.01 0.00 0.14 0.58 0.02 0.00 0.00 177.57 178.30 1i33 h VAL 344 N 0.02 1.08 -0.57 2.57 2.07 -1.27 -1.76 116.25 118.40 1i33 h VAL 344 Ca 0.20 -0.19 0.09 0.00 0.82 0.00 0.00 66.70 67.63 1i33 h VAL 344 Cb 0.30 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.80 1i33 h VAL 344 CO -0.41 0.08 0.19 0.44 0.02 0.00 0.00 177.57 177.89 1i33 h ASP 345 N 0.28 0.15 -0.49 0.57 3.32 0.02 -0.30 116.42 119.97 1i33 h ASP 345 Ca 0.08 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1i33 h ASP 345 Cb 0.01 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1i33 h ASP 345 CO -0.02 0.10 0.32 0.25 -1.72 0.00 0.00 179.24 178.17 1i33 h LEU 346 N 0.35 0.57 0.39 1.55 5.85 -0.25 0.14 115.31 123.91 1i33 h LEU 346 Ca 0.29 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1i33 h LEU 346 Cb 0.37 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1i33 h LEU 346 CO -0.31 0.43 -0.22 0.58 -0.34 0.00 0.00 178.44 178.58 1i33 h VAL 347 N 0.66 0.54 -0.81 1.05 2.07 -0.42 0.24 116.25 119.59 1i33 h VAL 347 Ca 0.18 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.81 1i33 h VAL 347 Cb -0.05 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.18 1i33 h VAL 347 CO -0.04 0.00 0.43 0.03 0.02 0.00 0.00 177.57 178.01 1i33 h ARG 348 N -0.57 0.66 0.41 1.57 3.08 -0.89 0.37 114.38 119.01 1i33 h ARG 348 Ca -0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1i33 h ARG 348 Cb 0.46 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1i33 h ARG 348 CO 0.06 0.44 -0.20 -0.92 -1.07 0.00 0.00 179.97 178.28 1i33 h TYR 349 N 0.68 -0.51 -0.40 3.04 3.20 -0.54 -0.71 116.97 121.74 1i33 h TYR 349 Ca 0.41 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.34 1i33 h TYR 349 Cb 0.47 0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.84 1i33 h TYR 349 CO -0.08 -0.27 -0.04 0.52 -1.64 0.00 0.00 178.16 176.65 1i33 h MET 350 N -0.63 0.06 -0.18 1.82 2.86 0.27 -1.05 114.93 118.07 1i33 h MET 350 Ca -0.06 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.63 1i33 h MET 350 Cb 0.47 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.05 1i33 h MET 350 CO 0.09 0.04 -0.31 0.00 1.06 0.00 0.00 176.91 177.79 1i33 h ALA 351 N 1.37 -0.32 0.23 6.32 0.00 -0.08 0.32 119.26 127.10 1i33 h ALA 351 Ca 0.19 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1i33 h ALA 351 Cb 0.29 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1i33 h ALA 351 CO -0.36 -0.77 -0.37 0.00 0.00 0.00 0.00 179.25 177.74 1i33 h ALA 352 N 0.51 -0.72 -0.45 0.00 0.00 -0.51 -1.19 119.26 116.90 1i33 h ALA 352 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1i33 h ALA 352 Cb 0.53 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1i33 h ALA 352 CO -0.38 -0.95 0.16 -0.22 0.00 0.00 0.00 179.25 177.85 1i33 h LYS 353 N -0.67 0.64 -0.05 0.00 3.64 -0.96 -0.20 116.57 118.97 1i33 h LYS 353 Ca 0.00 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.22 1i33 h LYS 353 Cb 0.65 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1i33 h LYS 353 CO -0.15 0.55 -0.27 -0.44 -2.27 0.00 0.00 179.45 176.87 1i33 h ASP 354 N 0.64 0.08 0.07 4.20 3.32 0.01 -2.37 116.42 122.36 1i33 h ASP 354 Ca 0.15 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 1i33 h ASP 354 Cb 0.16 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.70 1i33 h ASP 354 CO -0.01 0.36 -0.49 0.00 -1.72 0.00 0.00 179.24 177.37 1i33 h ALA 355 N 1.65 -0.03 0.24 3.45 0.00 -0.29 -3.30 119.26 120.98 1i33 h ALA 355 Ca 0.01 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1i33 h ALA 355 Cb 0.52 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1i33 h ALA 355 CO 0.04 0.23 -0.23 0.00 0.00 0.00 0.00 179.25 179.29 1i33 h ALA 356 N 0.12 -0.47 0.00 0.00 0.00 -0.97 -0.36 119.26 117.58 1i33 h ALA 356 Ca -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1i33 h ALA 356 Cb 1.34 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1i33 h ALA 356 CO 0.09 -0.79 0.00 -1.13 0.00 0.00 0.00 179.25 177.42 1i33 n SER 357 N -5.35 0.00 0.00 0.00 3.41 -0.90 -5.11 113.62 105.67 1i33 n SER 357 Ca -0.08 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1i33 n SER 357 Cb 0.26 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1i33 n SER 357 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68