#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1av8 s TYR 2 N 0.00 3.39 -0.01 0.00 5.04 -1.26 -5.00 117.35 119.51 1av8 s TYR 2 Ca 0.00 0.30 0.02 0.00 -2.44 0.00 0.00 57.07 54.95 1av8 s TYR 2 Cb 0.00 -2.00 -0.00 0.00 0.35 0.00 0.00 41.96 40.31 1av8 s TYR 2 CO 0.00 0.44 -0.06 -0.08 -1.34 0.00 0.00 175.55 174.50 1av8 s THR 3 N -0.32 0.52 -1.01 4.34 -1.32 -1.26 -5.03 115.64 111.56 1av8 s THR 3 Ca 0.10 -0.26 0.21 0.00 -1.21 0.00 0.00 61.69 60.53 1av8 s THR 3 Cb -0.12 -0.45 0.18 0.00 -1.51 0.00 0.00 72.50 70.60 1av8 s THR 3 CO 0.01 0.16 1.66 0.35 -2.21 0.00 0.00 174.62 174.59 1av8 n THR 4 N 3.07 0.57 -3.27 5.08 -2.24 -1.26 -4.30 114.28 111.93 1av8 n THR 4 Ca -0.15 0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.71 1av8 n THR 4 Cb 0.57 -0.79 -0.04 0.00 -2.10 0.00 0.00 70.33 67.97 1av8 n THR 4 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1av8 s PHE 5 N -2.99 -1.18 0.06 4.78 5.36 -1.26 -4.88 117.98 117.88 1av8 s PHE 5 Ca 0.10 -0.08 -0.31 0.00 -0.96 0.00 0.00 56.93 55.69 1av8 s PHE 5 Cb 0.14 0.02 -0.07 0.00 -0.34 0.00 0.00 43.02 42.77 1av8 s PHE 5 CO 0.38 -1.09 1.50 -1.54 -1.46 0.00 0.00 175.22 173.01 1av8 s SER 6 N 1.80 6.74 0.31 6.13 1.04 -1.26 -4.91 113.70 123.55 1av8 s SER 6 Ca 0.16 2.32 0.25 0.00 0.48 0.00 0.00 55.95 59.15 1av8 s SER 6 Cb -0.09 -2.57 0.59 0.00 0.10 0.00 0.00 66.02 64.05 1av8 s SER 6 CO -0.08 -0.77 1.69 1.56 0.98 0.00 0.00 173.24 176.62 1av8 h GLN 7 N 7.75 0.00 -6.25 4.02 4.20 -1.98 -3.44 115.11 119.42 1av8 h GLN 7 Ca -0.41 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 57.75 1av8 h GLN 7 Cb 1.19 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.95 1av8 h GLN 7 CO 0.91 0.00 0.86 0.99 -0.67 0.00 0.00 178.83 180.91 1av8 s THR 8 N -3.15 4.09 0.14 -0.54 2.01 -1.26 -4.99 115.64 111.95 1av8 s THR 8 Ca 0.09 1.38 -0.30 0.00 0.31 0.00 0.00 61.69 63.17 1av8 s THR 8 Cb 0.09 -3.89 -0.08 0.00 0.01 0.00 0.00 72.50 68.63 1av8 s THR 8 CO 0.63 -0.07 1.26 -0.75 -0.69 0.00 0.00 174.62 175.00 1av8 s LYS 9 N 3.01 4.42 0.16 4.92 2.20 -1.26 -5.00 119.74 128.19 1av8 s LYS 9 Ca 0.59 1.92 -0.06 0.00 -0.36 0.00 0.00 55.97 58.06 1av8 s LYS 9 Cb -0.25 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 32.79 1av8 s LYS 9 CO 0.20 -0.23 0.21 0.54 -0.36 0.00 0.00 175.35 175.72 1av8 s ASN 10 N 0.58 0.13 -0.60 1.43 4.22 -1.26 -5.10 114.94 114.33 1av8 s ASN 10 Ca 0.57 -1.00 -0.19 0.00 -2.14 0.00 0.00 52.86 50.10 1av8 s ASN 10 Cb -0.33 0.39 0.10 0.00 1.28 0.00 0.00 41.25 42.68 1av8 s ASN 10 CO 0.34 -0.85 0.74 -0.62 -2.04 0.00 0.00 177.10 174.67 1av8 s ASP 11 N -3.00 6.18 0.57 3.54 -1.08 -1.26 -4.91 116.67 116.72 1av8 s ASP 11 Ca 0.20 -1.33 0.27 0.00 -0.52 0.00 0.00 52.55 51.17 1av8 s ASP 11 Cb 0.05 -2.32 1.58 0.00 -1.46 0.00 0.00 42.92 40.77 1av8 s ASP 11 CO 0.01 -1.15 2.09 1.56 0.52 0.00 0.00 175.17 178.20 1av8 h GLN 12 N 9.23 0.00 0.00 4.34 4.20 -1.97 0.11 115.11 131.02 1av8 h GLN 12 Ca -0.29 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.39 1av8 h GLN 12 Cb 1.08 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.86 1av8 h GLN 12 CO 1.11 0.00 -0.11 -0.07 -0.67 0.00 0.00 178.83 179.08 1av8 h LEU 13 N 0.00 0.00 -1.85 1.46 3.38 -1.95 -2.82 115.31 113.54 1av8 h LEU 13 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1av8 h LEU 13 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1av8 h LEU 13 CO -0.00 0.11 0.00 0.29 0.09 0.00 0.00 178.44 178.93 1av8 n LYS 14 N -3.26 2.25 -3.02 1.13 4.01 0.36 -4.87 118.16 114.77 1av8 n LYS 14 Ca 0.00 -1.84 -0.30 0.00 -0.51 0.00 0.00 58.31 55.66 1av8 n LYS 14 Cb 0.37 -1.47 -0.04 0.00 -0.51 0.00 0.00 35.03 33.38 1av8 n LYS 14 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1av8 s GLU 15 N -1.83 3.76 0.64 1.97 0.41 -1.07 -5.06 118.70 117.54 1av8 s GLU 15 Ca 0.33 0.37 -0.11 0.00 -0.41 0.00 0.00 54.97 55.15 1av8 s GLU 15 Cb 0.21 -2.47 -0.03 0.00 -1.78 0.00 0.00 34.13 30.07 1av8 s GLU 15 CO 0.31 0.05 1.04 -1.25 -0.49 0.00 0.00 175.26 174.93 1av8 s PRO 16 N -3.66 3.41 0.27 0.39 0.04 -1.26 -4.94 135.00 129.24 1av8 s PRO 16 Ca 0.50 0.72 -0.03 0.00 0.04 0.00 0.00 61.00 62.23 1av8 s PRO 16 Cb -0.10 -2.06 0.39 0.00 0.04 0.00 0.00 34.50 32.77 1av8 s PRO 16 CO 0.29 -0.70 1.89 0.52 0.04 0.00 0.00 177.00 179.04 1av8 h MET 17 N -0.42 1.17 -5.59 4.56 2.86 -1.92 -3.37 114.93 112.22 1av8 h MET 17 Ca -0.44 -0.07 -0.47 0.00 -2.06 0.00 0.00 59.70 56.66 1av8 h MET 17 Cb 1.20 -0.26 -0.14 0.00 0.06 0.00 0.00 31.60 32.46 1av8 h MET 17 CO 0.62 0.77 -0.72 -0.06 1.06 0.00 0.00 176.91 178.58 1av8 s PHE 18 N -6.05 1.80 0.00 -0.22 0.08 -1.26 -0.80 117.98 111.54 1av8 s PHE 18 Ca -0.13 -0.59 0.00 0.00 0.12 0.00 0.00 56.93 56.34 1av8 s PHE 18 Cb 0.20 -0.88 0.00 0.00 -0.57 0.00 0.00 43.02 41.77 1av8 s PHE 18 CO 0.81 0.36 0.00 1.19 -0.10 0.00 0.00 175.22 177.49 1av8 n PHE 19 N -0.44 0.00 -0.16 0.36 3.72 -0.22 -4.85 117.46 115.86 1av8 n PHE 19 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1av8 n PHE 19 Cb 0.61 -1.66 0.00 0.00 -0.94 0.00 0.00 39.48 37.49 1av8 n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1av8 n GLY 20 N -0.14 0.83 3.73 1.37 0.00 -1.26 -5.01 105.19 104.71 1av8 n GLY 20 Ca 0.00 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 1av8 n GLY 20 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1av8 s GLN 21 N 0.54 4.66 0.51 1.61 0.74 -1.26 -4.90 119.66 121.55 1av8 s GLN 21 Ca 0.00 1.37 -0.22 0.00 0.05 0.00 0.00 55.36 56.56 1av8 s GLN 21 Cb 0.00 -3.37 -0.07 0.00 1.10 0.00 0.00 33.01 30.66 1av8 s GLN 21 CO 0.00 0.23 1.06 -2.30 -0.55 0.00 0.00 175.29 173.73 1av8 n PRO 22 N 2.80 1.28 -2.13 1.67 -0.02 -1.26 -4.54 135.00 132.80 1av8 n PRO 22 Ca 0.01 0.47 -0.41 0.00 -2.02 0.00 0.00 63.50 61.55 1av8 n PRO 22 Cb 0.49 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1av8 n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1av8 s VAL 23 N -1.37 2.97 -0.03 -1.45 1.01 -1.26 -4.60 120.40 115.67 1av8 s VAL 23 Ca 0.69 0.80 -0.08 0.00 0.00 0.00 0.00 61.98 63.39 1av8 s VAL 23 Cb -0.47 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 1av8 s VAL 23 CO 0.52 0.12 -0.16 -0.46 0.00 0.00 0.00 175.10 175.12 1av8 n ASN 24 N 2.50 1.48 -4.75 3.32 0.23 -1.26 -4.53 115.26 112.25 1av8 n ASN 24 Ca 0.06 0.23 -0.39 0.00 -0.53 0.00 0.00 54.58 53.95 1av8 n ASN 24 Cb 0.42 -0.52 -0.05 0.00 -2.08 0.00 0.00 39.78 37.54 1av8 n ASN 24 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1av8 s VAL 25 N -2.41 4.81 -0.63 3.53 1.01 -1.26 -4.94 120.40 120.52 1av8 s VAL 25 Ca -0.13 1.44 -0.16 0.00 0.00 0.00 0.00 61.98 63.13 1av8 s VAL 25 Cb 0.02 -4.03 0.15 0.00 0.00 0.00 0.00 36.38 32.52 1av8 s VAL 25 CO 0.20 0.39 0.60 0.00 0.00 0.00 0.00 175.10 176.30 1av8 s ALA 26 N -0.14 3.73 0.09 5.51 0.00 -1.26 -4.82 121.76 124.87 1av8 s ALA 26 Ca 0.35 -2.72 0.10 0.00 0.00 0.00 0.00 51.96 49.69 1av8 s ALA 26 Cb -0.19 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1av8 s ALA 26 CO 0.20 -2.14 -0.25 -0.98 0.00 0.00 0.00 175.76 172.59 1av8 s ARG 27 N 1.36 1.66 -0.09 0.00 1.70 -1.26 -5.04 118.95 117.28 1av8 s ARG 27 Ca 0.08 -1.21 0.19 0.00 -0.47 0.00 0.00 55.73 54.33 1av8 s ARG 27 Cb -0.24 -1.98 0.42 0.00 -0.57 0.00 0.00 34.95 32.58 1av8 s ARG 27 CO -0.00 0.49 1.19 0.66 -1.08 0.00 0.00 175.30 176.55 1av8 n TYR 28 N 1.28 0.00 0.01 5.89 4.01 -1.26 -4.66 117.16 122.43 1av8 n TYR 28 Ca -0.17 -0.91 -0.06 0.00 -0.16 0.00 0.00 57.90 56.59 1av8 n TYR 28 Cb 0.52 -0.19 -0.12 0.00 -0.31 0.00 0.00 39.34 39.25 1av8 n TYR 28 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1av8 h ASP 29 N 0.97 0.00 -4.75 7.72 2.03 -2.04 -3.47 116.42 116.89 1av8 h ASP 29 Ca -0.13 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 55.93 1av8 h ASP 29 Cb 1.51 0.00 -0.18 0.00 -0.83 0.00 0.00 39.33 39.83 1av8 h ASP 29 CO 0.06 0.91 -0.71 0.00 -1.03 0.00 0.00 179.24 178.46 1av8 s GLN 30 N -2.69 0.64 -0.03 4.15 -2.07 -1.26 -5.16 119.66 113.24 1av8 s GLN 30 Ca -0.03 -1.01 -0.06 0.00 -1.82 0.00 0.00 55.36 52.44 1av8 s GLN 30 Cb 0.08 -0.20 0.01 0.00 -1.09 0.00 0.00 33.01 31.81 1av8 s GLN 30 CO 0.82 0.01 0.14 1.14 -1.32 0.00 0.00 175.29 176.08 1av8 s GLN 31 N -2.61 0.33 -0.05 9.60 0.00 -1.26 -4.93 119.66 120.74 1av8 s GLN 31 Ca -0.01 -0.11 -0.25 0.00 -0.00 0.00 0.00 55.36 54.99 1av8 s GLN 31 Cb -0.03 0.14 -0.22 0.00 0.00 0.00 0.00 33.01 32.91 1av8 s GLN 31 CO -0.02 -0.07 1.10 -0.22 0.00 0.00 0.00 175.29 176.08 1av8 h LYS 32 N 5.07 0.11 -3.83 9.60 3.64 -1.89 -3.41 116.57 125.85 1av8 h LYS 32 Ca -0.28 -0.10 -0.59 0.00 -1.27 0.00 0.00 60.65 58.41 1av8 h LYS 32 Cb 1.20 0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.64 1av8 h LYS 32 CO 0.41 0.78 -0.75 0.71 -2.27 0.00 0.00 179.45 178.32 1av8 s TYR 33 N -3.47 2.10 -2.00 1.91 2.02 -1.26 -5.01 117.35 111.64 1av8 s TYR 33 Ca -0.16 -1.91 0.05 0.00 -0.37 0.00 0.00 57.07 54.68 1av8 s TYR 33 Cb 0.01 -1.88 0.31 0.00 -0.40 0.00 0.00 41.96 40.00 1av8 s TYR 33 CO 0.71 -0.86 0.73 -0.40 -1.57 0.00 0.00 175.55 174.16 1av8 n ASP 34 N 4.74 0.00 -0.23 2.29 5.75 -1.26 -2.87 116.55 124.96 1av8 n ASP 34 Ca -0.02 -0.71 -0.07 0.00 -0.01 0.00 0.00 54.79 53.98 1av8 n ASP 34 Cb 0.43 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.55 1av8 n ASP 34 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1av8 h ILE 35 N 0.00 1.25 -0.36 2.12 6.09 -1.99 -2.19 117.51 122.43 1av8 h ILE 35 Ca 0.00 -0.85 -0.06 0.00 -1.37 0.00 0.00 64.86 62.58 1av8 h ILE 35 Cb 0.00 0.57 -0.02 0.00 0.47 0.00 0.00 36.82 37.84 1av8 h ILE 35 CO 0.00 0.33 -0.05 -0.26 -3.07 0.00 0.00 178.15 175.10 1av8 h PHE 36 N 0.94 0.62 -0.40 2.19 0.04 -1.88 0.66 116.94 119.12 1av8 h PHE 36 Ca 0.21 -0.08 -0.10 0.00 2.80 0.00 0.00 57.97 60.80 1av8 h PHE 36 Cb 0.29 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 1av8 h PHE 36 CO 0.02 0.63 -0.18 1.49 -0.60 0.00 0.00 178.31 179.67 1av8 h GLU 37 N 0.55 0.75 -0.38 1.51 4.57 -1.71 -1.40 114.58 118.48 1av8 h GLU 37 Ca 0.11 -0.28 -0.14 0.00 -1.18 0.00 0.00 59.36 57.88 1av8 h GLU 37 Cb 0.43 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1av8 h GLU 37 CO 0.02 0.88 -0.31 0.87 -1.18 0.00 0.00 179.01 179.29 1av8 h LYS 38 N 0.67 0.83 -0.33 1.92 1.79 -0.62 -0.94 116.57 119.89 1av8 h LYS 38 Ca 0.10 -0.39 -0.02 0.00 -2.18 0.00 0.00 60.65 58.16 1av8 h LYS 38 Cb 0.67 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 1av8 h LYS 38 CO 0.05 1.03 0.12 -0.07 -1.08 0.00 0.00 179.45 179.49 1av8 h LEU 39 N 0.70 0.46 0.05 2.94 3.38 -0.65 -0.15 115.31 122.05 1av8 h LEU 39 Ca 0.08 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1av8 h LEU 39 Cb 0.86 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1av8 h LEU 39 CO 0.08 0.52 -0.13 0.40 0.09 0.00 0.00 178.44 179.40 1av8 h ILE 40 N 0.38 0.70 -0.66 1.22 2.04 -0.97 0.12 117.51 120.33 1av8 h ILE 40 Ca 0.11 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.04 1av8 h ILE 40 Cb 0.21 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 36.93 1av8 h ILE 40 CO -0.01 0.00 0.35 -0.33 0.00 0.00 0.00 178.15 178.16 1av8 h GLU 41 N -0.24 0.61 0.14 2.37 5.08 -1.01 -0.58 114.58 120.94 1av8 h GLU 41 Ca 0.03 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1av8 h GLU 41 Cb 0.27 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1av8 h GLU 41 CO -0.09 0.40 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.04 1av8 h LYS 42 N 0.63 -0.18 -0.80 2.33 1.63 -0.57 -1.79 116.57 117.82 1av8 h LYS 42 Ca 0.31 0.01 0.08 0.00 -0.85 0.00 0.00 60.65 60.20 1av8 h LYS 42 Cb 0.25 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 31.85 1av8 h LYS 42 CO -0.21 0.03 0.46 0.37 -3.45 0.00 0.00 179.45 176.65 1av8 h GLN 43 N -0.37 0.77 -0.57 1.90 5.75 -0.44 -1.51 115.11 120.64 1av8 h GLN 43 Ca -0.02 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.35 1av8 h GLN 43 Cb 0.29 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 1av8 h GLN 43 CO 0.03 0.51 0.01 -0.07 -2.65 0.00 0.00 178.83 176.66 1av8 h LEU 44 N 0.79 0.94 -1.45 -2.39 3.38 -0.98 -2.07 115.31 113.52 1av8 h LEU 44 Ca 0.37 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1av8 h LEU 44 Cb 0.30 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1av8 h LEU 44 CO -0.23 0.99 0.00 0.77 0.09 0.00 0.00 178.44 180.06 1av8 h SER 45 N 0.89 0.00 -0.09 -0.43 4.64 -0.41 -2.43 113.55 115.72 1av8 h SER 45 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1av8 h SER 45 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1av8 h SER 45 CO 0.02 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.47 1av8 n PHE 46 N -3.01 0.10 -1.61 4.77 3.72 -0.66 -4.96 117.46 115.81 1av8 n PHE 46 Ca 0.01 -0.05 -0.53 0.00 -0.05 0.00 0.00 57.45 56.82 1av8 n PHE 46 Cb 0.29 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.77 1av8 n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1av8 n PHE 47 N 0.24 1.56 -3.86 1.38 7.35 -0.92 -4.97 117.46 118.24 1av8 n PHE 47 Ca 0.18 0.65 -0.09 0.00 -0.76 0.00 0.00 57.45 57.42 1av8 n PHE 47 Cb 0.34 -2.34 -0.07 0.00 0.35 0.00 0.00 39.48 37.76 1av8 n PHE 47 CO 0.00 0.00 0.00 1.67 -0.76 0.00 0.00 176.76 177.67 1av8 s TRP 48 N 0.95 0.15 -0.12 -5.13 1.48 -1.26 -5.13 118.94 109.88 1av8 s TRP 48 Ca 0.87 -0.57 0.03 0.00 -1.06 0.00 0.00 56.10 55.37 1av8 s TRP 48 Cb -0.99 -0.06 0.01 0.00 -1.16 0.00 0.00 33.47 31.26 1av8 s TRP 48 CO 0.50 -0.53 -0.21 1.03 -4.06 0.00 0.00 176.95 173.68 1av8 s ARG 49 N -3.78 2.88 0.26 3.25 1.81 -1.26 -5.03 118.95 117.08 1av8 s ARG 49 Ca 0.04 -0.81 -0.02 0.00 -1.72 0.00 0.00 55.73 53.23 1av8 s ARG 49 Cb 0.05 -2.30 0.47 0.00 -0.45 0.00 0.00 34.95 32.71 1av8 s ARG 49 CO -0.11 0.03 1.82 -1.00 -0.68 0.00 0.00 175.30 175.37 1av8 h PRO 50 N 7.17 0.87 -1.06 3.54 0.13 -1.95 -2.38 132.00 138.32 1av8 h PRO 50 Ca -0.29 -0.05 0.28 0.00 -0.87 0.00 0.00 66.00 65.07 1av8 h PRO 50 Cb 1.20 -0.20 -0.11 0.00 0.13 0.00 0.00 31.00 32.03 1av8 h PRO 50 CO 0.52 0.57 0.66 0.93 -0.23 0.00 0.00 178.00 180.46 1av8 h GLU 51 N 0.89 0.39 -0.03 0.86 3.07 -1.96 -0.22 114.58 117.58 1av8 h GLU 51 Ca 0.44 -0.02 0.01 0.00 -0.50 0.00 0.00 59.36 59.29 1av8 h GLU 51 Cb 0.41 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1av8 h GLU 51 CO -0.25 0.26 0.03 0.93 -1.40 0.00 0.00 179.01 178.58 1av8 h GLU 52 N 0.40 0.00 -6.12 2.33 3.07 -1.86 -3.42 114.58 108.97 1av8 h GLU 52 Ca 0.64 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.94 1av8 h GLU 52 Cb 1.55 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.42 1av8 h GLU 52 CO -0.37 0.00 0.08 0.08 -1.40 0.00 0.00 179.01 177.40 1av8 s VAL 53 N -4.79 4.92 -0.34 3.13 1.01 -0.09 -5.02 120.40 119.20 1av8 s VAL 53 Ca -0.05 1.44 -0.24 0.00 0.00 0.00 0.00 61.98 63.13 1av8 s VAL 53 Cb 0.16 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1av8 s VAL 53 CO 0.59 0.33 0.82 -0.62 0.00 0.00 0.00 175.10 176.23 1av8 s ASP 54 N 0.27 6.63 -0.22 3.32 2.15 -1.26 -4.89 116.67 122.67 1av8 s ASP 54 Ca 0.36 0.53 0.11 0.00 0.43 0.00 0.00 52.55 53.97 1av8 s ASP 54 Cb -0.19 -2.42 0.43 0.00 -0.30 0.00 0.00 42.92 40.45 1av8 s ASP 54 CO 0.19 -0.72 1.27 1.33 -0.17 0.00 0.00 175.17 177.07 1av8 n VAL 55 N 5.74 2.27 -0.01 1.11 0.24 -1.26 -4.49 118.33 121.94 1av8 n VAL 55 Ca 0.04 -3.09 -0.13 0.00 -2.04 0.00 0.00 64.34 59.12 1av8 n VAL 55 Cb 0.48 -0.26 -0.10 0.00 -1.47 0.00 0.00 33.84 32.50 1av8 n VAL 55 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1av8 h SER 56 N 0.96 -0.02 0.05 -1.34 4.64 -1.91 -3.22 113.55 112.71 1av8 h SER 56 Ca 0.05 -0.48 -0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1av8 h SER 56 Cb 1.15 0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1av8 h SER 56 CO 0.09 0.48 -0.04 -0.09 -0.87 0.00 0.00 176.83 176.39 1av8 h ARG 57 N -0.53 0.00 -0.44 4.77 2.43 -1.96 -1.96 114.38 116.70 1av8 h ARG 57 Ca -0.00 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.30 1av8 h ARG 57 Cb 0.50 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1av8 h ARG 57 CO 0.00 0.04 0.34 -0.44 -1.51 0.00 0.00 179.97 178.40 1av8 h ASP 58 N 0.00 0.00 -0.82 -3.80 5.19 -1.91 0.07 116.42 115.14 1av8 h ASP 58 Ca -0.00 0.00 0.05 0.00 -0.62 0.00 0.00 57.03 56.46 1av8 h ASP 58 Cb 0.08 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.53 1av8 h ASP 58 CO 0.01 0.00 0.52 -0.09 -3.12 0.00 0.00 179.24 176.55 1av8 h ARG 59 N 0.00 0.95 -0.01 3.56 9.65 -1.48 0.61 114.38 127.66 1av8 h ARG 59 Ca 0.21 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1av8 h ARG 59 Cb 0.89 -0.21 -0.00 0.00 -1.39 0.00 0.00 29.97 29.25 1av8 h ARG 59 CO -0.00 0.63 -0.01 0.82 2.80 0.00 0.00 179.97 184.21 1av8 h ILE 60 N 0.98 1.38 -0.12 1.20 2.04 -1.15 -2.17 117.51 119.67 1av8 h ILE 60 Ca 0.34 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 65.12 1av8 h ILE 60 Cb 0.09 2.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 1av8 h ILE 60 CO -0.14 0.29 -0.13 0.44 0.00 0.00 0.00 178.15 178.61 1av8 h ASP 61 N -0.45 -0.42 -0.56 1.72 3.32 -1.32 -1.44 116.42 117.28 1av8 h ASP 61 Ca 0.00 0.08 0.08 0.00 0.02 0.00 0.00 57.03 57.21 1av8 h ASP 61 Cb 0.48 0.20 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 1av8 h ASP 61 CO 0.00 -0.18 0.19 0.22 -1.72 0.00 0.00 179.24 177.75 1av8 h TYR 62 N -0.17 0.33 -0.54 4.55 3.20 -0.88 -0.88 116.97 122.58 1av8 h TYR 62 Ca 0.09 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1av8 h TYR 62 Cb 0.29 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 1av8 h TYR 62 CO -0.25 0.08 0.24 1.96 -1.64 0.00 0.00 178.16 178.55 1av8 h GLN 63 N 0.36 0.77 0.00 1.82 4.20 -0.91 -2.70 115.11 118.64 1av8 h GLN 63 Ca 0.28 -0.10 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1av8 h GLN 63 Cb 0.33 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1av8 h GLN 63 CO -0.29 0.62 -0.13 0.00 -0.67 0.00 0.00 178.83 178.35 1av8 h ALA 64 N 1.50 0.96 -2.90 3.87 0.00 -0.12 -3.46 119.26 119.11 1av8 h ALA 64 Ca 0.19 -0.12 -0.54 0.00 0.00 0.00 0.00 54.91 54.44 1av8 h ALA 64 Cb 0.12 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 17.99 1av8 h ALA 64 CO -0.02 0.17 0.83 -0.51 0.00 0.00 0.00 179.25 179.71 1av8 s LEU 65 N -6.40 4.32 1.06 0.00 1.43 -0.65 -4.97 118.68 113.46 1av8 s LEU 65 Ca 0.03 3.04 -0.12 0.00 -1.03 0.00 0.00 54.13 56.05 1av8 s LEU 65 Cb 0.08 -3.66 0.22 0.00 0.03 0.00 0.00 46.19 42.87 1av8 s LEU 65 CO 0.63 -0.91 1.07 -2.16 0.23 0.00 0.00 176.35 175.21 1av8 s PRO 66 N -1.54 -0.08 0.14 1.29 0.04 -1.26 -4.66 135.00 128.93 1av8 s PRO 66 Ca 0.57 0.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.05 1av8 s PRO 66 Cb -0.47 -1.66 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 1av8 s PRO 66 CO 0.58 -3.13 1.57 1.05 0.04 0.00 0.00 177.00 177.11 1av8 h GLU 67 N -2.19 -0.40 -0.64 4.56 9.09 -1.97 -1.14 114.58 121.89 1av8 h GLU 67 Ca -0.57 0.03 -0.01 0.00 0.05 0.00 0.00 59.36 58.86 1av8 h GLU 67 Cb 1.32 0.09 -0.03 0.00 -1.65 0.00 0.00 28.75 28.48 1av8 h GLU 67 CO 0.53 -0.26 0.38 1.12 0.05 0.00 0.00 179.01 180.83 1av8 h HIS 68 N -0.41 0.85 -0.17 2.06 2.07 -1.91 -0.28 115.15 117.36 1av8 h HIS 68 Ca 0.10 -0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.51 1av8 h HIS 68 Cb 0.61 -0.28 -0.01 0.00 2.57 0.00 0.00 27.41 30.30 1av8 h HIS 68 CO -0.61 0.58 -0.38 0.93 -3.07 0.00 0.00 177.93 175.38 1av8 h GLU 69 N 0.89 0.37 -0.17 5.12 5.08 -1.74 0.35 114.58 124.47 1av8 h GLU 69 Ca 0.23 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1av8 h GLU 69 Cb -0.02 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1av8 h GLU 69 CO -0.04 0.70 0.04 0.87 -1.00 0.00 0.00 179.01 179.58 1av8 h LYS 70 N 0.31 0.27 -0.18 2.33 1.57 -0.09 -1.46 116.57 119.32 1av8 h LYS 70 Ca 0.03 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1av8 h LYS 70 Cb 0.82 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.03 1av8 h LYS 70 CO 0.07 0.41 -0.22 1.25 -0.57 0.00 0.00 179.45 180.39 1av8 h HIS 71 N 0.09 -0.58 -0.12 -1.35 2.76 -0.58 0.22 115.15 115.60 1av8 h HIS 71 Ca 0.05 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.30 1av8 h HIS 71 Cb 0.26 0.28 -0.06 0.00 1.55 0.00 0.00 27.41 29.45 1av8 h HIS 71 CO 0.01 -0.30 -0.23 0.82 -1.30 0.00 0.00 177.93 176.93 1av8 h ILE 72 N -0.25 0.44 0.42 6.26 2.04 -0.75 -0.53 117.51 125.13 1av8 h ILE 72 Ca 0.12 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 1av8 h ILE 72 Cb 0.43 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1av8 h ILE 72 CO -0.33 0.00 -0.20 0.15 0.00 0.00 0.00 178.15 177.77 1av8 h PHE 73 N -0.30 -0.52 -0.62 1.37 3.04 -0.60 -2.68 116.94 116.64 1av8 h PHE 73 Ca 0.10 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.02 1av8 h PHE 73 Cb 0.44 0.17 -0.03 0.00 2.56 0.00 0.00 35.95 39.10 1av8 h PHE 73 CO -0.33 -0.27 0.31 0.97 -2.02 0.00 0.00 178.31 176.97 1av8 h ILE 74 N -0.65 1.21 -0.65 1.41 6.09 -0.50 -1.63 117.51 122.78 1av8 h ILE 74 Ca -0.06 -0.58 0.03 0.00 -1.37 0.00 0.00 64.86 62.88 1av8 h ILE 74 Cb 0.48 0.46 -0.04 0.00 0.47 0.00 0.00 36.82 38.19 1av8 h ILE 74 CO 0.09 0.24 0.40 0.28 -3.07 0.00 0.00 178.15 176.10 1av8 h SER 75 N 0.85 0.66 -0.49 2.19 0.02 -1.13 0.18 113.55 115.82 1av8 h SER 75 Ca 0.21 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1av8 h SER 75 Cb 0.10 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1av8 h SER 75 CO -0.03 0.46 0.26 -1.13 -1.14 0.00 0.00 176.83 175.25 1av8 h ASN 76 N 0.79 0.62 -0.39 3.07 -1.24 -1.26 -1.71 115.58 115.46 1av8 h ASN 76 Ca 0.26 -0.10 -0.02 0.00 0.71 0.00 0.00 56.30 57.16 1av8 h ASN 76 Cb 0.02 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 38.90 1av8 h ASN 76 CO -0.11 0.54 0.17 0.25 -1.29 0.00 0.00 177.43 177.00 1av8 h LEU 77 N 0.65 0.52 -0.83 0.34 5.85 -0.70 -1.85 115.31 119.31 1av8 h LEU 77 Ca 0.17 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1av8 h LEU 77 Cb 0.06 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 1av8 h LEU 77 CO -0.03 0.52 0.54 0.11 -0.34 0.00 0.00 178.44 179.25 1av8 h LYS 78 N 0.49 1.06 0.33 1.25 1.57 -0.80 -0.81 116.57 119.67 1av8 h LYS 78 Ca 0.13 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1av8 h LYS 78 Cb 0.15 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1av8 h LYS 78 CO -0.01 0.70 -0.16 -0.92 -0.57 0.00 0.00 179.45 178.49 1av8 h TYR 79 N 1.09 -0.41 -0.42 -1.35 3.20 -1.04 -2.19 116.97 115.84 1av8 h TYR 79 Ca 0.31 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.25 1av8 h TYR 79 Cb -0.09 0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.25 1av8 h TYR 79 CO -0.02 -0.21 0.01 1.96 -1.64 0.00 0.00 178.16 178.26 1av8 h GLN 80 N -0.52 0.12 -0.89 1.82 4.20 -1.10 -0.75 115.11 117.98 1av8 h GLN 80 Ca -0.05 -0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.81 1av8 h GLN 80 Cb 0.39 -0.03 -0.09 0.00 0.30 0.00 0.00 27.48 28.05 1av8 h GLN 80 CO 0.08 0.08 0.49 1.15 -0.67 0.00 0.00 178.83 179.95 1av8 h THR 81 N 0.12 0.75 0.06 -0.54 2.02 -0.97 -0.88 112.91 113.47 1av8 h THR 81 Ca 0.21 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1av8 h THR 81 Cb 0.30 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1av8 h THR 81 CO -0.34 0.13 -0.03 0.25 0.37 0.00 0.00 175.52 175.90 1av8 h LEU 82 N 0.69 -0.06 -0.72 2.58 6.46 -0.61 -1.91 115.31 121.74 1av8 h LEU 82 Ca 0.49 -0.37 0.06 0.00 -0.12 0.00 0.00 57.88 57.94 1av8 h LEU 82 Cb 0.67 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.56 1av8 h LEU 82 CO -0.35 0.34 0.41 -0.07 -0.62 0.00 0.00 178.44 178.16 1av8 h LEU 83 N -0.48 0.63 -0.48 2.25 3.38 -0.59 -1.25 115.31 118.77 1av8 h LEU 83 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1av8 h LEU 83 Cb 0.43 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1av8 h LEU 83 CO 0.01 0.40 0.00 0.44 0.09 0.00 0.00 178.44 179.39 1av8 h ASP 84 N 0.76 0.00 -0.23 -0.43 3.32 -1.22 0.47 116.42 119.10 1av8 h ASP 84 Ca 0.32 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.29 1av8 h ASP 84 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 1av8 h ASP 84 CO -0.18 0.00 -0.17 0.28 -1.72 0.00 0.00 179.24 177.45 1av8 h SER 85 N 0.00 0.55 -0.13 6.45 0.02 -0.41 -0.00 113.55 120.03 1av8 h SER 85 Ca 0.00 -0.45 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 1av8 h SER 85 Cb 0.76 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 1av8 h SER 85 CO 0.00 0.88 0.01 0.40 -1.14 0.00 0.00 176.83 176.98 1av8 h ILE 86 N 0.22 1.23 0.00 3.27 2.04 -1.15 -2.83 117.51 120.30 1av8 h ILE 86 Ca 0.04 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 1av8 h ILE 86 Cb 0.71 1.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1av8 h ILE 86 CO 0.05 0.22 -0.01 1.56 0.00 0.00 0.00 178.15 179.97 1av8 h GLN 87 N -0.03 0.00 0.14 2.37 1.08 -0.86 -1.08 115.11 116.73 1av8 h GLN 87 Ca 0.04 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 1av8 h GLN 87 Cb 0.33 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1av8 h GLN 87 CO 0.00 0.01 -0.07 0.78 -0.95 0.00 0.00 178.83 178.60 1av8 h GLY 88 N 0.49 -0.20 0.93 3.46 0.00 -0.73 -3.39 103.07 103.64 1av8 h GLY 88 Ca -0.00 0.07 -0.32 0.00 0.00 0.00 0.00 47.33 47.08 1av8 h GLY 88 CO 0.00 -0.07 -1.76 0.07 0.00 0.00 0.00 176.54 174.78 1av8 h ARG 89 N -0.69 0.19 -0.15 4.80 0.11 -1.54 -3.42 114.38 113.67 1av8 h ARG 89 Ca -0.02 -0.32 0.03 0.00 0.10 0.00 0.00 59.98 59.77 1av8 h ARG 89 Cb 0.51 0.12 -0.03 0.00 1.11 0.00 0.00 29.97 31.68 1av8 h ARG 89 CO 0.03 0.98 -0.02 0.77 0.10 0.00 0.00 179.97 181.83 1av8 h SER 90 N 0.05 -0.10 -0.70 0.08 0.02 -1.38 -2.16 113.55 109.36 1av8 h SER 90 Ca -0.32 0.04 0.12 0.00 -0.84 0.00 0.00 61.79 60.79 1av8 h SER 90 Cb 2.02 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 64.60 1av8 h SER 90 CO 0.11 -0.03 0.47 -0.65 -1.14 0.00 0.00 176.83 175.59 1av8 h PRO 91 N 0.02 0.43 0.22 3.45 0.11 -1.81 -0.77 132.00 133.66 1av8 h PRO 91 Ca 0.07 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 1av8 h PRO 91 Cb 0.10 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1av8 h PRO 91 CO -0.14 0.28 -0.11 -0.91 -0.21 0.00 0.00 178.00 176.92 1av8 h ASN 92 N 0.44 -0.26 -0.09 -2.05 2.35 -1.73 -2.02 115.58 112.23 1av8 h ASN 92 Ca 0.33 -0.27 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 1av8 h ASN 92 Cb 0.69 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 1av8 h ASN 92 CO -0.10 0.23 -0.27 -0.37 -1.65 0.00 0.00 177.43 175.26 1av8 h VAL 93 N -0.84 1.27 0.13 2.81 -1.51 -1.21 -3.04 116.25 113.85 1av8 h VAL 93 Ca -0.03 -1.34 -0.30 0.00 -1.23 0.00 0.00 66.70 63.80 1av8 h VAL 93 Cb 0.51 1.36 -0.00 0.00 -2.13 0.00 0.00 31.29 31.03 1av8 h VAL 93 CO 0.05 0.43 -1.54 0.00 -1.23 0.00 0.00 177.57 175.28 1av8 h ALA 94 N 1.23 0.20 0.05 5.19 0.00 -1.25 -3.42 119.26 121.27 1av8 h ALA 94 Ca 0.06 -1.14 -0.35 0.00 0.00 0.00 0.00 54.91 53.49 1av8 h ALA 94 Cb 0.72 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 1av8 h ALA 94 CO 0.06 0.91 -2.08 1.28 0.00 0.00 0.00 179.25 179.42 1av8 n LEU 95 N -3.83 1.96 -0.24 0.00 4.77 -0.76 -4.48 117.00 114.43 1av8 n LEU 95 Ca -0.26 0.16 0.04 0.00 -0.03 0.00 0.00 56.01 55.92 1av8 n LEU 95 Cb 0.94 -0.57 0.16 0.00 -2.33 0.00 0.00 43.42 41.63 1av8 n LEU 95 CO 0.42 0.72 0.95 0.25 -1.33 0.00 0.00 177.39 178.40 1av8 h LEU 96 N 0.03 0.09 0.00 2.23 5.85 -1.53 -0.54 115.31 121.44 1av8 h LEU 96 Ca -0.44 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1av8 h LEU 96 Cb 2.03 0.15 0.00 0.00 0.37 0.00 0.00 40.66 43.21 1av8 h LEU 96 CO 0.04 0.02 0.00 -2.65 -0.34 0.00 0.00 178.44 175.51 1av8 n PRO 97 N -5.10 0.36 0.00 5.25 -0.02 -1.26 -2.78 135.00 131.45 1av8 n PRO 97 Ca 0.13 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1av8 n PRO 97 Cb 0.40 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1av8 n PRO 97 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1av8 n LEU 98 N -1.02 0.17 -4.78 2.45 4.77 -0.24 -4.99 117.00 113.37 1av8 n LEU 98 Ca 0.09 -0.55 -0.37 0.00 -0.03 0.00 0.00 56.01 55.15 1av8 n LEU 98 Cb 0.04 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1av8 n LEU 98 CO 0.07 0.04 0.79 -0.63 -1.33 0.00 0.00 177.39 176.33 1av8 s ILE 99 N -0.75 3.33 0.00 -0.08 1.01 -1.06 -1.06 121.20 122.60 1av8 s ILE 99 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 60.65 61.64 1av8 s ILE 99 Cb 0.00 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.97 1av8 s ILE 99 CO 0.00 -0.02 0.34 -1.20 0.00 0.00 0.00 174.94 174.05 1av8 n SER 100 N -0.41 0.67 -4.13 3.58 7.64 0.02 -4.09 113.62 116.90 1av8 n SER 100 Ca 0.07 -0.93 -0.25 0.00 1.01 0.00 0.00 58.87 58.77 1av8 n SER 100 Cb 0.49 0.08 -0.16 0.00 -1.01 0.00 0.00 64.21 63.61 1av8 n SER 100 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1av8 s ILE 101 N -0.08 1.33 0.16 0.44 -4.36 -1.26 -4.56 121.20 112.86 1av8 s ILE 101 Ca 0.00 -0.69 -0.20 0.00 -0.26 0.00 0.00 60.65 59.50 1av8 s ILE 101 Cb 0.00 -1.12 0.06 0.00 1.25 0.00 0.00 42.46 42.65 1av8 s ILE 101 CO 0.00 0.38 1.64 1.55 0.24 0.00 0.00 174.94 178.75 1av8 h PRO 102 N 5.98 -0.16 -0.77 0.37 0.13 -1.89 -2.23 132.00 133.44 1av8 h PRO 102 Ca -0.35 0.01 0.16 0.00 -0.87 0.00 0.00 66.00 64.95 1av8 h PRO 102 Cb 1.16 0.04 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 1av8 h PRO 102 CO 0.48 -0.11 0.27 1.05 -0.23 0.00 0.00 178.00 179.46 1av8 h GLU 103 N -0.17 0.36 -0.13 0.86 4.11 -1.92 -0.55 114.58 117.14 1av8 h GLU 103 Ca 0.16 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 59.51 1av8 h GLU 103 Cb 0.41 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1av8 h GLU 103 CO -0.41 0.24 -0.13 1.25 0.07 0.00 0.00 179.01 180.03 1av8 h LEU 104 N 0.37 0.34 -0.19 3.06 5.85 -1.88 -1.54 115.31 121.33 1av8 h LEU 104 Ca 0.44 -0.48 0.05 0.00 0.84 0.00 0.00 57.88 58.73 1av8 h LEU 104 Cb 0.72 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.59 1av8 h LEU 104 CO -0.46 0.75 -0.27 -0.08 -0.34 0.00 0.00 178.44 178.05 1av8 h GLU 105 N -0.06 -0.29 -0.75 1.25 4.81 -0.70 0.14 114.58 118.98 1av8 h GLU 105 Ca 0.02 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1av8 h GLU 105 Cb 0.66 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1av8 h GLU 105 CO 0.03 -0.20 0.29 1.15 -0.73 0.00 0.00 179.01 179.55 1av8 h THR 106 N -0.30 1.26 -0.30 0.32 2.02 -1.18 -1.86 112.91 112.86 1av8 h THR 106 Ca 0.12 -0.83 0.01 0.00 0.77 0.00 0.00 66.41 66.48 1av8 h THR 106 Cb 0.49 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1av8 h THR 106 CO -0.36 0.33 0.17 -0.25 0.37 0.00 0.00 175.52 175.78 1av8 h TRP 107 N 1.09 0.32 -0.76 3.16 2.91 -0.44 0.40 115.95 122.63 1av8 h TRP 107 Ca 0.25 0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.33 1av8 h TRP 107 Cb 0.24 -0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 28.73 1av8 h TRP 107 CO 0.02 0.19 0.46 0.28 -1.03 0.00 0.00 178.44 178.36 1av8 h VAL 108 N 0.35 1.04 -0.68 2.65 2.07 -0.38 0.19 116.25 121.50 1av8 h VAL 108 Ca 0.12 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 1av8 h VAL 108 Cb 0.01 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 29.86 1av8 h VAL 108 CO -0.06 0.16 0.12 -0.33 0.02 0.00 0.00 177.57 177.47 1av8 h GLU 109 N 0.86 1.12 -0.45 1.57 5.08 -0.74 -0.10 114.58 121.91 1av8 h GLU 109 Ca 0.32 -0.30 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1av8 h GLU 109 Cb 0.12 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1av8 h GLU 109 CO -0.15 1.02 -0.18 1.15 -1.00 0.00 0.00 179.01 179.85 1av8 h THR 110 N 1.04 1.27 0.17 1.13 2.02 -0.20 -1.09 112.91 117.26 1av8 h THR 110 Ca 0.21 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 1av8 h THR 110 Cb 0.44 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1av8 h THR 110 CO 0.01 0.45 -0.08 -0.25 0.37 0.00 0.00 175.52 176.02 1av8 h TRP 111 N 0.75 -0.21 -0.77 3.16 7.01 -0.50 -1.61 115.95 123.79 1av8 h TRP 111 Ca 0.11 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.16 1av8 h TRP 111 Cb 0.74 0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 27.81 1av8 h TRP 111 CO 0.05 -0.01 0.46 0.00 -2.79 0.00 0.00 178.44 176.15 1av8 h ALA 112 N 0.43 1.06 -0.38 2.65 0.00 -0.94 -2.41 119.26 119.66 1av8 h ALA 112 Ca -0.02 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1av8 h ALA 112 Cb 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1av8 h ALA 112 CO 0.04 0.16 0.24 0.35 0.00 0.00 0.00 179.25 180.03 1av8 h PHE 113 N 0.82 0.45 -0.02 0.00 3.57 -0.98 -2.23 116.94 118.56 1av8 h PHE 113 Ca 0.34 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.84 1av8 h PHE 113 Cb 0.20 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 1av8 h PHE 113 CO -0.06 0.28 -0.05 0.66 -2.23 0.00 0.00 178.31 176.91 1av8 h SER 114 N 0.49 0.03 -0.21 0.41 4.64 -0.81 -1.08 113.55 117.01 1av8 h SER 114 Ca 0.15 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.41 1av8 h SER 114 Cb -0.03 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1av8 h SER 114 CO -0.05 0.08 -0.04 -0.33 -0.87 0.00 0.00 176.83 175.62 1av8 h GLU 115 N 0.03 0.54 -0.42 4.77 4.39 -1.09 -1.81 114.58 120.99 1av8 h GLU 115 Ca 0.01 -0.13 -0.08 0.00 0.34 0.00 0.00 59.36 59.49 1av8 h GLU 115 Cb 0.11 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1av8 h GLU 115 CO 0.01 0.59 -0.09 1.79 -1.16 0.00 0.00 179.01 180.15 1av8 h THR 116 N 0.51 1.25 -0.31 1.13 1.35 -1.01 -0.27 112.91 115.57 1av8 h THR 116 Ca 0.10 -1.10 -0.05 0.00 -0.55 0.00 0.00 66.41 64.81 1av8 h THR 116 Cb 0.39 1.02 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 1av8 h THR 116 CO 0.02 0.37 -0.03 0.40 -0.25 0.00 0.00 175.52 176.03 1av8 h ILE 117 N 0.66 1.20 0.03 6.82 1.08 -1.23 -0.20 117.51 125.87 1av8 h ILE 117 Ca 0.12 -0.80 -0.00 0.00 -0.39 0.00 0.00 64.86 63.79 1av8 h ILE 117 Cb 0.54 1.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1av8 h ILE 117 CO 0.03 0.27 -0.01 0.45 -0.69 0.00 0.00 178.15 178.20 1av8 h HIS 118 N 0.46 -0.04 -0.92 1.37 3.86 -0.42 -1.81 115.15 117.65 1av8 h HIS 118 Ca 0.10 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.40 1av8 h HIS 118 Cb 0.35 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.76 1av8 h HIS 118 CO 0.01 0.26 0.59 0.77 0.86 0.00 0.00 177.93 180.42 1av8 h SER 119 N -0.34 0.84 -0.67 2.45 0.02 -0.60 -0.35 113.55 114.90 1av8 h SER 119 Ca -0.00 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 1av8 h SER 119 Cb 0.31 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 1av8 h SER 119 CO 0.01 0.49 0.14 0.03 -1.14 0.00 0.00 176.83 176.36 1av8 h ARG 120 N 0.92 1.10 -0.09 3.45 3.08 -0.86 -2.07 114.38 119.92 1av8 h ARG 120 Ca 0.43 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 60.13 1av8 h ARG 120 Cb 0.40 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1av8 h ARG 120 CO -0.19 0.99 -0.26 0.66 -1.07 0.00 0.00 179.97 180.10 1av8 h SER 121 N 1.04 0.15 -0.51 7.04 4.64 -0.21 -0.36 113.55 125.34 1av8 h SER 121 Ca 0.21 -0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.40 1av8 h SER 121 Cb 0.40 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1av8 h SER 121 CO 0.01 0.42 -0.01 1.88 -0.87 0.00 0.00 176.83 178.25 1av8 h TYR 122 N 0.14 1.00 0.07 4.77 0.05 -0.66 -1.16 116.97 121.18 1av8 h TYR 122 Ca 0.02 -0.18 -0.00 0.00 0.05 0.00 0.00 58.73 58.62 1av8 h TYR 122 Cb 0.55 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 38.03 1av8 h TYR 122 CO 0.01 0.93 -0.03 1.15 -1.05 0.00 0.00 178.16 179.16 1av8 h THR 123 N 0.78 0.97 -1.02 -2.88 2.02 -0.91 -0.96 112.91 110.91 1av8 h THR 123 Ca 0.14 -0.12 0.25 0.00 0.77 0.00 0.00 66.41 67.45 1av8 h THR 123 Cb 0.54 1.05 -0.10 0.00 -1.74 0.00 0.00 68.15 67.90 1av8 h THR 123 CO 0.03 0.03 0.64 -0.74 0.37 0.00 0.00 175.52 175.85 1av8 h HIS 124 N -0.15 0.78 0.09 3.16 -0.00 -0.69 0.94 115.15 119.28 1av8 h HIS 124 Ca -0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1av8 h HIS 124 Cb 0.12 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.31 1av8 h HIS 124 CO -0.06 0.09 -0.04 0.82 -0.00 0.00 0.00 177.93 178.74 1av8 h ILE 125 N 0.48 0.62 -0.67 6.26 2.04 -0.87 -3.13 117.51 122.24 1av8 h ILE 125 Ca 0.60 -1.30 0.14 0.00 1.00 0.00 0.00 64.86 65.30 1av8 h ILE 125 Cb 1.36 1.13 -0.10 0.00 -0.74 0.00 0.00 36.82 38.46 1av8 h ILE 125 CO -0.34 0.19 0.13 0.40 0.00 0.00 0.00 178.15 178.54 1av8 h ILE 126 N -0.98 0.56 -0.96 -0.67 2.04 -0.74 -0.34 117.51 116.42 1av8 h ILE 126 Ca -0.01 -0.08 0.07 0.00 1.00 0.00 0.00 64.86 65.83 1av8 h ILE 126 Cb 0.41 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1av8 h ILE 126 CO 0.02 0.04 0.61 -0.09 0.00 0.00 0.00 178.15 178.74 1av8 h ARG 127 N 0.25 1.06 -0.01 2.37 2.43 -0.95 -2.13 114.38 117.39 1av8 h ARG 127 Ca 0.36 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1av8 h ARG 127 Cb 0.59 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1av8 h ARG 127 CO -0.47 0.70 -0.04 0.09 -1.51 0.00 0.00 179.97 178.74 1av8 n ASN 128 N -4.55 1.38 0.00 -3.80 5.03 -0.18 -4.33 115.26 108.80 1av8 n ASN 128 Ca 0.15 -1.39 0.00 0.00 0.87 0.00 0.00 54.58 54.21 1av8 n ASN 128 Cb 0.20 0.02 0.00 0.00 -1.02 0.00 0.00 39.78 38.98 1av8 n ASN 128 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 1av8 n ILE 129 N 0.01 0.00 -3.87 2.41 -5.35 -0.93 -4.28 119.36 107.36 1av8 n ILE 129 Ca 0.18 0.00 -0.21 0.00 -0.27 0.00 0.00 62.75 62.45 1av8 n ILE 129 Cb 0.35 -0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.22 1av8 n ILE 129 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1av8 s VAL 130 N -1.66 4.74 -0.17 7.28 1.01 -0.82 -4.84 120.40 125.94 1av8 s VAL 130 Ca 0.00 -1.08 -0.21 0.00 0.00 0.00 0.00 61.98 60.69 1av8 s VAL 130 Cb 0.00 -3.64 -0.18 0.00 0.00 0.00 0.00 36.38 32.56 1av8 s VAL 130 CO 0.00 -0.28 0.34 0.78 0.00 0.00 0.00 175.10 175.94 1av8 h ASN 131 N 1.16 0.00 -3.83 3.32 2.35 -1.89 -3.44 115.58 113.26 1av8 h ASN 131 Ca -0.49 -0.57 -0.67 0.00 -0.55 0.00 0.00 56.30 54.01 1av8 h ASN 131 Cb 1.24 0.00 -0.38 0.00 0.05 0.00 0.00 38.32 39.23 1av8 h ASN 131 CO 0.59 1.15 -0.58 -0.62 -1.65 0.00 0.00 177.43 176.31 1av8 s ASP 132 N -6.39 4.93 0.51 5.81 2.15 -1.26 -4.96 116.67 117.46 1av8 s ASP 132 Ca -0.21 -2.40 0.28 0.00 0.43 0.00 0.00 52.55 50.65 1av8 s ASP 132 Cb 0.02 -1.74 1.38 0.00 -0.30 0.00 0.00 42.92 42.28 1av8 s ASP 132 CO 0.53 -0.41 1.88 -0.65 -0.17 0.00 0.00 175.17 176.36 1av8 h PRO 133 N 7.45 0.10 -0.40 4.34 0.11 -1.86 -1.44 132.00 140.29 1av8 h PRO 133 Ca -0.07 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 1av8 h PRO 133 Cb 0.99 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 1av8 h PRO 133 CO 0.64 0.06 0.24 1.03 -0.21 0.00 0.00 178.00 179.76 1av8 h SER 134 N 0.10 0.48 0.14 -2.05 0.87 -1.99 -1.90 113.55 109.20 1av8 h SER 134 Ca 0.43 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.98 1av8 h SER 134 Cb 1.55 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 63.35 1av8 h SER 134 CO -0.05 0.37 -0.29 0.58 -0.53 0.00 0.00 176.83 176.91 1av8 h VAL 135 N 0.55 0.38 0.58 2.23 2.07 -1.69 0.07 116.25 120.43 1av8 h VAL 135 Ca 0.15 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 1av8 h VAL 135 Cb -0.01 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1av8 h VAL 135 CO -0.03 0.00 -0.41 0.58 0.02 0.00 0.00 177.57 177.73 1av8 h VAL 136 N -0.52 0.18 -0.91 2.57 2.07 -1.59 -2.71 116.25 115.33 1av8 h VAL 136 Ca 0.02 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.66 1av8 h VAL 136 Cb 0.54 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.41 1av8 h VAL 136 CO -0.15 0.00 0.59 -0.26 0.02 0.00 0.00 177.57 177.76 1av8 h PHE 137 N -0.95 0.96 -0.42 1.57 0.04 -1.22 -2.25 116.94 114.67 1av8 h PHE 137 Ca -0.07 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.65 1av8 h PHE 137 Cb 0.79 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 1av8 h PHE 137 CO -0.14 0.41 -0.04 -0.44 -0.60 0.00 0.00 178.31 177.50 1av8 h ASP 138 N 0.87 0.75 0.36 2.17 3.32 -0.92 -2.94 116.42 120.03 1av8 h ASP 138 Ca 0.44 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1av8 h ASP 138 Cb 0.49 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1av8 h ASP 138 CO -0.20 0.90 -0.09 -0.78 -1.72 0.00 0.00 179.24 177.35 1av8 h ASP 139 N 0.58 0.00 -0.40 6.45 3.58 -1.08 -2.44 116.42 123.11 1av8 h ASP 139 Ca 0.11 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.58 1av8 h ASP 139 Cb 0.54 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 1av8 h ASP 139 CO 0.03 0.09 0.27 0.40 -2.88 0.00 0.00 179.24 177.14 1av8 h ILE 140 N 0.00 1.06 0.00 2.25 2.04 -1.31 0.10 117.51 121.66 1av8 h ILE 140 Ca -0.00 -0.17 -0.30 0.00 1.00 0.00 0.00 64.86 65.40 1av8 h ILE 140 Cb 0.29 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1av8 h ILE 140 CO 0.01 0.09 -1.74 0.52 0.00 0.00 0.00 178.15 177.03 1av8 n VAL 141 N -4.48 1.61 0.02 1.67 0.31 -0.94 -4.56 118.33 111.96 1av8 n VAL 141 Ca 0.04 -0.79 -0.01 0.00 -0.01 0.00 0.00 64.34 63.56 1av8 n VAL 141 Cb 0.11 -1.05 -0.00 0.00 -0.91 0.00 0.00 33.84 31.99 1av8 n VAL 141 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1av8 h THR 142 N 0.00 0.00 0.00 2.52 2.02 -1.22 -3.46 112.91 112.77 1av8 h THR 142 Ca -0.30 -0.10 -0.23 0.00 0.77 0.00 0.00 66.41 66.55 1av8 h THR 142 Cb 2.02 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 1av8 h THR 142 CO 0.08 0.00 0.68 -3.20 0.37 0.00 0.00 175.52 173.45 1av8 n ASN 143 N -2.46 0.16 -0.16 4.18 2.85 0.32 -4.79 115.26 115.36 1av8 n ASN 143 Ca -0.01 0.12 0.19 0.00 -0.11 0.00 0.00 54.58 54.77 1av8 n ASN 143 Cb 0.03 -0.37 0.57 0.00 1.24 0.00 0.00 39.78 41.24 1av8 n ASN 143 CO 0.00 0.00 0.00 1.05 -2.11 0.00 0.00 177.26 176.20 1av8 h GLU 144 N 4.63 0.27 -0.27 1.20 9.09 -1.89 0.04 114.58 127.65 1av8 h GLU 144 Ca -0.03 -0.02 -0.03 0.00 0.05 0.00 0.00 59.36 59.34 1av8 h GLU 144 Cb 0.55 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.57 1av8 h GLU 144 CO 0.54 0.18 0.04 1.96 0.05 0.00 0.00 179.01 181.78 1av8 h GLN 145 N 0.28 0.45 -0.28 1.06 1.08 -1.98 -2.44 115.11 113.28 1av8 h GLN 145 Ca 0.38 -0.12 -0.13 0.00 -1.45 0.00 0.00 58.65 57.33 1av8 h GLN 145 Cb 1.08 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.46 1av8 h GLN 145 CO -0.10 0.57 -0.32 0.82 -0.95 0.00 0.00 178.83 178.85 1av8 h ILE 146 N 0.26 1.30 -0.95 2.54 2.04 -1.63 -3.20 117.51 117.86 1av8 h ILE 146 Ca 0.08 -1.50 0.13 0.00 1.00 0.00 0.00 64.86 64.57 1av8 h ILE 146 Cb 0.34 1.61 -0.08 0.00 -0.74 0.00 0.00 36.82 37.95 1av8 h ILE 146 CO 0.01 0.48 0.61 1.56 0.00 0.00 0.00 178.15 180.80 1av8 h GLN 147 N 0.46 0.84 -0.06 2.37 1.08 -0.97 -0.60 115.11 118.22 1av8 h GLN 147 Ca 0.04 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1av8 h GLN 147 Cb 0.90 -0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 28.13 1av8 h GLN 147 CO 0.08 0.55 -0.00 0.87 -0.95 0.00 0.00 178.83 179.38 1av8 h LYS 148 N 0.86 0.09 0.00 1.46 1.57 -1.43 -1.58 116.57 117.54 1av8 h LYS 148 Ca 0.48 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 59.14 1av8 h LYS 148 Cb 0.59 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 1av8 h LYS 148 CO -0.24 0.10 -1.17 0.00 -0.57 0.00 0.00 179.45 177.57 1av8 h ARG 149 N 0.09 0.00 0.71 3.15 3.08 -1.26 -3.37 114.38 116.77 1av8 h ARG 149 Ca 0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1av8 h ARG 149 Cb 0.06 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.12 1av8 h ARG 149 CO 0.00 0.22 -0.34 0.00 -1.07 0.00 0.00 179.97 178.78 1av8 h ALA 150 N 1.61 -0.95 -2.51 0.04 0.00 -0.33 -3.31 119.26 113.82 1av8 h ALA 150 Ca -0.10 -0.22 -0.49 0.00 0.00 0.00 0.00 54.91 54.11 1av8 h ALA 150 Cb 1.38 0.37 0.04 0.00 0.00 0.00 0.00 17.79 19.57 1av8 h ALA 150 CO 0.03 -0.91 0.42 -1.83 0.00 0.00 0.00 179.25 176.96 1av8 s GLU 151 N -4.97 3.90 0.00 0.00 1.03 -0.91 -2.00 118.70 115.75 1av8 s GLU 151 Ca -0.15 1.54 0.00 0.00 0.03 0.00 0.00 54.97 56.39 1av8 s GLU 151 Cb 0.02 -2.34 0.00 0.00 -0.80 0.00 0.00 34.13 31.01 1av8 s GLU 151 CO 0.48 -0.38 0.00 0.41 -1.33 0.00 0.00 175.26 174.44 1av8 n GLY 152 N 0.19 2.81 0.13 -3.83 0.00 -1.26 -4.68 105.19 98.54 1av8 n GLY 152 Ca 0.07 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.17 1av8 n GLY 152 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1av8 h ILE 153 N 0.00 1.42 0.00 -0.61 2.04 -1.60 -3.09 117.51 115.68 1av8 h ILE 153 Ca 0.00 -1.73 -0.04 0.00 1.00 0.00 0.00 64.86 64.09 1av8 h ILE 153 Cb 0.00 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1av8 h ILE 153 CO 0.00 0.50 -0.19 0.77 0.00 0.00 0.00 178.15 179.22 1av8 h SER 154 N -0.15 0.00 -0.25 1.72 4.64 -1.68 -3.18 113.55 114.66 1av8 h SER 154 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 1av8 h SER 154 Cb 0.97 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 1av8 h SER 154 CO 0.07 0.19 0.06 0.28 -0.87 0.00 0.00 176.83 176.56 1av8 h SER 155 N 0.00 0.38 -0.05 4.97 0.02 -1.79 0.13 113.55 117.20 1av8 h SER 155 Ca -0.00 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1av8 h SER 155 Cb 0.76 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 1av8 h SER 155 CO 0.03 0.52 0.02 1.88 -1.14 0.00 0.00 176.83 178.13 1av8 h TYR 156 N 0.23 0.12 0.11 3.45 0.05 -1.52 -1.22 116.97 118.18 1av8 h TYR 156 Ca 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 1av8 h TYR 156 Cb 0.29 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.99 1av8 h TYR 156 CO 0.01 0.11 -0.05 1.88 -1.05 0.00 0.00 178.16 179.06 1av8 h TYR 157 N 0.12 -0.14 -0.81 4.88 0.05 -1.54 -3.19 116.97 116.34 1av8 h TYR 157 Ca 0.03 -0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.96 1av8 h TYR 157 Cb 0.06 0.05 -0.10 0.00 1.01 0.00 0.00 36.73 37.74 1av8 h TYR 157 CO 0.00 0.32 0.37 -0.44 -1.05 0.00 0.00 178.16 177.37 1av8 h ASP 158 N -0.92 0.40 -0.34 3.88 5.19 -0.38 -0.31 116.42 123.95 1av8 h ASP 158 Ca -0.02 0.10 -0.04 0.00 -0.62 0.00 0.00 57.03 56.46 1av8 h ASP 158 Cb 0.52 0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.07 1av8 h ASP 158 CO 0.02 0.15 0.04 -0.33 -3.12 0.00 0.00 179.24 176.01 1av8 h GLU 159 N 0.52 0.57 -0.55 3.56 5.08 -1.38 -1.16 114.58 121.22 1av8 h GLU 159 Ca 0.45 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.68 1av8 h GLU 159 Cb 0.68 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 1av8 h GLU 159 CO -0.39 0.66 0.33 1.25 -1.00 0.00 0.00 179.01 179.85 1av8 h LEU 160 N 0.39 0.53 -0.45 1.33 5.85 -1.26 -0.70 115.31 121.00 1av8 h LEU 160 Ca 0.10 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1av8 h LEU 160 Cb 0.38 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1av8 h LEU 160 CO 0.01 0.37 0.23 0.40 -0.34 0.00 0.00 178.44 179.11 1av8 h ILE 161 N 0.65 1.18 0.13 4.05 2.04 -0.90 0.15 117.51 124.80 1av8 h ILE 161 Ca 0.23 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1av8 h ILE 161 Cb 0.04 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1av8 h ILE 161 CO -0.11 0.19 -0.06 -0.08 0.00 0.00 0.00 178.15 178.09 1av8 h GLU 162 N 0.59 -0.17 -0.86 2.37 4.81 -0.76 -1.57 114.58 118.99 1av8 h GLU 162 Ca 0.16 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1av8 h GLU 162 Cb 0.10 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 1av8 h GLU 162 CO -0.02 0.03 0.55 0.52 -0.73 0.00 0.00 179.01 179.36 1av8 h MET 163 N -0.35 1.04 -0.94 1.92 2.86 -1.08 -1.84 114.93 116.55 1av8 h MET 163 Ca -0.02 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1av8 h MET 163 Cb 0.28 -0.23 -0.05 0.00 0.06 0.00 0.00 31.60 31.66 1av8 h MET 163 CO 0.03 0.69 0.62 1.15 1.06 0.00 0.00 176.91 180.46 1av8 h THR 164 N 1.07 1.24 0.53 2.22 2.02 -0.82 -1.34 112.91 117.83 1av8 h THR 164 Ca 0.34 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1av8 h THR 164 Cb 0.01 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.26 1av8 h THR 164 CO -0.12 0.23 -0.39 0.28 0.37 0.00 0.00 175.52 175.89 1av8 h SER 165 N 1.27 -1.02 -0.35 4.18 0.02 -0.47 -1.42 113.55 115.77 1av8 h SER 165 Ca 0.34 0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.44 1av8 h SER 165 Cb -0.15 0.32 -0.08 0.00 0.14 0.00 0.00 62.40 62.63 1av8 h SER 165 CO -0.07 -0.58 -0.22 1.88 -1.14 0.00 0.00 176.83 176.70 1av8 h TYR 166 N -0.90 -0.57 -0.83 3.45 0.05 -1.16 0.01 116.97 117.02 1av8 h TYR 166 Ca -0.06 0.04 0.09 0.00 0.05 0.00 0.00 58.73 58.85 1av8 h TYR 166 Cb 0.76 0.30 -0.07 0.00 1.01 0.00 0.00 36.73 38.73 1av8 h TYR 166 CO -0.15 -0.30 0.49 2.35 -1.05 0.00 0.00 178.16 179.49 1av8 h TRP 167 N -0.17 0.88 -0.13 4.88 7.01 -1.12 0.29 115.95 127.60 1av8 h TRP 167 Ca 0.18 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 61.07 1av8 h TRP 167 Cb 0.44 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.22 1av8 h TRP 167 CO -0.43 0.38 -0.52 0.45 -2.79 0.00 0.00 178.44 175.53 1av8 h HIS 168 N 0.83 0.45 0.02 2.65 3.86 -0.19 -1.60 115.15 121.16 1av8 h HIS 168 Ca 0.39 -0.15 -0.00 0.00 -1.16 0.00 0.00 60.37 59.45 1av8 h HIS 168 Cb 0.33 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.71 1av8 h HIS 168 CO -0.05 0.81 -0.01 -0.07 0.86 0.00 0.00 177.93 179.46 1av8 h LEU 169 N 0.28 -0.02 0.00 2.43 3.38 -0.23 0.22 115.31 121.38 1av8 h LEU 169 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1av8 h LEU 169 Cb 1.01 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1av8 h LEU 169 CO 0.09 0.10 -0.13 -0.07 0.09 0.00 0.00 178.44 178.52 1av8 h LEU 170 N -0.25 0.00 -0.11 1.67 3.38 -0.61 -3.44 115.31 115.96 1av8 h LEU 170 Ca -0.00 -0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.05 1av8 h LEU 170 Cb 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 1av8 h LEU 170 CO 0.00 0.02 -0.21 0.61 0.09 0.00 0.00 178.44 178.95 1av8 n GLY 171 N 1.28 -1.80 3.50 0.83 0.00 -0.60 -4.92 105.19 103.49 1av8 n GLY 171 Ca 0.05 -1.40 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 1av8 n GLY 171 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1av8 s GLU 172 N -1.86 -1.00 0.03 1.61 2.12 -1.26 -4.73 118.70 113.61 1av8 s GLU 172 Ca 0.00 0.66 0.00 0.00 0.36 0.00 0.00 54.97 55.99 1av8 s GLU 172 Cb 0.00 -1.56 0.00 0.00 0.26 0.00 0.00 34.13 32.83 1av8 s GLU 172 CO 0.00 -3.73 0.00 0.41 -0.54 0.00 0.00 175.26 171.40 1av8 n GLY 173 N 0.49 -3.50 3.75 -1.50 0.00 -0.40 -4.88 105.19 99.15 1av8 n GLY 173 Ca 0.04 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.77 1av8 n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1av8 s THR 174 N -0.92 4.92 0.24 2.61 2.01 -1.26 -1.79 115.64 121.45 1av8 s THR 174 Ca 0.00 1.28 0.01 0.00 0.31 0.00 0.00 61.69 63.29 1av8 s THR 174 Cb 0.00 -3.95 -0.05 0.00 0.01 0.00 0.00 72.50 68.51 1av8 s THR 174 CO 0.00 0.39 0.10 -1.00 -0.69 0.00 0.00 174.62 173.42 1av8 s HIS 175 N -0.03 1.43 -0.10 4.92 3.76 0.50 -4.96 115.29 120.81 1av8 s HIS 175 Ca 0.32 -1.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.04 1av8 s HIS 175 Cb -0.18 -0.81 0.00 0.00 1.11 0.00 0.00 32.58 32.70 1av8 s HIS 175 CO 0.17 -0.41 -0.22 0.99 -0.85 0.00 0.00 174.74 174.43 1av8 s THR 176 N -3.85 1.90 -0.21 1.30 2.01 -1.26 -0.31 115.64 115.23 1av8 s THR 176 Ca 0.38 -0.92 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 1av8 s THR 176 Cb 0.08 -1.66 0.07 0.00 0.01 0.00 0.00 72.50 70.99 1av8 s THR 176 CO 0.13 0.52 0.05 -0.69 -0.69 0.00 0.00 174.62 173.95 1av8 s VAL 177 N 0.45 0.43 -1.40 3.82 1.01 -0.38 -4.81 120.40 119.51 1av8 s VAL 177 Ca -0.17 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 1av8 s VAL 177 Cb -0.17 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.22 1av8 s VAL 177 CO 0.07 -0.30 0.89 0.59 0.00 0.00 0.00 175.10 176.36 1av8 n ASN 178 N 5.08 -3.36 -0.75 3.32 4.13 -1.26 -2.29 115.26 120.13 1av8 n ASN 178 Ca -0.08 -0.76 -0.08 0.00 1.68 0.00 0.00 54.58 55.34 1av8 n ASN 178 Cb 0.47 -4.15 -0.02 0.00 -1.54 0.00 0.00 39.78 34.53 1av8 n ASN 178 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1av8 n GLY 179 N -1.65 0.63 3.32 7.41 0.00 -1.26 -5.04 105.19 108.60 1av8 n GLY 179 Ca -0.12 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.06 1av8 n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1av8 s LYS 180 N -3.36 1.24 0.13 1.61 -0.14 -0.97 -5.13 119.74 113.11 1av8 s LYS 180 Ca 0.00 -1.37 -0.13 0.00 -1.36 0.00 0.00 55.97 53.11 1av8 s LYS 180 Cb 0.00 -1.29 -0.07 0.00 -1.68 0.00 0.00 37.83 34.80 1av8 s LYS 180 CO 0.00 0.26 0.51 -0.08 -0.76 0.00 0.00 175.35 175.28 1av8 s THR 181 N -2.00 4.92 -0.07 2.17 -1.32 -1.26 -1.25 115.64 116.82 1av8 s THR 181 Ca 0.14 0.72 -0.02 0.00 -1.21 0.00 0.00 61.69 61.32 1av8 s THR 181 Cb -0.06 -3.71 0.03 0.00 -1.51 0.00 0.00 72.50 67.26 1av8 s THR 181 CO 0.06 0.25 0.05 -0.69 -2.21 0.00 0.00 174.62 172.07 1av8 s VAL 182 N -1.46 0.05 -0.24 5.08 1.01 0.58 -4.92 120.40 120.51 1av8 s VAL 182 Ca 0.37 0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.52 1av8 s VAL 182 Cb -0.15 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 1av8 s VAL 182 CO 0.19 0.13 0.04 -0.89 0.00 0.00 0.00 175.10 174.57 1av8 s THR 183 N 2.10 4.11 -0.41 3.92 2.01 -1.26 -0.37 115.64 125.74 1av8 s THR 183 Ca 0.04 -0.24 -0.07 0.00 0.31 0.00 0.00 61.69 61.73 1av8 s THR 183 Cb -0.13 -2.91 0.09 0.00 0.01 0.00 0.00 72.50 69.56 1av8 s THR 183 CO -0.05 0.36 0.23 -0.69 -0.69 0.00 0.00 174.62 173.78 1av8 s VAL 184 N 1.55 3.89 -0.12 3.82 1.01 -0.74 -5.01 120.40 124.80 1av8 s VAL 184 Ca 0.06 -1.58 -0.04 0.00 0.00 0.00 0.00 61.98 60.43 1av8 s VAL 184 Cb -0.15 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1av8 s VAL 184 CO 0.02 -0.53 0.02 -0.55 0.00 0.00 0.00 175.10 174.06 1av8 s SER 185 N 2.02 5.39 0.34 3.32 0.15 -1.26 -1.27 113.70 122.38 1av8 s SER 185 Ca 0.04 0.14 0.15 0.00 0.70 0.00 0.00 55.95 56.97 1av8 s SER 185 Cb -0.23 -1.67 0.57 0.00 -1.71 0.00 0.00 66.02 62.98 1av8 s SER 185 CO 0.00 0.32 1.70 0.25 1.20 0.00 0.00 173.24 176.71 1av8 h LEU 186 N 5.61 0.00 -0.39 3.45 5.85 -1.99 -2.51 115.31 125.33 1av8 h LEU 186 Ca -0.46 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.15 1av8 h LEU 186 Cb 1.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1av8 h LEU 186 CO 0.59 0.47 -0.19 -0.09 -0.34 0.00 0.00 178.44 178.88 1av8 h ARG 187 N 0.00 0.82 -0.62 1.25 2.43 -1.99 -0.24 114.38 116.04 1av8 h ARG 187 Ca -0.00 -0.36 -0.04 0.00 -0.81 0.00 0.00 59.98 58.77 1av8 h ARG 187 Cb 0.94 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1av8 h ARG 187 CO 0.06 0.99 0.24 0.93 -1.51 0.00 0.00 179.97 180.68 1av8 h GLU 188 N 0.63 0.93 -0.21 0.20 5.08 -1.95 -1.28 114.58 117.98 1av8 h GLU 188 Ca 0.09 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1av8 h GLU 188 Cb 0.74 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1av8 h GLU 188 CO 0.06 0.79 0.13 1.25 -1.00 0.00 0.00 179.01 180.24 1av8 h LEU 189 N 0.86 0.26 -1.48 1.33 5.85 -1.29 -0.34 115.31 120.49 1av8 h LEU 189 Ca 0.20 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1av8 h LEU 189 Cb 0.22 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1av8 h LEU 189 CO -0.02 0.23 0.22 0.11 -0.34 0.00 0.00 178.44 178.65 1av8 h LYS 190 N 0.26 0.57 -0.05 1.25 1.57 -0.81 -1.51 116.57 117.85 1av8 h LYS 190 Ca 0.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1av8 h LYS 190 Cb 0.02 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1av8 h LYS 190 CO -0.01 0.43 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.07 1av8 h LYS 191 N 0.58 0.08 -0.65 3.15 3.64 -0.53 -2.15 116.57 120.70 1av8 h LYS 191 Ca 0.15 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.60 1av8 h LYS 191 Cb 0.03 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.76 1av8 h LYS 191 CO -0.02 0.40 0.24 -0.22 -2.27 0.00 0.00 179.45 177.58 1av8 h LYS 192 N -0.24 0.41 -0.20 1.90 1.63 -0.69 -0.43 116.57 118.95 1av8 h LYS 192 Ca 0.01 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.80 1av8 h LYS 192 Cb 0.37 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.89 1av8 h LYS 192 CO 0.00 0.27 0.09 1.25 -3.45 0.00 0.00 179.45 177.61 1av8 h LEU 193 N 0.42 0.13 0.06 5.20 5.85 -1.18 0.25 115.31 126.04 1av8 h LEU 193 Ca 0.33 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1av8 h LEU 193 Cb 0.43 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1av8 h LEU 193 CO -0.33 0.10 -0.07 0.22 -0.34 0.00 0.00 178.44 178.02 1av8 h TYR 194 N 0.20 -0.18 -0.42 1.25 3.20 -0.67 -0.17 116.97 120.18 1av8 h TYR 194 Ca 0.08 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.02 1av8 h TYR 194 Cb 0.03 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.32 1av8 h TYR 194 CO -0.10 -0.11 0.12 -0.07 -1.64 0.00 0.00 178.16 176.36 1av8 h LEU 195 N -0.15 0.09 -0.47 2.82 4.07 -0.92 -0.38 115.31 120.37 1av8 h LEU 195 Ca 0.01 0.06 0.05 0.00 0.08 0.00 0.00 57.88 58.08 1av8 h LEU 195 Cb 0.15 0.06 -0.05 0.00 1.08 0.00 0.00 40.66 41.91 1av8 h LEU 195 CO -0.03 0.08 0.20 0.00 -1.08 0.00 0.00 178.44 177.61 1av8 h LEU 197 N 0.39 0.43 -0.06 0.00 3.38 -0.09 0.58 115.31 119.95 1av8 h LEU 197 Ca 0.22 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1av8 h LEU 197 Cb 0.19 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1av8 h LEU 197 CO -0.20 0.46 0.02 0.24 0.09 0.00 0.00 178.44 179.05 1av8 h MET 198 N 0.45 0.08 -0.60 1.13 2.86 0.04 -0.27 114.93 118.62 1av8 h MET 198 Ca 0.11 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.78 1av8 h MET 198 Cb 0.23 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 1av8 h MET 198 CO 0.00 0.24 0.32 1.03 1.06 0.00 0.00 176.91 179.56 1av8 h SER 199 N -0.09 0.46 -0.25 1.22 0.87 -0.41 -0.06 113.55 115.29 1av8 h SER 199 Ca 0.02 0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.50 1av8 h SER 199 Cb 0.19 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 1av8 h SER 199 CO -0.00 0.31 -0.20 0.58 -0.53 0.00 0.00 176.83 176.98 1av8 h VAL 200 N 0.60 1.27 -0.70 2.23 2.07 -0.76 -0.16 116.25 120.80 1av8 h VAL 200 Ca 0.27 -1.28 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 1av8 h VAL 200 Cb 0.17 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1av8 h VAL 200 CO -0.18 0.42 0.21 -1.13 0.02 0.00 0.00 177.57 176.92 1av8 h ASN 201 N 0.62 1.04 -0.51 0.57 -1.24 -0.18 -1.28 115.58 114.59 1av8 h ASN 201 Ca 0.09 -0.21 -0.04 0.00 0.71 0.00 0.00 56.30 56.85 1av8 h ASN 201 Cb 0.68 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.44 1av8 h ASN 201 CO 0.05 0.98 0.17 0.00 -1.29 0.00 0.00 177.43 177.34 1av8 h ALA 202 N 1.10 0.67 0.53 1.57 0.00 -0.63 0.34 119.26 122.84 1av8 h ALA 202 Ca 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1av8 h ALA 202 Cb 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1av8 h ALA 202 CO -0.01 0.32 -0.46 1.25 0.00 0.00 0.00 179.25 180.35 1av8 h LEU 203 N 0.70 -1.24 -0.25 0.00 5.85 -0.54 0.21 115.31 120.05 1av8 h LEU 203 Ca 0.17 0.09 -0.21 0.00 0.84 0.00 0.00 57.88 58.77 1av8 h LEU 203 Cb 0.25 0.40 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1av8 h LEU 203 CO -0.01 -0.64 -0.89 -0.33 -0.34 0.00 0.00 178.44 176.23 1av8 h GLU 204 N -0.98 0.29 0.00 1.25 5.08 -1.22 -1.99 114.58 117.01 1av8 h GLU 204 Ca -0.06 -0.31 -0.15 0.00 -1.00 0.00 0.00 59.36 57.84 1av8 h GLU 204 Cb 0.84 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1av8 h GLU 204 CO -0.03 1.01 -0.94 0.00 -1.00 0.00 0.00 179.01 178.05 1av8 h ALA 205 N 0.88 0.61 0.00 3.43 0.00 -0.33 -3.39 119.26 120.46 1av8 h ALA 205 Ca -0.06 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1av8 h ALA 205 Cb 1.52 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1av8 h ALA 205 CO 0.14 0.89 -0.13 -0.89 0.00 0.00 0.00 179.25 179.26 1av8 n ILE 206 N -3.14 0.78 -0.15 0.00 5.41 0.68 -4.60 119.36 118.35 1av8 n ILE 206 Ca -0.03 0.26 -0.03 0.00 1.00 0.00 0.00 62.75 63.95 1av8 n ILE 206 Cb 0.82 -1.50 0.05 0.00 -0.71 0.00 0.00 39.64 38.30 1av8 n ILE 206 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1av8 h ARG 207 N -0.13 0.08 -0.14 0.38 3.08 -1.12 -1.62 114.38 114.90 1av8 h ARG 207 Ca 0.00 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1av8 h ARG 207 Cb 0.13 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1av8 h ARG 207 CO 0.00 0.05 -0.17 0.74 -1.07 0.00 0.00 179.97 179.52 1av8 h PHE 208 N 0.08 0.24 0.00 3.04 0.04 -1.56 -2.56 116.94 116.21 1av8 h PHE 208 Ca 0.24 -0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.91 1av8 h PHE 208 Cb 0.36 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1av8 h PHE 208 CO -0.33 0.39 -0.34 1.88 -0.60 0.00 0.00 178.31 179.30 1av8 h TYR 209 N 0.21 0.00 -0.17 -0.55 -1.99 -1.52 -2.07 116.97 110.88 1av8 h TYR 209 Ca 0.04 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 1av8 h TYR 209 Cb 0.43 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.15 1av8 h TYR 209 CO 0.01 0.34 -0.08 0.28 -0.00 0.00 0.00 178.16 178.71 1av8 h VAL 210 N 0.00 1.31 -0.46 -2.88 2.07 -1.03 -2.70 116.25 112.57 1av8 h VAL 210 Ca -0.00 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.35 1av8 h VAL 210 Cb 0.80 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1av8 h VAL 210 CO 0.04 0.33 0.13 0.77 0.02 0.00 0.00 177.57 178.87 1av8 h SER 211 N 0.03 0.62 -0.29 0.57 4.64 -1.36 -1.80 113.55 115.96 1av8 h SER 211 Ca 0.04 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 1av8 h SER 211 Cb 0.56 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1av8 h SER 211 CO 0.02 0.60 0.16 -0.26 -0.87 0.00 0.00 176.83 176.48 1av8 h PHE 212 N 0.66 0.42 -0.11 4.77 0.04 -1.25 -1.69 116.94 119.78 1av8 h PHE 212 Ca 0.15 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 1av8 h PHE 212 Cb 0.21 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 1av8 h PHE 212 CO 0.01 0.31 0.07 0.00 -0.60 0.00 0.00 178.31 178.10 1av8 h ALA 213 N 1.74 0.14 -0.29 2.45 0.00 -0.99 -0.86 119.26 121.44 1av8 h ALA 213 Ca 0.11 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1av8 h ALA 213 Cb 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1av8 h ALA 213 CO -0.02 -0.38 0.18 0.00 0.00 0.00 0.00 179.25 179.03 1av8 h SER 215 N 0.37 0.11 0.70 0.00 0.02 -1.22 -2.63 113.55 110.90 1av8 h SER 215 Ca 0.10 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.00 1av8 h SER 215 Cb 0.00 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1av8 h SER 215 CO -0.02 0.09 -0.17 -0.26 -1.14 0.00 0.00 176.83 175.34 1av8 h PHE 216 N 0.12 0.00 -0.61 3.45 0.04 -1.00 -2.28 116.94 116.66 1av8 h PHE 216 Ca 0.04 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1av8 h PHE 216 Cb -0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 1av8 h PHE 216 CO -0.07 0.17 0.37 0.00 -0.60 0.00 0.00 178.31 178.18 1av8 h ALA 217 N 1.83 0.78 -0.18 2.45 0.00 -0.62 -0.81 119.26 122.71 1av8 h ALA 217 Ca -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1av8 h ALA 217 Cb 0.57 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1av8 h ALA 217 CO 0.02 0.26 0.03 0.74 0.00 0.00 0.00 179.25 180.30 1av8 h PHE 218 N 0.83 0.31 -0.68 0.00 0.04 -1.30 -2.91 116.94 113.23 1av8 h PHE 218 Ca 0.22 -0.04 0.12 0.00 2.80 0.00 0.00 57.97 61.06 1av8 h PHE 218 Cb -0.03 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 37.99 1av8 h PHE 218 CO -0.02 0.44 0.45 0.00 -0.60 0.00 0.00 178.31 178.59 1av8 h ALA 219 N 0.83 2.02 -0.21 2.45 0.00 -1.14 -0.10 119.26 123.11 1av8 h ALA 219 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1av8 h ALA 219 Cb 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1av8 h ALA 219 CO 0.00 -0.19 0.06 0.93 0.00 0.00 0.00 179.25 180.06 1av8 h GLU 220 N 0.45 0.29 -0.64 0.00 4.39 -0.95 0.05 114.58 118.18 1av8 h GLU 220 Ca 0.32 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1av8 h GLU 220 Cb 0.65 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1av8 h GLU 220 CO -0.10 0.27 0.00 0.54 -1.16 0.00 0.00 179.01 178.56 1av8 n ARG 221 N -4.43 2.88 -3.67 2.33 1.74 -0.09 -4.91 116.66 110.51 1av8 n ARG 221 Ca 0.00 -1.81 -0.25 0.00 -0.77 0.00 0.00 57.85 55.03 1av8 n ARG 221 Cb 0.14 -1.74 0.06 0.00 -1.02 0.00 0.00 32.46 29.90 1av8 n ARG 221 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1av8 n GLU 222 N 0.55 -6.87 -4.38 5.56 1.02 0.01 -5.01 120.64 111.51 1av8 n GLU 222 Ca 0.16 0.75 -0.24 0.00 -0.02 0.00 0.00 57.16 57.81 1av8 n GLU 222 Cb 0.66 -5.72 -0.13 0.00 -0.02 0.00 0.00 31.44 26.24 1av8 n GLU 222 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1av8 s LEU 223 N -7.12 2.26 -1.28 -4.62 1.43 -0.93 -4.80 118.68 103.61 1av8 s LEU 223 Ca 0.48 -0.64 -0.06 0.00 -1.03 0.00 0.00 54.13 52.88 1av8 s LEU 223 Cb -0.22 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.09 1av8 s LEU 223 CO 0.76 0.08 0.64 0.23 0.23 0.00 0.00 176.35 178.29 1av8 n MET 224 N 1.29 -3.20 0.11 1.70 2.81 -1.26 -2.95 117.12 115.63 1av8 n MET 224 Ca -0.19 0.51 0.13 0.00 -1.81 0.00 0.00 57.70 56.34 1av8 n MET 224 Cb 0.53 -4.67 0.37 0.00 -0.71 0.00 0.00 33.22 28.74 1av8 n MET 224 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1av8 h GLU 225 N -1.84 0.00 -0.02 0.03 5.08 -1.93 -1.94 114.58 113.97 1av8 h GLU 225 Ca -0.63 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.64 1av8 h GLU 225 Cb 1.36 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.62 1av8 h GLU 225 CO 0.56 0.00 -0.32 0.78 -1.00 0.00 0.00 179.01 179.03 1av8 h GLY 226 N 4.48 0.27 1.05 -3.84 0.00 -1.90 -2.19 103.07 100.95 1av8 h GLY 226 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 46.91 1av8 h GLY 226 CO 0.00 0.40 0.58 -0.57 0.00 0.00 0.00 176.54 176.95 1av8 h ASN 227 N -0.35 0.97 -0.57 0.19 -0.73 -1.87 -2.09 115.58 111.13 1av8 h ASN 227 Ca -0.04 -0.02 -0.02 0.00 1.87 0.00 0.00 56.30 58.10 1av8 h ASN 227 Cb 1.04 -0.23 -0.03 0.00 0.27 0.00 0.00 38.32 39.37 1av8 h ASN 227 CO 0.06 0.68 0.26 0.00 -0.37 0.00 0.00 177.43 178.06 1av8 h ALA 228 N 1.47 0.73 -0.68 1.57 0.00 -1.30 -0.12 119.26 120.95 1av8 h ALA 228 Ca 0.34 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1av8 h ALA 228 Cb -0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1av8 h ALA 228 CO -0.09 0.31 0.28 -0.22 0.00 0.00 0.00 179.25 179.52 1av8 h LYS 229 N 0.77 0.99 -0.15 0.00 3.64 -0.73 -0.73 116.57 120.37 1av8 h LYS 229 Ca 0.19 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1av8 h LYS 229 Cb 0.14 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1av8 h LYS 229 CO -0.02 0.80 -0.19 0.82 -2.27 0.00 0.00 179.45 178.59 1av8 h ILE 230 N 0.97 1.36 -0.31 2.00 2.04 -1.01 -2.84 117.51 119.72 1av8 h ILE 230 Ca 0.23 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.68 1av8 h ILE 230 Cb 0.18 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1av8 h ILE 230 CO -0.02 0.41 0.10 0.40 0.00 0.00 0.00 178.15 179.03 1av8 h ILE 231 N 0.00 1.14 -0.21 -0.67 1.08 -0.84 0.22 117.51 118.22 1av8 h ILE 231 Ca 0.02 -0.46 0.03 0.00 -0.39 0.00 0.00 64.86 64.06 1av8 h ILE 231 Cb 0.74 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 1av8 h ILE 231 CO 0.04 0.17 0.01 -0.09 -0.69 0.00 0.00 178.15 177.59 1av8 h ARG 232 N 0.44 0.08 -0.24 2.37 9.65 -1.05 0.31 114.38 125.93 1av8 h ARG 232 Ca 0.11 -0.00 -0.14 0.00 -1.10 0.00 0.00 59.98 58.85 1av8 h ARG 232 Cb 0.14 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1av8 h ARG 232 CO -0.01 0.05 -0.42 -0.07 2.80 0.00 0.00 179.97 182.33 1av8 h LEU 233 N 0.08 0.63 -0.48 3.80 3.38 -1.03 -2.35 115.31 119.34 1av8 h LEU 233 Ca 0.10 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 1av8 h LEU 233 Cb 0.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1av8 h LEU 233 CO -0.16 0.97 -0.16 0.40 0.09 0.00 0.00 178.44 179.58 1av8 h ILE 234 N 0.48 1.27 -0.68 1.22 2.04 -0.56 -2.86 117.51 118.43 1av8 h ILE 234 Ca 0.04 -1.31 -0.05 0.00 1.00 0.00 0.00 64.86 64.55 1av8 h ILE 234 Cb 0.93 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1av8 h ILE 234 CO 0.08 0.45 0.24 0.00 0.00 0.00 0.00 178.15 178.93 1av8 h ALA 235 N 0.88 1.15 -0.91 1.87 0.00 -0.27 0.13 119.26 122.10 1av8 h ALA 235 Ca 0.12 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1av8 h ALA 235 Cb 0.72 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1av8 h ALA 235 CO 0.06 0.60 0.60 -0.09 0.00 0.00 0.00 179.25 180.42 1av8 h ARG 236 N 0.99 1.13 -0.14 0.00 2.43 -1.32 -1.69 114.38 115.78 1av8 h ARG 236 Ca 0.23 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 59.19 1av8 h ARG 236 Cb 0.23 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1av8 h ARG 236 CO -0.01 0.75 -0.44 -0.44 -1.51 0.00 0.00 179.97 178.31 1av8 h ASP 237 N 1.17 0.63 -0.82 -3.80 3.32 -1.14 -3.21 116.42 112.57 1av8 h ASP 237 Ca 0.35 -0.60 0.14 0.00 0.02 0.00 0.00 57.03 56.94 1av8 h ASP 237 Cb -0.03 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.28 1av8 h ASP 237 CO -0.10 1.12 0.53 -0.08 -1.72 0.00 0.00 179.24 179.00 1av8 h GLU 238 N 0.17 0.56 -0.55 3.56 4.57 -0.32 -0.28 114.58 122.29 1av8 h GLU 238 Ca -0.02 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1av8 h GLU 238 Cb 1.07 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.50 1av8 h GLU 238 CO 0.09 0.37 0.33 0.00 -1.18 0.00 0.00 179.01 178.62 1av8 h ALA 239 N 1.62 0.70 -0.43 2.92 0.00 -1.34 0.06 119.26 122.79 1av8 h ALA 239 Ca 0.40 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1av8 h ALA 239 Cb 0.74 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1av8 h ALA 239 CO -0.16 0.05 0.10 -0.07 0.00 0.00 0.00 179.25 179.16 1av8 h LEU 240 N 0.65 0.66 -0.25 0.00 3.38 -1.19 -1.87 115.31 116.70 1av8 h LEU 240 Ca 0.22 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1av8 h LEU 240 Cb 0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1av8 h LEU 240 CO -0.10 0.73 0.08 0.45 0.09 0.00 0.00 178.44 179.69 1av8 h HIS 241 N 0.57 0.13 -0.16 1.13 3.86 -0.41 -1.63 115.15 118.64 1av8 h HIS 241 Ca 0.13 0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.25 1av8 h HIS 241 Cb 0.33 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1av8 h HIS 241 CO 0.02 0.06 -0.38 1.37 0.86 0.00 0.00 177.93 179.86 1av8 h LEU 242 N 0.18 0.37 -1.06 2.43 -0.00 -0.92 -2.37 115.31 113.94 1av8 h LEU 242 Ca 0.11 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1av8 h LEU 242 Cb 0.08 -0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 40.60 1av8 h LEU 242 CO -0.12 0.72 0.57 0.74 -0.00 0.00 0.00 178.44 180.35 1av8 h THR 243 N 0.30 1.24 -0.10 0.15 2.02 -0.95 0.14 112.91 115.70 1av8 h THR 243 Ca 0.03 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 1av8 h THR 243 Cb 0.80 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1av8 h THR 243 CO 0.06 0.24 0.05 1.23 0.37 0.00 0.00 175.52 177.47 1av8 h GLY 244 N 1.24 0.15 2.00 2.16 0.00 -0.79 -1.19 103.07 106.63 1av8 h GLY 244 Ca 0.33 -0.07 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 1av8 h GLY 244 CO -0.07 0.07 -0.48 -0.91 0.00 0.00 0.00 176.54 175.15 1av8 h THR 245 N 0.04 1.35 0.70 4.70 1.35 -1.16 -1.67 112.91 118.21 1av8 h THR 245 Ca 0.03 -1.66 -0.03 0.00 -0.55 0.00 0.00 66.41 64.20 1av8 h THR 245 Cb 0.11 1.89 0.01 0.00 -1.73 0.00 0.00 68.15 68.43 1av8 h THR 245 CO -0.00 0.47 -0.33 1.56 -0.25 0.00 0.00 175.52 176.97 1av8 h GLN 246 N 0.00 -0.90 -0.90 4.72 4.20 -0.45 -1.30 115.11 120.48 1av8 h GLN 246 Ca -0.00 0.06 0.14 0.00 0.06 0.00 0.00 58.65 58.90 1av8 h GLN 246 Cb 0.86 0.20 -0.07 0.00 0.30 0.00 0.00 27.48 28.77 1av8 h GLN 246 CO 0.06 -0.57 0.58 0.45 -0.67 0.00 0.00 178.83 178.68 1av8 h HIS 247 N -1.09 0.88 0.24 2.96 3.86 -1.13 0.13 115.15 121.00 1av8 h HIS 247 Ca -0.10 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1av8 h HIS 247 Cb 0.75 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.94 1av8 h HIS 247 CO -0.00 0.33 -0.12 0.52 0.86 0.00 0.00 177.93 179.52 1av8 h MET 248 N 0.75 -0.31 -0.88 2.45 2.86 -1.21 -0.51 114.93 118.07 1av8 h MET 248 Ca 0.45 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 58.14 1av8 h MET 248 Cb 0.66 0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.34 1av8 h MET 248 CO -0.21 -0.10 0.58 -0.07 1.06 0.00 0.00 176.91 178.17 1av8 h LEU 249 N -0.47 0.96 -0.36 1.22 3.38 0.04 -1.38 115.31 118.70 1av8 h LEU 249 Ca -0.03 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 1av8 h LEU 249 Cb 0.35 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1av8 h LEU 249 CO 0.05 0.66 -0.81 0.78 0.09 0.00 0.00 178.44 179.22 1av8 h ASN 250 N 1.11 0.32 -0.43 -0.43 2.35 -0.72 -1.34 115.58 116.45 1av8 h ASN 250 Ca 0.35 -0.23 -0.15 0.00 -0.55 0.00 0.00 56.30 55.71 1av8 h ASN 250 Cb -0.00 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1av8 h ASN 250 CO -0.10 1.00 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.31 1av8 h LEU 251 N 0.16 1.01 -0.37 1.61 4.07 -0.71 -2.22 115.31 118.86 1av8 h LEU 251 Ca -0.04 -0.43 -0.07 0.00 0.08 0.00 0.00 57.88 57.41 1av8 h LEU 251 Cb 1.41 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.85 1av8 h LEU 251 CO 0.13 1.23 -0.06 -0.07 -1.08 0.00 0.00 178.44 178.59 1av8 h LEU 252 N 0.81 0.69 -0.67 1.67 3.38 -1.19 -3.10 115.31 116.89 1av8 h LEU 252 Ca 0.08 -0.35 -0.13 0.00 0.09 0.00 0.00 57.88 57.58 1av8 h LEU 252 Cb 0.89 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1av8 h LEU 252 CO 0.08 0.88 -0.33 0.08 0.09 0.00 0.00 178.44 179.24 1av8 h ARG 253 N 0.50 0.66 0.00 1.13 0.11 -1.24 -2.80 114.38 112.74 1av8 h ARG 253 Ca 0.10 -0.31 0.00 0.00 0.10 0.00 0.00 59.98 59.87 1av8 h ARG 253 Cb 0.56 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.63 1av8 h ARG 253 CO 0.03 0.90 0.00 -1.13 0.10 0.00 0.00 179.97 179.87 1av8 n SER 254 N -4.07 0.00 0.00 0.08 3.41 -0.84 -4.46 113.62 107.74 1av8 n SER 254 Ca -0.01 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 1av8 n SER 254 Cb 0.48 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1av8 n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1av8 n GLY 255 N 0.42 0.16 0.00 5.00 0.00 -1.07 -4.81 105.19 104.88 1av8 n GLY 255 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.22 1av8 n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1av8 n ALA 256 N 1.00 2.06 0.02 4.61 0.00 -1.21 -3.84 120.51 123.14 1av8 n ALA 256 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1av8 n ALA 256 Cb 0.24 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1av8 n ALA 256 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1av8 n ASP 257 N -0.93 0.31 -3.81 0.00 2.03 -1.25 -5.04 116.55 107.86 1av8 n ASP 257 Ca 0.10 0.05 -0.25 0.00 0.52 0.00 0.00 54.79 55.21 1av8 n ASP 257 Cb 0.05 -0.09 -0.17 0.00 -0.72 0.00 0.00 41.12 40.19 1av8 n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1av8 s ASP 258 N -5.23 2.13 0.50 1.67 2.15 -1.25 -4.84 116.67 111.80 1av8 s ASP 258 Ca 0.00 -0.35 0.21 0.00 0.43 0.00 0.00 52.55 52.84 1av8 s ASP 258 Cb 0.00 -0.62 1.28 0.00 -0.30 0.00 0.00 42.92 43.29 1av8 s ASP 258 CO 0.00 -0.20 2.07 -0.65 -0.17 0.00 0.00 175.17 176.22 1av8 h PRO 259 N 8.25 0.00 0.00 4.34 0.11 -1.92 -1.78 132.00 141.00 1av8 h PRO 259 Ca -0.22 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.84 1av8 h PRO 259 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1av8 h PRO 259 CO 0.32 0.12 -0.24 1.49 -0.21 0.00 0.00 178.00 179.48 1av8 h GLU 260 N 0.00 0.00 -0.23 1.05 4.81 -1.95 -2.69 114.58 115.56 1av8 h GLU 260 Ca -0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1av8 h GLU 260 Cb 0.25 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 1av8 h GLU 260 CO 0.02 0.24 -0.24 0.52 -0.73 0.00 0.00 179.01 178.82 1av8 h MET 261 N 0.00 0.57 -0.68 1.92 2.86 -1.60 -2.35 114.93 115.65 1av8 h MET 261 Ca -0.00 -0.30 0.08 0.00 -2.06 0.00 0.00 59.70 57.42 1av8 h MET 261 Cb 0.57 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 1av8 h MET 261 CO 0.03 0.90 0.45 0.00 1.06 0.00 0.00 176.91 179.35 1av8 h ALA 262 N 0.67 1.85 -0.05 6.32 0.00 -1.30 0.15 119.26 126.89 1av8 h ALA 262 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1av8 h ALA 262 Cb 0.79 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1av8 h ALA 262 CO 0.06 0.02 -0.02 0.93 0.00 0.00 0.00 179.25 180.24 1av8 h GLU 263 N 0.60 0.11 -0.75 0.00 5.08 -1.39 -3.02 114.58 115.20 1av8 h GLU 263 Ca 0.31 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.72 1av8 h GLU 263 Cb 0.42 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1av8 h GLU 263 CO -0.10 0.49 0.49 0.82 -1.00 0.00 0.00 179.01 179.72 1av8 h ILE 264 N -0.28 0.94 -0.00 3.13 1.08 -0.71 -1.41 117.51 120.26 1av8 h ILE 264 Ca 0.01 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.27 1av8 h ILE 264 Cb 0.46 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 1av8 h ILE 264 CO 0.01 0.12 -0.11 0.00 -0.69 0.00 0.00 178.15 177.48 1av8 h ALA 265 N 1.62 -0.12 -0.12 1.87 0.00 -0.62 -2.58 119.26 119.30 1av8 h ALA 265 Ca 0.35 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 1av8 h ALA 265 Cb 0.47 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1av8 h ALA 265 CO -0.13 -0.60 -0.43 0.93 0.00 0.00 0.00 179.25 179.02 1av8 h GLU 266 N -0.19 0.28 0.00 0.00 3.07 -1.29 -2.22 114.58 114.24 1av8 h GLU 266 Ca 0.04 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1av8 h GLU 266 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1av8 h GLU 266 CO -0.11 0.67 0.00 0.39 -1.40 0.00 0.00 179.01 178.56 1av8 n GLU 267 N -4.01 0.11 0.00 2.33 1.02 -0.61 -3.10 120.64 116.38 1av8 n GLU 267 Ca -0.02 0.16 0.02 0.00 -0.02 0.00 0.00 57.16 57.30 1av8 n GLU 267 Cb 0.50 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 1av8 n GLU 267 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1av8 n LYS 269 N -0.94 -0.05 0.01 0.00 4.76 -0.88 -0.01 118.16 121.05 1av8 n LYS 269 Ca 0.01 0.96 -0.13 0.00 -2.87 0.00 0.00 58.31 56.28 1av8 n LYS 269 Cb 0.08 -1.46 -0.09 0.00 -1.84 0.00 0.00 35.03 31.72 1av8 n LYS 269 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 1av8 h GLN 270 N 0.00 -0.06 -0.41 1.97 1.08 -1.86 -1.26 115.11 114.57 1av8 h GLN 270 Ca 0.33 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.55 1av8 h GLN 270 Cb 0.57 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.99 1av8 h GLN 270 CO -0.62 0.37 0.27 0.93 -0.95 0.00 0.00 178.83 178.83 1av8 h GLU 271 N -0.51 0.47 -0.05 1.46 5.08 -0.76 0.28 114.58 120.55 1av8 h GLU 271 Ca -0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1av8 h GLU 271 Cb 0.46 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1av8 h GLU 271 CO 0.01 0.31 -0.13 0.00 -1.00 0.00 0.00 179.01 178.20 1av8 h TYR 273 N -0.34 0.67 -0.55 0.00 5.03 -0.66 -1.76 116.97 119.37 1av8 h TYR 273 Ca -0.00 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.30 1av8 h TYR 273 Cb 0.73 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.80 1av8 h TYR 273 CO 0.12 0.25 0.18 -0.44 -1.32 0.00 0.00 178.16 176.95 1av8 h ASP 274 N 0.64 0.79 -0.57 -2.11 3.32 -0.94 -0.97 116.42 116.58 1av8 h ASP 274 Ca 0.36 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 1av8 h ASP 274 Cb 0.37 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1av8 h ASP 274 CO -0.26 0.78 0.02 0.17 -1.72 0.00 0.00 179.24 178.23 1av8 h LEU 275 N 0.75 0.98 -0.05 1.55 8.10 -0.89 0.13 115.31 125.89 1av8 h LEU 275 Ca 0.18 -0.30 -0.00 0.00 0.11 0.00 0.00 57.88 57.87 1av8 h LEU 275 Cb 0.27 -0.26 -0.00 0.00 -0.44 0.00 0.00 40.66 40.23 1av8 h LEU 275 CO -0.01 1.04 0.03 -0.26 -4.11 0.00 0.00 178.44 175.13 1av8 h PHE 276 N 0.89 0.07 -0.75 0.17 0.04 -1.19 0.22 116.94 116.39 1av8 h PHE 276 Ca 0.17 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 1av8 h PHE 276 Cb 0.52 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.61 1av8 h PHE 276 CO 0.04 0.11 0.43 0.28 -0.60 0.00 0.00 178.31 178.57 1av8 h VAL 277 N 0.01 1.22 -0.94 -0.55 2.07 -1.07 -1.84 116.25 115.15 1av8 h VAL 277 Ca 0.02 -0.53 0.01 0.00 0.82 0.00 0.00 66.70 67.02 1av8 h VAL 277 Cb 0.06 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 29.99 1av8 h VAL 277 CO -0.00 0.24 0.62 -0.61 0.02 0.00 0.00 177.57 177.84 1av8 h GLN 278 N 1.04 1.24 -0.13 1.57 4.15 -0.26 -1.14 115.11 121.57 1av8 h GLN 278 Ca 0.27 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 59.63 1av8 h GLN 278 Cb 0.00 -0.28 -0.02 0.00 0.21 0.00 0.00 27.48 27.40 1av8 h GLN 278 CO -0.05 0.82 0.02 0.00 -1.93 0.00 0.00 178.83 177.69 1av8 h ALA 279 N 1.34 0.13 -0.91 3.38 0.00 -0.30 -0.95 119.26 121.95 1av8 h ALA 279 Ca 0.34 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.33 1av8 h ALA 279 Cb -0.15 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1av8 h ALA 279 CO -0.07 -0.43 0.59 0.00 0.00 0.00 0.00 179.25 179.34 1av8 h ALA 280 N 1.10 1.46 -0.43 0.00 0.00 -0.75 -0.63 119.26 120.01 1av8 h ALA 280 Ca 0.06 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1av8 h ALA 280 Cb 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1av8 h ALA 280 CO -0.08 0.43 0.05 0.37 0.00 0.00 0.00 179.25 180.02 1av8 h GLN 281 N 1.09 0.72 -0.48 0.00 5.75 -0.70 -0.96 115.11 120.54 1av8 h GLN 281 Ca 0.37 -0.20 0.01 0.00 -0.15 0.00 0.00 58.65 58.67 1av8 h GLN 281 Cb 0.09 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1av8 h GLN 281 CO -0.13 0.77 0.32 1.96 -2.65 0.00 0.00 178.83 179.10 1av8 h GLN 282 N 0.57 0.63 -0.49 1.69 4.20 -0.33 0.26 115.11 121.64 1av8 h GLN 282 Ca 0.13 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 1av8 h GLN 282 Cb 0.41 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1av8 h GLN 282 CO 0.01 0.41 0.19 0.93 -0.67 0.00 0.00 178.83 179.71 1av8 h GLU 283 N 0.64 0.71 -0.22 1.46 4.39 -0.86 0.14 114.58 120.84 1av8 h GLU 283 Ca 0.17 -0.10 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 1av8 h GLU 283 Cb -0.07 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1av8 h GLU 283 CO -0.04 0.59 -0.46 0.87 -1.16 0.00 0.00 179.01 178.81 1av8 h LYS 284 N 0.70 0.57 0.00 2.33 1.57 -0.42 -1.55 116.57 119.78 1av8 h LYS 284 Ca 0.17 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.56 1av8 h LYS 284 Cb 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1av8 h LYS 284 CO -0.02 0.91 -0.34 -0.44 -0.57 0.00 0.00 179.45 178.99 1av8 h ASP 285 N 0.46 0.00 -0.34 0.86 3.32 -0.13 -2.61 116.42 117.98 1av8 h ASP 285 Ca 0.03 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.93 1av8 h ASP 285 Cb 0.98 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 1av8 h ASP 285 CO 0.09 0.34 -0.38 -0.25 -1.72 0.00 0.00 179.24 177.32 1av8 h TRP 286 N 0.00 1.05 -0.44 4.55 2.91 -0.31 -2.79 115.95 120.92 1av8 h TRP 286 Ca -0.00 -0.32 0.06 0.00 1.13 0.00 0.00 58.89 59.75 1av8 h TRP 286 Cb 0.86 -0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 29.27 1av8 h TRP 286 CO 0.00 1.13 0.29 0.00 -1.03 0.00 0.00 178.44 178.84 1av8 h ALA 287 N 0.74 1.97 0.14 2.65 0.00 -0.91 0.16 119.26 124.00 1av8 h ALA 287 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1av8 h ALA 287 Cb 0.97 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1av8 h ALA 287 CO 0.09 -0.05 -0.07 -0.44 0.00 0.00 0.00 179.25 178.79 1av8 h ASP 288 N 0.35 -0.16 -0.64 0.00 5.19 -1.32 -2.23 116.42 117.61 1av8 h ASP 288 Ca 0.19 -0.16 0.07 0.00 -0.62 0.00 0.00 57.03 56.51 1av8 h ASP 288 Cb 0.32 0.04 -0.06 0.00 0.18 0.00 0.00 39.33 39.81 1av8 h ASP 288 CO -0.04 0.07 0.32 0.22 -3.12 0.00 0.00 179.24 176.68 1av8 h TYR 289 N -0.38 0.58 -0.64 4.55 3.20 -1.05 -0.78 116.97 122.44 1av8 h TYR 289 Ca -0.02 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1av8 h TYR 289 Cb 0.30 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1av8 h TYR 289 CO -0.01 0.24 0.32 -0.07 -1.64 0.00 0.00 178.16 177.00 1av8 h LEU 290 N 0.58 0.82 -3.04 2.82 4.07 -0.93 -3.25 115.31 116.39 1av8 h LEU 290 Ca 0.30 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.14 1av8 h LEU 290 Cb 0.26 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1av8 h LEU 290 CO -0.22 0.71 0.00 0.49 -1.08 0.00 0.00 178.44 178.34 1av8 n PHE 291 N -4.50 1.26 -0.31 1.13 3.72 -0.85 -4.44 117.46 113.46 1av8 n PHE 291 Ca 0.04 -0.59 0.11 0.00 -0.05 0.00 0.00 57.45 56.97 1av8 n PHE 291 Cb 0.12 -0.17 0.34 0.00 -0.94 0.00 0.00 39.48 38.82 1av8 n PHE 291 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 1av8 h ARG 292 N 3.85 0.75 -0.20 -1.08 0.11 -1.18 -1.88 114.38 114.75 1av8 h ARG 292 Ca 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1av8 h ARG 292 Cb 1.29 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1av8 h ARG 292 CO 0.16 0.50 0.00 -0.25 0.10 0.00 0.00 179.97 180.48 1av8 n ASP 293 N -4.62 2.38 0.00 0.08 8.00 -1.26 -5.03 116.55 116.10 1av8 n ASP 293 Ca 0.19 -1.81 0.00 0.00 0.71 0.00 0.00 54.79 53.88 1av8 n ASP 293 Cb 0.48 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 1av8 n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1av8 n GLY 294 N 1.28 3.96 0.00 0.44 0.00 -0.71 -4.88 105.19 105.29 1av8 n GLY 294 Ca 0.17 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1av8 n GLY 294 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1av8 n SER 295 N 0.00 0.00 -3.48 1.61 3.41 -1.26 -4.68 113.62 109.23 1av8 n SER 295 Ca 0.00 -0.69 -0.14 0.00 -0.26 0.00 0.00 58.87 57.78 1av8 n SER 295 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1av8 n SER 295 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1av8 s MET 296 N -1.00 1.77 0.22 4.33 0.23 -1.10 -4.93 119.30 118.81 1av8 s MET 296 Ca 0.00 -1.67 -0.31 0.00 -1.03 0.00 0.00 55.69 52.68 1av8 s MET 296 Cb 0.00 0.42 -0.11 0.00 -1.53 0.00 0.00 34.83 33.62 1av8 s MET 296 CO 0.00 -0.72 1.55 0.42 -2.03 0.00 0.00 175.02 174.24 1av8 s ILE 297 N -3.35 2.45 0.00 3.16 1.01 -1.26 -2.92 121.20 120.29 1av8 s ILE 297 Ca 0.31 0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.31 1av8 s ILE 297 Cb 0.00 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1av8 s ILE 297 CO 0.18 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.77 1av8 n GLY 298 N 2.94 2.30 3.59 6.18 0.00 -1.26 -4.91 105.19 114.03 1av8 n GLY 298 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1av8 n GLY 298 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1av8 s LEU 299 N 0.00 -0.60 0.39 0.99 2.96 -1.15 -5.02 118.68 116.25 1av8 s LEU 299 Ca 0.00 1.37 -0.12 0.00 -0.22 0.00 0.00 54.13 55.16 1av8 s LEU 299 Cb 0.00 2.32 0.04 0.00 0.50 0.00 0.00 46.19 49.06 1av8 s LEU 299 CO 0.00 -0.24 0.72 0.54 -1.32 0.00 0.00 176.35 176.05 1av8 s ASN 300 N 0.41 0.29 0.17 3.68 2.20 -1.26 -2.72 114.94 117.72 1av8 s ASN 300 Ca -0.00 -1.28 -0.15 0.00 -0.94 0.00 0.00 52.86 50.49 1av8 s ASN 300 Cb -0.05 0.82 0.13 0.00 -2.00 0.00 0.00 41.25 40.15 1av8 s ASN 300 CO 0.00 -1.62 1.71 0.50 -2.94 0.00 0.00 177.10 174.75 1av8 h LYS 301 N 2.02 0.18 -0.01 3.55 3.64 -1.94 -0.03 116.57 123.98 1av8 h LYS 301 Ca -0.32 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1av8 h LYS 301 Cb 1.25 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1av8 h LYS 301 CO 0.41 0.12 0.00 -0.44 -2.27 0.00 0.00 179.45 177.27 1av8 h ASP 302 N 0.18 0.01 -0.80 4.20 3.32 -1.97 0.23 116.42 121.59 1av8 h ASP 302 Ca 0.21 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1av8 h ASP 302 Cb 0.28 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 1av8 h ASP 302 CO -0.30 0.10 0.49 0.40 -1.72 0.00 0.00 179.24 178.21 1av8 h ILE 303 N -0.09 1.22 -0.24 0.35 2.04 -1.93 -1.01 117.51 117.85 1av8 h ILE 303 Ca 0.00 -0.46 -0.13 0.00 1.00 0.00 0.00 64.86 65.27 1av8 h ILE 303 Cb 0.10 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1av8 h ILE 303 CO -0.00 0.23 -0.34 0.25 0.00 0.00 0.00 178.15 178.28 1av8 h LEU 304 N 1.09 0.72 -1.21 1.44 5.85 -0.74 -1.63 115.31 120.83 1av8 h LEU 304 Ca 0.29 -0.51 -0.07 0.00 0.84 0.00 0.00 57.88 58.42 1av8 h LEU 304 Cb -0.06 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1av8 h LEU 304 CO -0.06 1.09 -0.24 0.00 -0.34 0.00 0.00 178.44 178.89 1av8 h GLN 306 N 0.22 0.76 -0.79 0.00 4.15 -1.09 -2.58 115.11 115.77 1av8 h GLN 306 Ca 0.04 -0.51 0.03 0.00 0.77 0.00 0.00 58.65 58.97 1av8 h GLN 306 Cb 0.56 0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.27 1av8 h GLN 306 CO 0.04 1.13 0.50 -0.92 -1.93 0.00 0.00 178.83 177.66 1av8 h TYR 307 N 0.49 0.95 -0.71 3.99 3.20 -0.75 -0.09 116.97 124.05 1av8 h TYR 307 Ca -0.00 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.96 1av8 h TYR 307 Cb 1.13 -0.31 -0.06 0.00 1.54 0.00 0.00 36.73 39.03 1av8 h TYR 307 CO 0.08 0.55 0.40 0.28 -1.64 0.00 0.00 178.16 177.84 1av8 h VAL 308 N 0.99 0.96 -0.01 1.81 2.07 -0.77 -0.03 116.25 121.27 1av8 h VAL 308 Ca 0.31 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1av8 h VAL 308 Cb -0.02 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 29.93 1av8 h VAL 308 CO -0.10 0.13 0.00 -0.33 0.02 0.00 0.00 177.57 177.29 1av8 h GLU 309 N 0.72 0.02 -0.16 1.57 5.08 -0.90 -0.69 114.58 120.22 1av8 h GLU 309 Ca 0.32 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.72 1av8 h GLU 309 Cb 0.22 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1av8 h GLU 309 CO -0.20 0.29 -0.16 -0.92 -1.00 0.00 0.00 179.01 177.02 1av8 h TYR 310 N -0.26 -0.40 -0.48 4.33 3.20 -0.65 -1.29 116.97 121.42 1av8 h TYR 310 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1av8 h TYR 310 Cb 0.28 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 1av8 h TYR 310 CO 0.02 -0.23 0.26 0.82 -1.64 0.00 0.00 178.16 177.39 1av8 h ILE 311 N -0.18 1.17 -0.94 1.81 1.08 -0.99 -2.50 117.51 116.95 1av8 h ILE 311 Ca 0.11 -0.44 0.01 0.00 -0.39 0.00 0.00 64.86 64.14 1av8 h ILE 311 Cb 0.34 0.59 -0.05 0.00 -3.07 0.00 0.00 36.82 34.63 1av8 h ILE 311 CO -0.27 0.18 0.61 0.74 -0.69 0.00 0.00 178.15 178.72 1av8 h THR 312 N 0.63 1.25 0.37 -0.27 2.02 -0.75 -1.57 112.91 114.58 1av8 h THR 312 Ca 0.17 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 1av8 h THR 312 Cb 0.06 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.35 1av8 h THR 312 CO -0.03 0.24 -0.18 0.78 0.37 0.00 0.00 175.52 176.71 1av8 h ASN 313 N 1.28 -0.42 -0.92 4.18 2.35 -1.07 -1.32 115.58 119.66 1av8 h ASN 313 Ca 0.34 -0.04 0.13 0.00 -0.55 0.00 0.00 56.30 56.19 1av8 h ASN 313 Cb -0.12 0.11 -0.09 0.00 0.05 0.00 0.00 38.32 38.27 1av8 h ASN 313 CO -0.07 -0.23 0.54 0.40 -1.65 0.00 0.00 177.43 176.42 1av8 h ILE 314 N -0.58 0.83 0.01 2.81 2.04 -1.14 -0.15 117.51 121.32 1av8 h ILE 314 Ca -0.05 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1av8 h ILE 314 Cb 0.43 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1av8 h ILE 314 CO 0.08 0.15 -0.01 0.03 0.00 0.00 0.00 178.15 178.40 1av8 h ARG 315 N 0.81 -0.02 -0.64 2.37 2.47 -1.12 -2.74 114.38 115.51 1av8 h ARG 315 Ca 0.48 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 59.25 1av8 h ARG 315 Cb 0.58 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.87 1av8 h ARG 315 CO -0.31 0.45 0.42 0.52 0.56 0.00 0.00 179.97 181.61 1av8 h MET 316 N -0.49 0.67 0.11 0.04 2.86 -0.88 -1.76 114.93 115.49 1av8 h MET 316 Ca -0.00 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1av8 h MET 316 Cb 0.48 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1av8 h MET 316 CO 0.00 0.45 -0.22 0.37 1.06 0.00 0.00 176.91 178.57 1av8 h GLN 317 N 0.69 -0.39 -0.09 1.72 5.75 -0.96 -0.10 115.11 121.74 1av8 h GLN 317 Ca 0.27 0.03 0.03 0.00 -0.15 0.00 0.00 58.65 58.82 1av8 h GLN 317 Cb 0.18 0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.82 1av8 h GLN 317 CO -0.08 -0.26 0.17 0.00 -2.65 0.00 0.00 178.83 176.01 1av8 h ALA 318 N 0.39 1.48 -0.41 3.38 0.00 -1.01 -0.75 119.26 122.35 1av8 h ALA 318 Ca 0.03 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 1av8 h ALA 318 Cb 0.43 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.13 1av8 h ALA 318 CO -0.13 -0.22 0.03 1.33 0.00 0.00 0.00 179.25 180.27 1av8 n VAL 319 N -3.41 2.55 -3.50 0.00 0.24 -0.99 -4.96 118.33 108.27 1av8 n VAL 319 Ca -0.01 -2.34 -0.24 0.00 -2.04 0.00 0.00 64.34 59.71 1av8 n VAL 319 Cb 0.26 -0.32 0.06 0.00 -1.47 0.00 0.00 33.84 32.38 1av8 n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1av8 n GLY 320 N -0.89 -0.54 3.84 7.63 0.00 -0.29 -5.01 105.19 109.95 1av8 n GLY 320 Ca 0.32 0.22 -0.21 0.00 0.00 0.00 0.00 46.02 46.35 1av8 n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1av8 s LEU 321 N -7.15 3.42 0.17 0.99 1.43 -0.09 -5.02 118.68 112.44 1av8 s LEU 321 Ca 0.53 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.63 1av8 s LEU 321 Cb -0.24 -2.02 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 1av8 s LEU 321 CO 0.65 -0.51 0.96 -1.81 0.23 0.00 0.00 176.35 175.87 1av8 s ASP 322 N -4.04 7.56 -0.04 2.29 1.01 -1.26 -4.28 116.67 117.91 1av8 s ASP 322 Ca 0.44 1.88 -0.30 0.00 0.71 0.00 0.00 52.55 55.28 1av8 s ASP 322 Cb -0.03 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 1av8 s ASP 322 CO 0.26 0.03 1.40 -0.76 0.21 0.00 0.00 175.17 176.32 1av8 s LEU 323 N -0.57 4.29 0.00 1.23 1.43 -1.26 -4.92 118.68 118.88 1av8 s LEU 323 Ca 0.44 2.05 0.27 0.00 -1.03 0.00 0.00 54.13 55.86 1av8 s LEU 323 Cb -0.25 -3.55 0.95 0.00 0.03 0.00 0.00 46.19 43.37 1av8 s LEU 323 CO 0.31 -0.74 1.69 -0.81 0.23 0.00 0.00 176.35 177.02 1av8 n PRO 324 N 5.78 1.57 -4.28 1.29 -0.04 -1.26 -4.95 135.00 133.11 1av8 n PRO 324 Ca 0.14 -0.95 -0.18 0.00 -0.04 0.00 0.00 63.50 62.47 1av8 n PRO 324 Cb 0.44 -1.48 -0.11 0.00 -0.04 0.00 0.00 33.50 32.31 1av8 n PRO 324 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1av8 s PHE 325 N -2.08 1.51 -0.20 0.54 0.08 -1.26 -5.05 117.98 111.52 1av8 s PHE 325 Ca 0.35 -0.58 0.18 0.00 0.12 0.00 0.00 56.93 57.00 1av8 s PHE 325 Cb 0.21 -0.76 0.03 0.00 -0.57 0.00 0.00 43.02 41.93 1av8 s PHE 325 CO 0.36 0.21 1.20 1.96 -0.10 0.00 0.00 175.22 178.85 1av8 h GLN 326 N 3.13 0.00 -6.16 0.44 4.20 -1.96 -3.47 115.11 111.29 1av8 h GLN 326 Ca -0.39 0.00 -0.74 0.00 0.06 0.00 0.00 58.65 57.58 1av8 h GLN 326 Cb 1.20 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.01 1av8 h GLN 326 CO 0.55 0.27 0.65 2.41 -0.67 0.00 0.00 178.83 182.04 1av8 n THR 327 N -3.00 0.14 0.25 -0.54 -1.04 -1.26 -4.88 114.28 103.95 1av8 n THR 327 Ca -0.02 -0.03 0.04 0.00 -2.04 0.00 0.00 64.05 62.01 1av8 n THR 327 Cb 0.71 -0.90 -0.05 0.00 -1.82 0.00 0.00 70.33 68.26 1av8 n THR 327 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1av8 n ARG 328 N 3.88 2.87 -4.19 -2.82 1.74 -1.26 -4.71 116.66 112.17 1av8 n ARG 328 Ca 0.23 -0.03 -0.15 0.00 -0.77 0.00 0.00 57.85 57.14 1av8 n ARG 328 Cb 0.13 -1.00 -0.11 0.00 -1.02 0.00 0.00 32.46 30.46 1av8 n ARG 328 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1av8 s SER 329 N -2.20 1.55 -0.31 0.55 1.04 -1.26 -5.09 113.70 107.98 1av8 s SER 329 Ca 0.01 -0.86 -0.24 0.00 0.48 0.00 0.00 55.95 55.34 1av8 s SER 329 Cb 0.06 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1av8 s SER 329 CO 0.34 -0.27 0.84 0.21 0.98 0.00 0.00 173.24 175.34 1av8 s ASN 330 N -2.60 6.72 0.41 7.02 2.47 -1.26 -4.78 114.94 122.93 1av8 s ASN 330 Ca 0.08 0.75 0.28 0.00 0.42 0.00 0.00 52.86 54.39 1av8 s ASN 330 Cb -0.02 -2.43 1.07 0.00 -1.45 0.00 0.00 41.25 38.42 1av8 s ASN 330 CO 0.00 -0.65 1.83 1.55 -3.72 0.00 0.00 177.10 176.11 1av8 h PRO 331 N 8.09 0.00 -2.31 0.43 0.13 -1.91 -3.32 132.00 133.11 1av8 h PRO 331 Ca -0.24 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.30 1av8 h PRO 331 Cb 1.09 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.81 1av8 h PRO 331 CO 0.91 0.00 -0.67 0.44 -0.23 0.00 0.00 178.00 178.44 1av8 n ILE 332 N -2.74 1.70 0.32 -3.56 -5.35 -1.26 -4.91 119.36 103.55 1av8 n ILE 332 Ca 0.02 -4.94 0.20 0.00 -0.27 0.00 0.00 62.75 57.76 1av8 n ILE 332 Cb 0.32 -2.08 1.07 0.00 -1.74 0.00 0.00 39.64 37.21 1av8 n ILE 332 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1av8 h PRO 333 N 4.39 0.00 0.00 6.28 0.13 -2.01 -2.16 132.00 138.62 1av8 h PRO 333 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1av8 h PRO 333 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1av8 h PRO 333 CO 0.75 0.01 0.00 0.11 -0.23 0.00 0.00 178.00 178.64 1av8 h TRP 334 N 0.00 0.00 0.00 1.56 5.08 -1.94 -2.17 115.95 118.48 1av8 h TRP 334 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1av8 h TRP 334 Cb 0.08 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.24 1av8 h TRP 334 CO 0.00 0.00 0.00 0.97 -1.28 0.00 0.00 178.44 178.13 1av8 h ILE 335 N 0.00 0.00 0.00 0.12 2.10 -1.81 -2.32 117.51 115.60 1av8 h ILE 335 Ca 0.00 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.74 1av8 h ILE 335 Cb 0.19 1.17 0.00 0.00 -1.09 0.00 0.00 36.82 37.09 1av8 h ILE 335 CO 0.00 0.00 0.00 0.78 -1.08 0.00 0.00 178.15 177.85 1av8 h ASN 336 N 0.00 0.00 1.72 2.19 2.35 -1.62 -1.87 115.58 118.35 1av8 h ASN 336 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1av8 h ASN 336 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1av8 h ASN 336 CO 0.00 0.00 0.00 0.71 -1.65 0.00 0.00 177.43 176.49 1av8 h THR 337 N 0.00 0.00 0.13 2.81 1.35 -1.63 -3.24 112.91 112.33 1av8 h THR 337 Ca 0.00 -0.78 -0.36 0.00 -0.55 0.00 0.00 66.41 64.73 1av8 h THR 337 Cb 0.64 1.77 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 1av8 h THR 337 CO 0.00 0.00 -1.91 -0.50 -0.25 0.00 0.00 175.52 172.86 1av8 h TRP 338 N 0.00 0.50 -3.99 4.73 4.06 -1.56 -3.47 115.95 116.21 1av8 h TRP 338 Ca 0.00 -0.36 -0.52 0.00 2.06 0.00 0.00 58.89 60.06 1av8 h TRP 338 Cb 0.86 -0.02 0.08 0.00 -1.00 0.00 0.00 29.16 29.08 1av8 h TRP 338 CO 0.00 1.75 0.55 -0.51 -3.56 0.00 0.00 178.44 176.67 1av8 s LEU 339 N -7.14 4.04 0.00 -4.49 1.02 -0.75 -4.89 118.68 106.48 1av8 s LEU 339 Ca -0.22 2.51 0.00 0.00 0.02 0.00 0.00 54.13 56.44 1av8 s LEU 339 Cb 0.06 -4.14 0.00 0.00 0.02 0.00 0.00 46.19 42.13 1av8 s LEU 339 CO 0.77 -1.03 0.00 0.52 0.02 0.00 0.00 176.35 176.64