#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i8b h LEU 2 N 0.00 0.16 -9.40 2.46 6.46 -1.99 -3.40 115.31 109.61 3i8b h LEU 2 Ca 0.00 0.12 -0.54 0.00 -0.12 0.00 0.00 57.88 57.34 3i8b h LEU 2 Cb 0.00 0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 3i8b h LEU 2 CO 0.00 0.05 0.48 -0.60 -0.62 0.00 0.00 178.44 177.75 3i8b s ARG 3 N -6.04 4.49 -0.15 1.25 3.52 -1.26 -5.00 118.95 115.75 3i8b s ARG 3 Ca -0.13 1.53 -0.26 0.00 -0.13 0.00 0.00 55.73 56.74 3i8b s ARG 3 Cb 0.20 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 3i8b s ARG 3 CO 0.76 -0.18 0.88 0.99 -0.81 0.00 0.00 175.30 176.94 3i8b s THR 4 N 1.29 4.85 0.09 4.11 2.01 -1.26 -5.04 115.64 121.69 3i8b s THR 4 Ca 0.54 1.75 0.10 0.00 0.31 0.00 0.00 61.69 64.38 3i8b s THR 4 Cb -0.23 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.05 3i8b s THR 4 CO 0.26 0.02 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.21 3i8b s LEU 5 N 2.13 2.40 0.41 4.42 1.43 -1.26 -1.97 118.68 126.25 3i8b s LEU 5 Ca 0.41 -0.62 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 3i8b s LEU 5 Cb -0.17 -1.35 -0.05 0.00 0.03 0.00 0.00 46.19 44.65 3i8b s LEU 5 CO 0.14 0.21 0.05 0.68 0.23 0.00 0.00 176.35 177.65 3i8b s VAL 6 N -0.99 1.28 -0.04 -1.59 -7.23 0.16 -1.34 120.40 110.65 3i8b s VAL 6 Ca 0.14 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.32 3i8b s VAL 6 Cb -0.10 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.26 3i8b s VAL 6 CO 0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 175.10 174.81 3i8b s ALA 7 N -3.02 0.60 -0.23 1.32 0.00 -0.57 0.29 121.76 120.15 3i8b s ALA 7 Ca 0.26 -0.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.13 3i8b s ALA 7 Cb 0.06 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 3i8b s ALA 7 CO 0.13 -0.04 0.08 0.20 0.00 0.00 0.00 175.76 176.12 3i8b s GLY 8 N 0.97 1.83 -0.14 0.00 0.00 -0.75 -2.15 107.32 107.08 3i8b s GLY 8 Ca -0.10 -0.99 -0.05 0.00 0.00 0.00 0.00 44.72 43.58 3i8b s GLY 8 CO -0.00 0.38 0.02 0.14 0.00 0.00 0.00 173.10 173.63 3i8b s VAL 9 N 1.19 4.46 -0.36 1.40 1.01 0.23 -0.61 120.40 127.73 3i8b s VAL 9 Ca 0.05 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.90 3i8b s VAL 9 Cb -0.14 -2.95 0.10 0.00 0.00 0.00 0.00 36.38 33.39 3i8b s VAL 9 CO 0.04 0.52 0.08 -0.62 0.00 0.00 0.00 175.10 175.12 3i8b s ASP 10 N -0.11 4.70 -0.54 3.32 2.15 -0.30 0.38 116.67 126.26 3i8b s ASP 10 Ca 0.05 -2.25 -0.17 0.00 0.43 0.00 0.00 52.55 50.62 3i8b s ASP 10 Cb -0.12 -1.61 0.11 0.00 -0.30 0.00 0.00 42.92 41.00 3i8b s ASP 10 CO 0.02 -0.36 0.54 0.28 -0.17 0.00 0.00 175.17 175.47 3i8b s THR 11 N 0.78 5.10 0.52 1.71 -1.32 -0.21 -0.93 115.64 121.28 3i8b s THR 11 Ca 0.12 -1.27 0.08 0.00 -1.21 0.00 0.00 61.69 59.40 3i8b s THR 11 Cb -0.20 -4.35 0.05 0.00 -1.51 0.00 0.00 72.50 66.49 3i8b s THR 11 CO -0.07 -0.89 0.59 -0.94 -2.21 0.00 0.00 174.62 171.10 3i8b s SER 12 N 3.43 5.05 0.22 8.08 1.04 0.07 -1.66 113.70 129.93 3i8b s SER 12 Ca 0.06 -0.88 -0.08 0.00 0.48 0.00 0.00 55.95 55.53 3i8b s SER 12 Cb -0.27 0.05 0.35 0.00 0.10 0.00 0.00 66.02 66.25 3i8b s SER 12 CO 0.05 -1.08 1.73 0.74 0.98 0.00 0.00 173.24 175.65 3i8b h THR 13 N 0.54 0.70 0.00 2.02 2.02 -1.96 -3.18 112.91 113.05 3i8b h THR 13 Ca -0.35 -0.14 -0.21 0.00 0.77 0.00 0.00 66.41 66.48 3i8b h THR 13 Cb 1.29 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 3i8b h THR 13 CO 0.48 0.07 -1.22 1.56 0.37 0.00 0.00 175.52 176.79 3i8b h GLN 14 N 0.40 0.00 -2.60 6.66 4.20 -1.91 -3.43 115.11 118.43 3i8b h GLN 14 Ca 0.35 0.00 0.13 0.00 0.06 0.00 0.00 58.65 59.19 3i8b h GLN 14 Cb 0.49 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.21 3i8b h GLN 14 CO -0.36 0.63 0.41 -1.54 -0.67 0.00 0.00 178.83 177.29 3i8b s SER 15 N -6.30 -0.17 -0.12 1.46 1.04 -1.20 -0.23 113.70 108.18 3i8b s SER 15 Ca -0.01 -0.55 -0.01 0.00 0.48 0.00 0.00 55.95 55.86 3i8b s SER 15 Cb 0.09 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.78 3i8b s SER 15 CO 0.81 -1.10 -0.10 0.00 0.98 0.00 0.00 173.24 173.82 3i8b s LYS 17 N 0.15 2.00 -0.18 0.00 1.02 -0.11 -1.50 119.74 121.12 3i8b s LYS 17 Ca -0.05 -1.00 0.00 0.00 0.02 0.00 0.00 55.97 54.94 3i8b s LYS 17 Cb -0.15 -2.07 0.04 0.00 -0.52 0.00 0.00 37.83 35.14 3i8b s LYS 17 CO 0.04 0.54 -0.09 0.08 -0.92 0.00 0.00 175.35 175.00 3i8b s VAL 18 N -0.76 1.47 -0.51 3.17 1.01 0.34 -1.15 120.40 123.97 3i8b s VAL 18 Ca 0.12 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 3i8b s VAL 18 Cb -0.10 -1.54 0.13 0.00 0.00 0.00 0.00 36.38 34.87 3i8b s VAL 18 CO 0.02 0.21 0.33 -0.60 0.00 0.00 0.00 175.10 175.05 3i8b s ARG 19 N 1.48 2.32 -0.03 2.72 3.52 0.22 -1.97 118.95 127.23 3i8b s ARG 19 Ca 0.00 -2.10 -0.30 0.00 -0.13 0.00 0.00 55.73 53.21 3i8b s ARG 19 Cb -0.15 -3.71 -0.05 0.00 -1.56 0.00 0.00 34.95 29.48 3i8b s ARG 19 CO -0.08 -1.13 1.42 0.08 -0.81 0.00 0.00 175.30 174.77 3i8b s VAL 20 N 0.69 3.76 0.04 7.11 1.01 -0.41 -1.82 120.40 130.79 3i8b s VAL 20 Ca 0.11 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.19 3i8b s VAL 20 Cb -0.22 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 3i8b s VAL 20 CO -0.04 -0.03 -0.04 0.42 0.00 0.00 0.00 175.10 175.42 3i8b s THR 21 N 2.75 0.28 -0.06 3.92 -4.23 0.14 -1.04 115.64 117.41 3i8b s THR 21 Ca 0.64 -1.29 -0.30 0.00 -1.18 0.00 0.00 61.69 59.56 3i8b s THR 21 Cb -0.31 -0.82 -0.05 0.00 1.34 0.00 0.00 72.50 72.67 3i8b s THR 21 CO 0.26 -0.65 1.55 -0.62 -0.54 0.00 0.00 174.62 174.61 3i8b s ASP 22 N -2.05 6.74 0.36 3.99 -1.08 -0.00 -0.67 116.67 123.97 3i8b s ASP 22 Ca -0.06 2.13 0.06 0.00 -0.52 0.00 0.00 52.55 54.17 3i8b s ASP 22 Cb -0.04 -2.54 0.69 0.00 -1.46 0.00 0.00 42.92 39.58 3i8b s ASP 22 CO -0.04 -0.86 1.92 0.00 0.52 0.00 0.00 175.17 176.72 3i8b h ALA 23 N 8.97 1.47 0.18 3.66 0.00 -1.72 0.14 119.26 131.96 3i8b h ALA 23 Ca -0.37 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.07 3i8b h ALA 23 Cb 1.17 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.83 3i8b h ALA 23 CO 0.95 0.38 -1.44 1.49 0.00 0.00 0.00 179.25 180.63 3i8b h GLU 24 N 0.47 0.38 0.00 0.00 4.81 -1.91 -3.40 114.58 114.94 3i8b h GLU 24 Ca 0.11 -0.65 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 3i8b h GLU 24 Cb 0.24 0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3i8b h GLU 24 CO 0.00 1.30 -1.44 0.25 -0.73 0.00 0.00 179.01 178.39 3i8b n THR 25 N -3.59 0.00 -0.81 0.32 -2.24 -1.15 -4.84 114.28 101.96 3i8b n THR 25 Ca -0.15 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 3i8b n THR 25 Cb 1.06 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 3i8b n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i8b n GLY 26 N 1.80 1.13 3.77 3.38 0.00 0.47 -4.27 105.19 111.48 3i8b n GLY 26 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3i8b n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i8b s GLU 27 N -0.10 4.16 0.15 1.61 2.02 -1.26 -4.63 118.70 120.66 3i8b s GLU 27 Ca 0.00 2.50 -0.30 0.00 0.02 0.00 0.00 54.97 57.19 3i8b s GLU 27 Cb 0.00 -3.00 -0.08 0.00 0.10 0.00 0.00 34.13 31.15 3i8b s GLU 27 CO 0.00 -0.48 1.27 -1.17 0.02 0.00 0.00 175.26 174.89 3i8b s LEU 28 N -1.72 4.41 -0.08 1.80 0.20 -1.26 -0.82 118.68 121.21 3i8b s LEU 28 Ca 0.54 2.26 -0.06 0.00 0.69 0.00 0.00 54.13 57.56 3i8b s LEU 28 Cb -0.45 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 41.67 3i8b s LEU 28 CO 0.58 -0.49 -0.13 0.52 -0.29 0.00 0.00 176.35 176.54 3i8b n VAL 29 N 3.06 0.79 -4.12 1.68 0.31 -0.20 -4.89 118.33 114.95 3i8b n VAL 29 Ca 0.07 -0.01 -0.08 0.00 -0.01 0.00 0.00 64.34 64.30 3i8b n VAL 29 Cb 0.44 -1.71 -0.10 0.00 -0.91 0.00 0.00 33.84 31.56 3i8b n VAL 29 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3i8b s ARG 30 N -2.23 0.74 0.01 5.55 0.52 -1.02 -5.02 118.95 117.49 3i8b s ARG 30 Ca -0.13 -1.30 -0.12 0.00 -0.52 0.00 0.00 55.73 53.66 3i8b s ARG 30 Cb 0.04 0.14 0.01 0.00 0.52 0.00 0.00 34.95 35.66 3i8b s ARG 30 CO 0.18 -0.13 0.24 0.12 0.02 0.00 0.00 175.30 175.72 3i8b s PHE 31 N -3.90 -0.06 0.06 -0.53 2.19 -1.26 -1.28 117.98 113.20 3i8b s PHE 31 Ca 0.12 0.02 -0.26 0.00 0.33 0.00 0.00 56.93 57.14 3i8b s PHE 31 Cb 0.07 0.03 0.07 0.00 -1.31 0.00 0.00 43.02 41.88 3i8b s PHE 31 CO -0.06 -0.38 0.62 0.20 1.83 0.00 0.00 175.22 177.43 3i8b s GLY 32 N -1.56 -0.57 -0.12 13.12 0.00 -0.83 -3.69 107.32 113.66 3i8b s GLY 32 Ca -0.12 0.82 -0.23 0.00 0.00 0.00 0.00 44.72 45.19 3i8b s GLY 32 CO 0.01 0.49 0.57 1.62 0.00 0.00 0.00 173.10 175.79 3i8b s GLN 33 N -2.58 0.82 0.04 2.90 0.74 -1.26 -0.50 119.66 119.82 3i8b s GLN 33 Ca -0.05 0.44 -0.09 0.00 0.05 0.00 0.00 55.36 55.72 3i8b s GLN 33 Cb -0.01 0.39 0.00 0.00 1.10 0.00 0.00 33.01 34.50 3i8b s GLN 33 CO -0.02 -0.19 0.18 0.00 -0.55 0.00 0.00 175.29 174.71 3i8b s ALA 34 N -0.51 -0.33 0.20 1.58 0.00 -0.56 -4.59 121.76 117.55 3i8b s ALA 34 Ca -0.06 -0.32 -0.16 0.00 0.00 0.00 0.00 51.96 51.42 3i8b s ALA 34 Cb -0.03 0.28 -0.08 0.00 0.00 0.00 0.00 23.12 23.30 3i8b s ALA 34 CO 0.05 -0.36 0.63 0.15 0.00 0.00 0.00 175.76 176.23 3i8b s LYS 35 N -2.59 4.08 0.18 0.00 -0.14 -1.26 -0.71 119.74 119.29 3i8b s LYS 35 Ca -0.05 0.64 -0.02 0.00 -1.36 0.00 0.00 55.97 55.19 3i8b s LYS 35 Cb -0.01 -2.85 -0.05 0.00 -1.68 0.00 0.00 37.83 33.25 3i8b s LYS 35 CO -0.04 0.41 0.38 -1.01 -0.76 0.00 0.00 175.35 174.32 3i8b s HIS 36 N -1.55 3.48 0.72 3.18 3.76 0.68 -4.77 115.29 120.79 3i8b s HIS 36 Ca 0.42 0.39 -0.16 0.00 -0.15 0.00 0.00 55.06 55.55 3i8b s HIS 36 Cb -0.15 -1.88 0.03 0.00 1.11 0.00 0.00 32.58 31.69 3i8b s HIS 36 CO 0.20 0.41 1.26 -2.30 -0.85 0.00 0.00 174.74 173.45 3i8b n PRO 37 N -0.42 0.71 -1.40 8.40 -0.02 -1.26 -4.81 135.00 136.20 3i8b n PRO 37 Ca -0.04 0.31 -0.30 0.00 -2.02 0.00 0.00 63.50 61.44 3i8b n PRO 37 Cb 0.53 -2.49 0.09 0.00 -0.02 0.00 0.00 33.50 31.61 3i8b n PRO 37 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3i8b s ASN 38 N -1.70 4.51 0.00 2.55 0.02 -1.26 -4.92 114.94 114.14 3i8b s ASN 38 Ca 0.79 1.57 0.00 0.00 -1.02 0.00 0.00 52.86 54.20 3i8b s ASN 38 Cb -0.34 -2.32 0.00 0.00 0.02 0.00 0.00 41.25 38.61 3i8b s ASN 38 CO 0.45 -1.99 0.00 0.61 0.02 0.00 0.00 177.10 176.18 3i8b n GLY 39 N -1.62 3.93 0.70 0.66 0.00 -1.26 -4.91 105.19 102.69 3i8b n GLY 39 Ca 0.08 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 44.64 3i8b n GLY 39 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3i8b n THR 40 N -1.45 0.00 -4.03 2.61 -2.24 -1.26 -4.82 114.28 103.09 3i8b n THR 40 Ca 0.00 -0.36 -0.11 0.00 -2.27 0.00 0.00 64.05 61.31 3i8b n THR 40 Cb 0.00 1.08 -0.11 0.00 -2.10 0.00 0.00 70.33 69.20 3i8b n THR 40 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3i8b s SER 41 N -2.11 0.55 -0.07 3.42 0.01 -1.26 -1.42 113.70 112.83 3i8b s SER 41 Ca 0.29 -0.56 -0.30 0.00 1.31 0.00 0.00 55.95 56.69 3i8b s SER 41 Cb 0.20 0.08 0.09 0.00 0.21 0.00 0.00 66.02 66.60 3i8b s SER 41 CO 0.37 -0.28 0.80 0.54 0.41 0.00 0.00 173.24 175.08 3i8b s VAL 42 N -1.61 0.00 -0.29 3.43 0.11 -0.29 -4.95 120.40 116.80 3i8b s VAL 42 Ca -0.11 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.65 3i8b s VAL 42 Cb -0.09 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.78 3i8b s VAL 42 CO -0.01 0.00 1.08 -0.62 -3.33 0.00 0.00 175.10 172.22 3i8b s ASP 43 N -1.37 6.96 0.65 3.54 -1.08 -1.26 -0.38 116.67 123.72 3i8b s ASP 43 Ca -0.06 1.15 0.33 0.00 -0.52 0.00 0.00 52.55 53.45 3i8b s ASP 43 Cb -0.00 -2.54 1.79 0.00 -1.46 0.00 0.00 42.92 40.70 3i8b s ASP 43 CO 0.04 -0.83 2.04 -0.65 0.52 0.00 0.00 175.17 176.29 3i8b h PRO 44 N 7.99 0.00 -1.09 4.34 0.11 -1.95 0.13 132.00 141.53 3i8b h PRO 44 Ca -0.20 0.00 0.31 0.00 0.11 0.00 0.00 66.00 66.22 3i8b h PRO 44 Cb 1.06 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.06 3i8b h PRO 44 CO 1.02 0.00 0.68 0.77 -0.21 0.00 0.00 178.00 180.26 3i8b h SER 45 N 0.00 0.45 0.41 -2.05 0.02 -2.00 0.40 113.55 110.78 3i8b h SER 45 Ca 0.03 0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 3i8b h SER 45 Cb 0.55 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 3i8b h SER 45 CO -0.00 -0.02 -0.40 1.88 -1.14 0.00 0.00 176.83 177.15 3i8b h TYR 46 N 0.34 0.00 -0.21 3.45 0.05 -1.37 -1.90 116.97 117.33 3i8b h TYR 46 Ca 0.68 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 59.29 3i8b h TYR 46 Cb 1.74 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.47 3i8b h TYR 46 CO -0.01 0.40 -0.58 -1.49 -1.05 0.00 0.00 178.16 175.44 3i8b h TRP 47 N 0.00 0.83 -0.26 4.88 6.55 -0.39 -1.09 115.95 126.47 3i8b h TRP 47 Ca -0.00 -0.30 -0.03 0.00 0.95 0.00 0.00 58.89 59.50 3i8b h TRP 47 Cb 0.71 -0.15 -0.01 0.00 -0.86 0.00 0.00 29.16 28.85 3i8b h TRP 47 CO 0.00 1.07 0.04 2.35 -1.05 0.00 0.00 178.44 180.85 3i8b h TRP 48 N 0.49 0.45 -0.63 0.49 2.91 -1.15 -1.30 115.95 117.22 3i8b h TRP 48 Ca 0.00 -0.06 -0.02 0.00 1.13 0.00 0.00 58.89 59.94 3i8b h TRP 48 Cb 1.15 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.64 3i8b h TRP 48 CO 0.06 0.54 0.30 0.77 -1.03 0.00 0.00 178.44 179.07 3i8b h SER 49 N 0.23 0.82 -0.57 2.65 0.02 -1.31 -1.45 113.55 113.94 3i8b h SER 49 Ca 0.08 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 3i8b h SER 49 Cb 0.33 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3i8b h SER 49 CO 0.00 0.73 0.28 0.00 -1.14 0.00 0.00 176.83 176.71 3i8b h ALA 50 N 1.13 0.74 -0.44 3.77 0.00 -1.18 -1.58 119.26 121.70 3i8b h ALA 50 Ca 0.21 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3i8b h ALA 50 Cb 0.13 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3i8b h ALA 50 CO -0.03 0.29 0.21 0.35 0.00 0.00 0.00 179.25 180.08 3i8b h PHE 51 N 0.78 0.39 -0.48 0.00 3.57 -0.86 0.45 116.94 120.79 3i8b h PHE 51 Ca 0.20 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 3i8b h PHE 51 Cb 0.10 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 3i8b h PHE 51 CO -0.00 0.20 0.28 1.96 -2.23 0.00 0.00 178.31 178.52 3i8b h GLN 52 N 0.43 0.65 -0.37 1.11 4.20 -1.04 0.13 115.11 120.23 3i8b h GLN 52 Ca 0.19 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 3i8b h GLN 52 Cb 0.11 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 3i8b h GLN 52 CO -0.14 0.49 -0.35 1.49 -0.67 0.00 0.00 178.83 179.64 3i8b h GLU 53 N 0.64 0.84 -0.30 1.46 4.81 -1.09 -1.68 114.58 119.26 3i8b h GLU 53 Ca 0.17 -0.42 -0.02 0.00 -0.13 0.00 0.00 59.36 58.96 3i8b h GLU 53 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3i8b h GLU 53 CO -0.03 1.06 0.10 0.00 -0.73 0.00 0.00 179.01 179.40 3i8b h ALA 54 N 0.90 0.39 -0.71 2.92 0.00 -0.66 -1.59 119.26 120.51 3i8b h ALA 54 Ca 0.07 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3i8b h ALA 54 Cb 0.92 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 3i8b h ALA 54 CO 0.08 0.01 0.18 0.00 0.00 0.00 0.00 179.25 179.53 3i8b h ALA 55 N 0.93 0.98 -0.49 0.00 0.00 -0.63 -1.52 119.26 118.53 3i8b h ALA 55 Ca 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3i8b h ALA 55 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3i8b h ALA 55 CO -0.00 0.66 0.26 0.93 0.00 0.00 0.00 179.25 181.10 3i8b h GLU 56 N 1.07 0.70 -0.11 0.00 4.39 -1.23 0.86 114.58 120.25 3i8b h GLU 56 Ca 0.22 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 3i8b h GLU 56 Cb 0.36 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 3i8b h GLU 56 CO 0.00 0.56 -0.03 0.37 -1.16 0.00 0.00 179.01 178.75 3i8b h GLN 57 N 0.65 0.16 -0.11 2.33 4.15 -1.03 -0.41 115.11 120.85 3i8b h GLN 57 Ca 0.17 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.57 3i8b h GLN 57 Cb 0.08 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.74 3i8b h GLN 57 CO -0.03 0.20 0.00 0.00 -1.93 0.00 0.00 178.83 177.08 3i8b n ALA 58 N -2.51 2.49 -1.23 3.38 0.00 -0.59 -4.63 120.51 117.42 3i8b n ALA 58 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.22 3i8b n ALA 58 Cb 0.17 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3i8b n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i8b n GLY 59 N 0.70 0.42 0.24 0.00 0.00 -0.16 -4.54 105.19 101.85 3i8b n GLY 59 Ca 0.05 -0.99 0.03 0.00 0.00 0.00 0.00 46.02 45.11 3i8b n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i8b n GLY 60 N -2.38 -1.68 0.48 -0.02 0.00 0.25 -4.77 105.19 97.06 3i8b n GLY 60 Ca 0.00 -1.46 0.05 0.00 0.00 0.00 0.00 46.02 44.62 3i8b n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i8b n LEU 61 N -2.11 1.44 0.28 0.99 4.77 -1.26 -4.82 117.00 116.29 3i8b n LEU 61 Ca -0.00 -2.37 0.14 0.00 -0.03 0.00 0.00 56.01 53.74 3i8b n LEU 61 Cb 0.11 -0.25 0.80 0.00 -2.33 0.00 0.00 43.42 41.76 3i8b n LEU 61 CO 0.00 0.63 1.04 0.44 -1.33 0.00 0.00 177.39 178.17 3i8b h ASP 62 N 0.28 0.00 -0.53 -1.43 3.32 -1.86 -0.65 116.42 115.55 3i8b h ASP 62 Ca -0.03 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 3i8b h ASP 62 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 3i8b h ASP 62 CO 0.01 0.07 0.04 -0.90 -1.72 0.00 0.00 179.24 176.74 3i8b n ASP 63 N -3.73 5.19 -4.64 6.45 5.75 -1.26 -1.29 116.55 123.02 3i8b n ASP 63 Ca -0.02 -3.01 -0.35 0.00 -0.01 0.00 0.00 54.79 51.40 3i8b n ASP 63 Cb 0.17 -0.67 -0.10 0.00 -1.03 0.00 0.00 41.12 39.50 3i8b n ASP 63 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3i8b s VAL 64 N -2.83 4.52 -0.09 2.12 1.01 -0.77 -4.32 120.40 120.03 3i8b s VAL 64 Ca 0.52 -0.14 0.22 0.00 0.00 0.00 0.00 61.98 62.57 3i8b s VAL 64 Cb 0.41 -2.98 -0.25 0.00 0.00 0.00 0.00 36.38 33.56 3i8b s VAL 64 CO 0.14 0.52 0.60 -1.20 0.00 0.00 0.00 175.10 175.15 3i8b n SER 65 N 3.02 0.23 -3.58 3.32 7.64 -0.45 -3.35 113.62 120.46 3i8b n SER 65 Ca -0.18 0.09 -0.16 0.00 1.01 0.00 0.00 58.87 59.64 3i8b n SER 65 Cb 0.53 1.50 -0.06 0.00 -1.01 0.00 0.00 64.21 65.17 3i8b n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i8b s ALA 66 N -3.39 -1.46 -0.03 -0.43 0.00 -1.25 -1.79 121.76 113.40 3i8b s ALA 66 Ca -0.06 0.92 -0.04 0.00 0.00 0.00 0.00 51.96 52.77 3i8b s ALA 66 Cb 0.12 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.39 3i8b s ALA 66 CO 0.87 -0.40 0.11 -1.17 0.00 0.00 0.00 175.76 175.17 3i8b s LEU 67 N -1.48 1.62 0.02 0.00 0.20 -0.65 -1.52 118.68 116.87 3i8b s LEU 67 Ca -0.10 0.07 0.02 0.00 0.69 0.00 0.00 54.13 54.81 3i8b s LEU 67 Cb -0.01 0.44 -0.01 0.00 -0.43 0.00 0.00 46.19 46.17 3i8b s LEU 67 CO 0.05 -0.14 -0.08 0.00 -0.29 0.00 0.00 176.35 175.89 3i8b s ALA 68 N -0.41 0.63 -0.22 5.97 0.00 -0.91 -1.04 121.76 125.77 3i8b s ALA 68 Ca -0.05 -0.53 -0.04 0.00 0.00 0.00 0.00 51.96 51.33 3i8b s ALA 68 Cb -0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 3i8b s ALA 68 CO 0.00 0.09 -0.02 0.08 0.00 0.00 0.00 175.76 175.91 3i8b s VAL 69 N -0.70 3.57 -0.08 0.00 1.01 -1.26 -0.60 120.40 122.34 3i8b s VAL 69 Ca -0.02 -0.43 -0.14 0.00 0.00 0.00 0.00 61.98 61.39 3i8b s VAL 69 Cb -0.06 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 3i8b s VAL 69 CO 0.00 0.41 0.35 -0.83 0.00 0.00 0.00 175.10 175.04 3i8b s GLY 70 N 1.44 2.35 0.09 4.51 0.00 0.16 -1.63 107.32 114.23 3i8b s GLY 70 Ca 0.05 -0.33 0.04 0.00 0.00 0.00 0.00 44.72 44.48 3i8b s GLY 70 CO -0.01 0.28 -0.11 -0.32 0.00 0.00 0.00 173.10 172.93 3i8b s GLY 71 N -0.31 0.84 0.24 0.20 0.00 0.29 -1.05 107.32 107.53 3i8b s GLY 71 Ca 0.21 -1.12 -0.31 0.00 0.00 0.00 0.00 44.72 43.50 3i8b s GLY 71 CO 0.09 -1.18 1.31 0.61 0.00 0.00 0.00 173.10 173.93 3i8b n GLN 72 N 0.80 1.81 -1.45 2.90 10.64 -0.67 -0.31 117.38 131.10 3i8b n GLN 72 Ca -0.18 0.64 -0.31 0.00 -1.83 0.00 0.00 57.00 55.33 3i8b n GLN 72 Cb 0.57 -2.23 0.08 0.00 -0.86 0.00 0.00 30.24 27.79 3i8b n GLN 72 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 3i8b s GLN 73 N -0.67 2.46 0.00 2.61 -0.21 -1.26 -4.38 119.66 118.21 3i8b s GLN 73 Ca 0.67 0.94 0.00 0.00 0.02 0.00 0.00 55.36 56.99 3i8b s GLN 73 Cb -0.68 -1.94 0.00 0.00 1.00 0.00 0.00 33.01 31.39 3i8b s GLN 73 CO 0.52 -1.44 0.00 0.72 -2.12 0.00 0.00 175.29 172.98 3i8b n HIS 74 N -3.35 0.00 0.00 0.91 8.25 -1.26 -4.19 115.22 115.58 3i8b n HIS 74 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 3i8b n HIS 74 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 3i8b n HIS 74 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i8b n GLY 75 N 0.00 -0.45 0.00 -1.41 0.00 -1.26 -3.94 105.19 98.13 3i8b n GLY 75 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3i8b n GLY 75 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i8b n VAL 77 N -0.04 0.00 -4.49 1.61 0.31 -0.25 -3.79 118.33 111.68 3i8b n VAL 77 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 3i8b n VAL 77 Cb 0.00 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 32.81 3i8b n VAL 77 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 3i8b s ILE 78 N 0.00 3.80 0.03 2.52 -4.36 -1.26 -1.24 121.20 120.69 3i8b s ILE 78 Ca 0.00 -0.41 0.07 0.00 -0.26 0.00 0.00 60.65 60.06 3i8b s ILE 78 Cb 0.00 -2.63 -0.03 0.00 1.25 0.00 0.00 42.46 41.05 3i8b s ILE 78 CO 0.00 0.53 -0.20 -0.76 0.24 0.00 0.00 174.94 174.75 3i8b s LEU 79 N 0.00 2.49 0.00 0.37 1.43 -0.73 -0.64 118.68 121.60 3i8b s LEU 79 Ca 0.00 -0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 52.62 3i8b s LEU 79 Cb -0.13 -1.46 0.12 0.00 0.03 0.00 0.00 46.19 44.74 3i8b s LEU 79 CO 0.03 0.27 0.76 -0.90 0.23 0.00 0.00 176.35 176.74 3i8b n ASP 80 N 1.75 0.55 0.03 2.29 5.68 -0.16 -0.24 116.55 126.45 3i8b n ASP 80 Ca -0.16 -1.58 0.22 0.00 -0.50 0.00 0.00 54.79 52.77 3i8b n ASP 80 Cb 0.52 -0.54 0.72 0.00 -1.14 0.00 0.00 41.12 40.68 3i8b n ASP 80 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 3i8b h ASN 81 N -0.72 0.00 -0.56 -1.12 -0.26 -1.91 -1.76 115.58 109.25 3i8b h ASN 81 Ca -0.25 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.49 3i8b h ASN 81 Cb 0.81 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 3i8b h ASN 81 CO 0.22 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.59 3i8b n GLN 82 N -3.75 2.64 -0.98 0.81 6.02 -1.26 -4.53 117.38 116.32 3i8b n GLN 82 Ca 0.10 -2.42 0.00 0.00 -0.01 0.00 0.00 57.00 54.67 3i8b n GLN 82 Cb 0.74 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.51 3i8b n GLN 82 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3i8b n GLY 83 N 1.38 0.61 3.76 1.08 0.00 -0.66 -0.11 105.19 111.24 3i8b n GLY 83 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3i8b n GLY 83 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i8b s ASN 84 N -2.31 7.28 0.00 1.61 -0.87 -1.26 -3.80 114.94 115.60 3i8b s ASN 84 Ca 0.00 2.15 -0.30 0.00 -1.57 0.00 0.00 52.86 53.13 3i8b s ASN 84 Cb 0.00 -2.62 -0.06 0.00 -0.02 0.00 0.00 41.25 38.56 3i8b s ASN 84 CO 0.00 -0.12 1.44 -0.69 -2.57 0.00 0.00 177.10 175.16 3i8b s VAL 85 N -1.26 3.63 0.10 1.60 1.01 -1.26 -0.99 120.40 123.24 3i8b s VAL 85 Ca 0.46 1.01 -0.14 0.00 0.00 0.00 0.00 61.98 63.30 3i8b s VAL 85 Cb -0.29 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 3i8b s VAL 85 CO 0.36 -0.01 1.41 0.40 0.00 0.00 0.00 175.10 177.26 3i8b h ILE 86 N 4.96 1.30 -3.07 2.22 2.04 -1.23 -3.48 117.51 120.25 3i8b h ILE 86 Ca -0.38 -1.53 0.04 0.00 1.00 0.00 0.00 64.86 63.99 3i8b h ILE 86 Cb 1.18 1.62 -0.05 0.00 -0.74 0.00 0.00 36.82 38.83 3i8b h ILE 86 CO 0.91 0.49 0.20 0.00 0.00 0.00 0.00 178.15 179.75 3i8b s ARG 87 N -4.28 1.84 0.46 2.37 1.70 -1.26 -5.08 118.95 114.70 3i8b s ARG 87 Ca -0.12 -1.09 -0.24 0.00 -0.47 0.00 0.00 55.73 53.80 3i8b s ARG 87 Cb 0.09 0.60 -0.08 0.00 -0.57 0.00 0.00 34.95 34.98 3i8b s ARG 87 CO 0.84 -0.84 1.26 -0.25 -1.08 0.00 0.00 175.30 175.23 3i8b n ASP 88 N -0.62 2.42 -3.62 -2.89 9.92 -1.26 -4.76 116.55 115.75 3i8b n ASP 88 Ca -0.04 1.06 0.00 0.00 -0.53 0.00 0.00 54.79 55.27 3i8b n ASP 88 Cb 0.59 -1.51 0.00 0.00 -0.64 0.00 0.00 41.12 39.57 3i8b n ASP 88 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3i8b n ALA 89 N -0.49 0.00 -3.84 2.24 0.00 0.49 -4.76 120.51 114.14 3i8b n ALA 89 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.45 3i8b n ALA 89 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 3i8b n ALA 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i8b s LEU 91 N 0.00 -0.18 0.52 0.00 1.43 -0.51 -1.14 118.68 118.81 3i8b s LEU 91 Ca 0.00 -0.76 0.27 0.00 -1.03 0.00 0.00 54.13 52.61 3i8b s LEU 91 Cb 0.00 2.73 1.40 0.00 0.03 0.00 0.00 46.19 50.35 3i8b s LEU 91 CO 0.00 -1.43 1.94 4.11 0.23 0.00 0.00 176.35 181.21 3i8b h TRP 92 N 2.00 0.05 -0.27 0.29 5.08 -1.79 -1.03 115.95 120.29 3i8b h TRP 92 Ca -0.23 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.74 3i8b h TRP 92 Cb 1.25 -0.02 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 3i8b h TRP 92 CO 0.72 0.02 0.00 0.27 -1.28 0.00 0.00 178.44 178.16 3i8b n ASN 93 N -4.35 3.25 -4.73 0.11 6.94 -1.26 -4.15 115.26 111.07 3i8b n ASN 93 Ca 0.14 -1.97 -0.42 0.00 -0.02 0.00 0.00 54.58 52.32 3i8b n ASN 93 Cb 0.75 -0.17 -0.03 0.00 -2.36 0.00 0.00 39.78 37.97 3i8b n ASN 93 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3i8b s ASP 94 N -1.58 6.73 0.00 0.53 2.15 -0.39 -4.92 116.67 119.20 3i8b s ASP 94 Ca 0.34 2.54 0.13 0.00 0.43 0.00 0.00 52.55 55.99 3i8b s ASP 94 Cb 0.21 -2.61 0.21 0.00 -0.30 0.00 0.00 42.92 40.43 3i8b s ASP 94 CO 0.30 -0.67 1.08 0.35 -0.17 0.00 0.00 175.17 176.06 3i8b n THR 95 N 2.89 0.42 -0.33 1.71 -2.24 -1.26 -4.55 114.28 110.92 3i8b n THR 95 Ca 0.08 -0.71 0.18 0.00 -2.27 0.00 0.00 64.05 61.33 3i8b n THR 95 Cb 0.41 0.95 0.41 0.00 -2.10 0.00 0.00 70.33 70.01 3i8b n THR 95 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3i8b h SER 96 N 2.53 0.62 -0.26 3.42 0.02 -1.93 -2.53 113.55 115.41 3i8b h SER 96 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3i8b h SER 96 Cb 0.65 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.17 3i8b h SER 96 CO 0.00 0.17 0.00 -1.54 -1.14 0.00 0.00 176.83 174.32 3i8b n SER 97 N -4.71 1.69 -0.25 3.07 3.41 -1.26 -4.31 113.62 111.25 3i8b n SER 97 Ca 0.24 -1.86 0.04 0.00 -0.26 0.00 0.00 58.87 57.03 3i8b n SER 97 Cb 0.71 -0.17 0.17 0.00 -0.26 0.00 0.00 64.21 64.67 3i8b n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i8b h ALA 98 N 3.79 1.04 -0.87 7.33 0.00 -1.76 -0.84 119.26 127.94 3i8b h ALA 98 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3i8b h ALA 98 Cb 0.45 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3i8b h ALA 98 CO 0.00 -0.17 0.48 -1.35 0.00 0.00 0.00 179.25 178.21 3i8b h PRO 99 N 0.48 1.21 -0.47 0.00 0.11 -1.85 -1.91 132.00 129.57 3i8b h PRO 99 Ca 0.40 -0.14 -0.08 0.00 0.11 0.00 0.00 66.00 66.29 3i8b h PRO 99 Cb 0.56 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 3i8b h PRO 99 CO -0.37 0.88 -0.04 1.96 -0.21 0.00 0.00 178.00 180.22 3i8b h GLN 100 N 1.22 0.81 -0.39 1.05 7.50 -1.57 0.45 115.11 124.17 3i8b h GLN 100 Ca 0.31 -0.24 -0.01 0.00 0.50 0.00 0.00 58.65 59.21 3i8b h GLN 100 Cb 0.02 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.44 3i8b h GLN 100 CO -0.05 0.84 0.21 0.00 -1.50 0.00 0.00 178.83 178.33 3i8b h ALA 101 N 1.21 0.51 -0.27 3.87 0.00 -0.80 -0.13 119.26 123.64 3i8b h ALA 101 Ca 0.14 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3i8b h ALA 101 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3i8b h ALA 101 CO 0.03 0.04 0.15 0.00 0.00 0.00 0.00 179.25 179.47 3i8b h ALA 102 N 1.06 0.33 -0.85 0.00 0.00 -0.98 -2.84 119.26 115.99 3i8b h ALA 102 Ca 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3i8b h ALA 102 Cb 0.07 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3i8b h ALA 102 CO -0.02 -0.23 0.39 0.00 0.00 0.00 0.00 179.25 179.39 3i8b h ALA 103 N 1.12 1.10 -0.88 0.00 0.00 -0.66 -2.38 119.26 117.55 3i8b h ALA 103 Ca 0.11 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3i8b h ALA 103 Cb 0.01 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 17.40 3i8b h ALA 103 CO -0.06 0.67 0.56 -0.07 0.00 0.00 0.00 179.25 180.35 3i8b h LEU 104 N 1.21 0.89 -0.06 0.00 3.38 -0.85 0.23 115.31 120.11 3i8b h LEU 104 Ca 0.29 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 3i8b h LEU 104 Cb 0.14 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3i8b h LEU 104 CO -0.03 0.59 0.02 0.40 0.09 0.00 0.00 178.44 179.50 3i8b h ILE 105 N 1.04 1.14 -0.87 1.22 2.04 -1.24 -1.90 117.51 118.95 3i8b h ILE 105 Ca 0.37 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 3i8b h ILE 105 Cb 0.12 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 3i8b h ILE 105 CO -0.15 0.12 0.49 -0.33 0.00 0.00 0.00 178.15 178.28 3i8b h GLU 106 N -0.07 1.20 -0.34 2.37 5.08 -0.99 -0.95 114.58 120.87 3i8b h GLU 106 Ca 0.02 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 3i8b h GLU 106 Cb 0.17 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3i8b h GLU 106 CO -0.00 0.86 0.10 -0.22 -1.00 0.00 0.00 179.01 178.75 3i8b h LYS 107 N 1.21 0.54 0.00 2.33 1.63 -0.39 -1.28 116.57 120.61 3i8b h LYS 107 Ca 0.31 -0.12 -0.12 0.00 -0.85 0.00 0.00 60.65 59.86 3i8b h LYS 107 Cb 0.00 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 3i8b h LYS 107 CO -0.05 0.58 -0.58 -0.07 -3.45 0.00 0.00 179.45 175.88 3i8b h LEU 108 N 0.40 0.00 0.00 5.20 3.38 -1.23 -3.18 115.31 119.88 3i8b h LEU 108 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3i8b h LEU 108 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3i8b h LEU 108 CO -0.00 0.58 -0.11 1.23 0.09 0.00 0.00 178.44 180.23 3i8b h GLY 109 N 2.04 0.00 0.38 0.83 0.00 -0.97 -3.39 103.07 101.96 3i8b h GLY 109 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.37 3i8b h GLY 109 CO 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 176.54 176.45 3i8b h ALA 110 N 2.48 -0.06 -2.12 3.60 0.00 -1.22 -3.43 119.26 118.51 3i8b h ALA 110 Ca 0.00 0.06 -0.60 0.00 0.00 0.00 0.00 54.91 54.38 3i8b h ALA 110 Cb 0.76 0.35 0.11 0.00 0.00 0.00 0.00 17.79 19.02 3i8b h ALA 110 CO 0.00 -0.61 0.18 0.00 0.00 0.00 0.00 179.25 178.83 3i8b n ALA 111 N -2.63 0.05 -1.58 0.00 0.00 -1.26 -4.87 120.51 110.21 3i8b n ALA 111 Ca -0.02 0.36 -0.36 0.00 0.00 0.00 0.00 53.44 53.42 3i8b n ALA 111 Cb 0.23 -2.06 0.08 0.00 0.00 0.00 0.00 19.45 17.70 3i8b n ALA 111 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3i8b n PRO 112 N 0.62 0.89 -1.64 0.00 -0.02 -1.26 -4.89 135.00 128.69 3i8b n PRO 112 Ca 0.09 0.36 -0.45 0.00 -2.02 0.00 0.00 63.50 61.48 3i8b n PRO 112 Cb 0.34 -2.45 -0.02 0.00 -0.02 0.00 0.00 33.50 31.35 3i8b n PRO 112 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i8b n ALA 113 N -2.18 0.51 -2.80 3.55 0.00 -1.26 -5.01 120.51 113.31 3i8b n ALA 113 Ca 0.15 0.40 -0.23 0.00 0.00 0.00 0.00 53.44 53.76 3i8b n ALA 113 Cb 0.48 -2.16 -0.05 0.00 0.00 0.00 0.00 19.45 17.73 3i8b n ALA 113 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3i8b s GLN 114 N -1.14 2.85 0.00 0.00 -1.52 -1.26 -4.96 119.66 113.63 3i8b s GLN 114 Ca 0.63 -1.06 0.00 0.00 -1.95 0.00 0.00 55.36 52.98 3i8b s GLN 114 Cb -0.67 -2.54 0.00 0.00 -0.22 0.00 0.00 33.01 29.58 3i8b s GLN 114 CO 0.56 0.41 0.00 -0.40 -0.25 0.00 0.00 175.29 175.62 3i8b n ASP 115 N -0.99 0.00 0.00 5.90 5.68 -1.26 0.64 116.55 126.52 3i8b n ASP 115 Ca -0.08 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.21 3i8b n ASP 115 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 3i8b n ASP 115 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3i8b n GLY 116 N 0.00 3.12 3.75 6.12 0.00 -1.26 -5.05 105.19 111.87 3i8b n GLY 116 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3i8b n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i8b s GLU 117 N -0.31 3.08 0.61 1.61 2.02 0.21 -4.97 118.70 120.94 3i8b s GLU 117 Ca 0.00 1.97 -0.19 0.00 0.02 0.00 0.00 54.97 56.77 3i8b s GLU 117 Cb 0.00 -2.09 -0.04 0.00 0.10 0.00 0.00 34.13 32.11 3i8b s GLU 117 CO 0.00 -1.15 1.17 -2.30 0.02 0.00 0.00 175.26 172.99 3i8b n PRO 118 N -1.30 1.14 0.08 0.39 -0.02 -1.26 -4.68 135.00 129.35 3i8b n PRO 118 Ca 0.12 0.44 -0.16 0.00 -2.02 0.00 0.00 63.50 61.88 3i8b n PRO 118 Cb 0.48 -2.38 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 3i8b n PRO 118 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3i8b h GLU 119 N 0.71 0.39 -6.43 -0.52 4.39 -1.98 -3.43 114.58 107.71 3i8b h GLU 119 Ca -0.50 -0.51 -0.53 0.00 0.34 0.00 0.00 59.36 58.16 3i8b h GLU 119 Cb 1.34 0.17 0.02 0.00 -0.10 0.00 0.00 28.75 30.18 3i8b h GLU 119 CO 0.53 1.18 1.01 0.34 -1.16 0.00 0.00 179.01 180.92 3i8b s ASP 120 N -7.16 6.60 0.39 1.42 2.15 -1.26 -4.90 116.67 113.92 3i8b s ASP 120 Ca -0.06 2.47 0.07 0.00 0.43 0.00 0.00 52.55 55.47 3i8b s ASP 120 Cb 0.08 -2.56 0.81 0.00 -0.30 0.00 0.00 42.92 40.94 3i8b s ASP 120 CO 0.88 -0.89 2.00 -0.65 -0.17 0.00 0.00 175.17 176.33 3i8b h PRO 121 N 8.48 0.46 0.05 4.34 0.11 -1.85 -0.69 132.00 142.90 3i8b h PRO 121 Ca -0.43 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3i8b h PRO 121 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3i8b h PRO 121 CO 0.93 0.39 -0.02 0.82 -0.21 0.00 0.00 178.00 179.91 3i8b h ILE 122 N 0.46 1.27 -0.76 4.15 1.08 -1.89 0.76 117.51 122.58 3i8b h ILE 122 Ca 0.11 -1.10 0.06 0.00 -0.39 0.00 0.00 64.86 63.54 3i8b h ILE 122 Cb 0.11 1.99 -0.05 0.00 -3.07 0.00 0.00 36.82 35.80 3i8b h ILE 122 CO -0.01 0.27 0.50 0.00 -0.69 0.00 0.00 178.15 178.22 3i8b h ALA 123 N 0.35 1.65 -0.27 1.87 0.00 -1.91 -0.45 119.26 120.51 3i8b h ALA 123 Ca -0.01 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 3i8b h ALA 123 Cb 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3i8b h ALA 123 CO 0.01 0.24 -0.58 -0.09 0.00 0.00 0.00 179.25 178.82 3i8b h ARG 124 N 0.82 0.85 -0.37 0.00 2.43 -1.01 -1.88 114.38 115.23 3i8b h ARG 124 Ca 0.32 -0.56 -0.06 0.00 -0.81 0.00 0.00 59.98 58.87 3i8b h ARG 124 Cb 0.22 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3i8b h ARG 124 CO -0.11 1.19 -0.01 0.78 -1.51 0.00 0.00 179.97 180.32 3i8b h GLY 125 N 0.69 0.71 0.69 2.80 0.00 -0.28 -1.26 103.07 106.41 3i8b h GLY 125 Ca 0.00 -0.53 0.04 0.00 0.00 0.00 0.00 47.33 46.85 3i8b h GLY 125 CO 0.13 0.48 0.16 0.50 0.00 0.00 0.00 176.54 177.81 3i8b h LYS 126 N 0.47 0.33 -0.69 4.80 1.57 -1.05 -1.57 116.57 120.43 3i8b h LYS 126 Ca 0.10 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 3i8b h LYS 126 Cb 0.47 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3i8b h LYS 126 CO 0.02 0.22 0.27 0.37 -0.57 0.00 0.00 179.45 179.75 3i8b h GLN 127 N 0.34 1.01 -0.19 3.15 4.15 -1.14 -1.78 115.11 120.65 3i8b h GLN 127 Ca 0.18 -0.17 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 3i8b h GLN 127 Cb 0.15 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 3i8b h GLN 127 CO -0.17 0.83 -0.35 0.00 -1.93 0.00 0.00 178.83 177.20 3i8b h ARG 128 N 0.99 0.40 -0.11 1.69 3.08 -0.82 -1.77 114.38 117.84 3i8b h ARG 128 Ca 0.23 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3i8b h ARG 128 Cb 0.20 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 3i8b h ARG 128 CO -0.02 0.71 -0.02 -1.49 -1.07 0.00 0.00 179.97 178.08 3i8b h TRP 129 N 0.34 0.24 -0.34 3.04 4.06 -0.92 -0.93 115.95 121.44 3i8b h TRP 129 Ca 0.04 -0.05 0.05 0.00 2.06 0.00 0.00 58.89 60.99 3i8b h TRP 129 Cb 0.79 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.84 3i8b h TRP 129 CO 0.02 0.50 0.06 0.28 -3.56 0.00 0.00 178.44 175.74 3i8b h VAL 130 N -0.09 0.83 -0.34 1.49 2.07 -1.23 -0.95 116.25 118.04 3i8b h VAL 130 Ca 0.03 -0.06 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 3i8b h VAL 130 Cb 0.41 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 3i8b h VAL 130 CO 0.01 0.03 -0.09 0.11 0.02 0.00 0.00 177.57 177.65 3i8b h LYS 131 N 0.18 0.56 -0.09 1.57 1.57 -1.34 0.29 116.57 119.31 3i8b h LYS 131 Ca 0.16 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3i8b h LYS 131 Cb 0.18 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 3i8b h LYS 131 CO -0.21 0.66 -0.10 0.00 -0.57 0.00 0.00 179.45 179.23 3i8b h ALA 132 N 1.38 0.14 0.00 3.86 0.00 -0.61 -3.41 119.26 120.61 3i8b h ALA 132 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3i8b h ALA 132 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3i8b h ALA 132 CO 0.03 -0.03 0.00 1.33 0.00 0.00 0.00 179.25 180.58 3i8b n VAL 133 N -4.66 0.01 0.00 0.00 0.24 -0.41 -4.67 118.33 108.84 3i8b n VAL 133 Ca -0.07 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 3i8b n VAL 133 Cb 0.33 1.69 0.00 0.00 -1.47 0.00 0.00 33.84 34.38 3i8b n VAL 133 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3i8b n GLY 134 N -0.01 3.23 2.96 7.63 0.00 0.10 -4.75 105.19 114.36 3i8b n GLY 134 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 3i8b n GLY 134 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i8b s SER 135 N -0.74 0.19 -0.08 1.61 0.01 -1.25 -1.51 113.70 111.93 3i8b s SER 135 Ca 0.00 -0.40 -0.22 0.00 1.31 0.00 0.00 55.95 56.64 3i8b s SER 135 Cb 0.00 0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 3i8b s SER 135 CO 0.00 -0.25 0.65 -0.55 0.41 0.00 0.00 173.24 173.51 3i8b s SER 136 N -1.19 6.92 0.14 2.44 0.15 -1.26 -3.88 113.70 117.02 3i8b s SER 136 Ca -0.13 1.11 -0.34 0.00 0.70 0.00 0.00 55.95 57.29 3i8b s SER 136 Cb -0.08 -2.39 -0.16 0.00 -1.71 0.00 0.00 66.02 61.68 3i8b s SER 136 CO -0.01 -0.10 1.15 -2.65 1.20 0.00 0.00 173.24 172.84 3i8b n PRO 137 N 3.78 0.99 -4.26 5.44 -0.02 -1.26 -5.02 135.00 134.66 3i8b n PRO 137 Ca -0.02 0.35 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 3i8b n PRO 137 Cb 0.51 -1.85 -0.10 0.00 -0.02 0.00 0.00 33.50 32.04 3i8b n PRO 137 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3i8b s VAL 138 N -0.11 0.55 0.59 -1.45 -7.23 -1.26 -4.82 120.40 106.67 3i8b s VAL 138 Ca 0.76 -1.98 0.29 0.00 -1.81 0.00 0.00 61.98 59.24 3i8b s VAL 138 Cb -0.91 -2.32 0.37 0.00 0.56 0.00 0.00 36.38 34.08 3i8b s VAL 138 CO 0.52 -0.28 2.02 0.00 -0.31 0.00 0.00 175.10 177.05 3i8b h ALA 139 N 2.59 1.92 -0.94 1.32 0.00 -1.88 -2.37 119.26 119.89 3i8b h ALA 139 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3i8b h ALA 139 Cb 1.22 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 3i8b h ALA 139 CO 0.61 -0.45 0.60 0.77 0.00 0.00 0.00 179.25 180.78 3i8b h SER 140 N 0.00 1.10 -3.94 0.00 0.02 -1.80 -3.44 113.55 105.49 3i8b h SER 140 Ca 0.13 -0.04 -0.51 0.00 -0.84 0.00 0.00 61.79 60.53 3i8b h SER 140 Cb 0.75 -0.28 0.05 0.00 0.14 0.00 0.00 62.40 63.07 3i8b h SER 140 CO -0.00 0.82 0.50 -0.31 -1.14 0.00 0.00 176.83 176.70 3i8b s TYR 141 N -6.01 3.09 0.17 3.45 2.02 -0.89 -4.49 117.35 114.69 3i8b s TYR 141 Ca -0.13 1.56 -0.14 0.00 -0.37 0.00 0.00 57.07 57.99 3i8b s TYR 141 Cb 0.18 -3.39 0.14 0.00 -0.40 0.00 0.00 41.96 38.49 3i8b s TYR 141 CO 0.82 -1.28 1.74 1.15 -1.57 0.00 0.00 175.55 176.41 3i8b h THR 142 N 2.37 0.82 -0.86 -0.71 2.02 -1.65 -1.17 112.91 113.73 3i8b h THR 142 Ca -0.49 -0.10 0.15 0.00 0.77 0.00 0.00 66.41 66.75 3i8b h THR 142 Cb 1.23 0.50 -0.07 0.00 -1.74 0.00 0.00 68.15 68.08 3i8b h THR 142 CO 0.63 0.05 0.56 0.25 0.37 0.00 0.00 175.52 177.38 3i8b h LEU 143 N 0.29 0.57 -1.06 2.58 5.85 -1.61 -0.58 115.31 121.36 3i8b h LEU 143 Ca 0.22 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.88 3i8b h LEU 143 Cb 0.23 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3i8b h LEU 143 CO -0.24 0.28 -0.31 0.71 -0.34 0.00 0.00 178.44 178.55 3i8b h THR 144 N 0.60 1.27 -0.30 1.05 1.35 -1.49 -0.50 112.91 114.89 3i8b h THR 144 Ca 0.44 -1.28 -0.07 0.00 -0.55 0.00 0.00 66.41 64.94 3i8b h THR 144 Cb 0.80 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3i8b h THR 144 CO -0.19 0.39 -0.08 0.11 -0.25 0.00 0.00 175.52 175.50 3i8b h LYS 145 N 0.25 0.59 -0.46 4.72 1.79 -1.05 -0.82 116.57 121.59 3i8b h LYS 145 Ca 0.03 -0.23 -0.02 0.00 -2.18 0.00 0.00 60.65 58.26 3i8b h LYS 145 Cb 0.67 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 3i8b h LYS 145 CO 0.05 0.78 0.22 0.28 -1.08 0.00 0.00 179.45 179.70 3i8b h VAL 146 N 0.35 1.19 -0.61 0.50 2.07 -1.10 -0.84 116.25 117.81 3i8b h VAL 146 Ca 0.08 -0.54 0.12 0.00 0.82 0.00 0.00 66.70 67.17 3i8b h VAL 146 Cb 0.57 0.69 -0.09 0.00 -1.52 0.00 0.00 31.29 30.95 3i8b h VAL 146 CO 0.03 0.21 0.14 0.00 0.02 0.00 0.00 177.57 177.97 3i8b h ALA 147 N 1.06 0.74 -0.72 1.67 0.00 -0.98 -0.86 119.26 120.16 3i8b h ALA 147 Ca 0.16 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3i8b h ALA 147 Cb 0.13 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3i8b h ALA 147 CO -0.02 -0.30 0.28 2.35 0.00 0.00 0.00 179.25 181.56 3i8b h TRP 148 N 0.27 1.10 -0.53 0.00 7.01 -0.44 -1.19 115.95 122.17 3i8b h TRP 148 Ca 0.32 -0.09 -0.09 0.00 2.11 0.00 0.00 58.89 61.15 3i8b h TRP 148 Cb 0.48 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.19 3i8b h TRP 148 CO -0.24 0.85 -0.02 0.28 -2.79 0.00 0.00 178.44 176.51 3i8b h VAL 149 N 1.03 1.26 -0.54 2.65 2.07 -0.69 0.14 116.25 122.17 3i8b h VAL 149 Ca 0.24 -1.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 3i8b h VAL 149 Cb 0.22 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3i8b h VAL 149 CO -0.02 0.40 0.08 0.00 0.02 0.00 0.00 177.57 178.05 3i8b h ALA 150 N 1.12 1.12 0.05 1.67 0.00 -0.69 0.20 119.26 122.73 3i8b h ALA 150 Ca 0.15 -0.24 -0.27 0.00 0.00 0.00 0.00 54.91 54.55 3i8b h ALA 150 Cb 0.53 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 18.12 3i8b h ALA 150 CO 0.03 0.58 -1.11 1.49 0.00 0.00 0.00 179.25 180.23 3i8b h GLU 151 N 0.82 0.62 0.00 0.00 4.57 -0.76 -3.35 114.58 116.49 3i8b h GLU 151 Ca 0.17 -0.73 -0.12 0.00 -1.18 0.00 0.00 59.36 57.50 3i8b h GLU 151 Cb 0.38 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 3i8b h GLU 151 CO 0.01 1.31 -1.98 0.09 -1.18 0.00 0.00 179.01 177.26 3i8b n ASN 152 N -3.80 0.70 -3.19 1.04 3.02 0.45 -4.71 115.26 108.76 3i8b n ASN 152 Ca -0.11 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.22 3i8b n ASN 152 Cb 0.92 1.52 -0.05 0.00 -0.61 0.00 0.00 39.78 41.56 3i8b n ASN 152 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3i8b n GLU 153 N -2.33 1.08 -0.35 3.52 1.02 0.71 -4.99 120.64 119.30 3i8b n GLU 153 Ca -0.12 -3.47 0.09 0.00 -0.02 0.00 0.00 57.16 53.64 3i8b n GLU 153 Cb 0.70 -1.56 0.28 0.00 -0.02 0.00 0.00 31.44 30.84 3i8b n GLU 153 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3i8b h PRO 154 N 3.48 0.87 -0.59 3.49 0.11 -1.68 -1.09 132.00 136.58 3i8b h PRO 154 Ca 0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3i8b h PRO 154 Cb 0.89 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.77 3i8b h PRO 154 CO 0.52 0.57 0.38 0.93 -0.21 0.00 0.00 178.00 180.19 3i8b h GLU 155 N 0.89 0.78 -0.12 1.05 3.07 -1.93 -2.37 114.58 115.95 3i8b h GLU 155 Ca 0.52 -0.05 -0.20 0.00 -0.50 0.00 0.00 59.36 59.12 3i8b h GLU 155 Cb 0.64 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3i8b h GLU 155 CO -0.29 0.53 -0.71 -0.91 -1.40 0.00 0.00 179.01 176.23 3i8b h ASN 156 N 0.80 0.84 -0.02 1.42 -0.26 -1.58 -3.27 115.58 113.52 3i8b h ASN 156 Ca 0.22 -0.65 -0.07 0.00 -0.56 0.00 0.00 56.30 55.24 3i8b h ASN 156 Cb -0.07 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 36.92 3i8b h ASN 156 CO -0.04 1.35 -0.17 1.62 -1.06 0.00 0.00 177.43 179.12 3i8b h VAL 157 N 0.38 1.23 0.00 2.81 3.04 -1.01 -2.30 116.25 120.40 3i8b h VAL 157 Ca -0.05 -1.02 0.00 0.00 -1.01 0.00 0.00 66.70 64.62 3i8b h VAL 157 Cb 1.35 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.89 3i8b h VAL 157 CO 0.15 0.32 0.00 0.11 -1.01 0.00 0.00 177.57 177.14 3i8b h LYS 158 N 0.33 0.00 0.00 4.17 1.57 -1.51 -2.72 116.57 118.41 3i8b h LYS 158 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3i8b h LYS 158 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3i8b h LYS 158 CO 0.03 0.00 -0.31 1.63 -0.57 0.00 0.00 179.45 180.24 3i8b n LYS 159 N -2.61 0.01 -1.67 3.15 5.02 -0.87 -4.92 118.16 116.27 3i8b n LYS 159 Ca 0.02 0.00 -0.47 0.00 -2.02 0.00 0.00 58.31 55.84 3i8b n LYS 159 Cb 0.30 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 3i8b n LYS 159 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3i8b n ILE 160 N -1.52 0.61 -0.02 -0.18 5.41 -1.03 -4.24 119.36 118.39 3i8b n ILE 160 Ca 0.06 -0.12 0.04 0.00 1.00 0.00 0.00 62.75 63.72 3i8b n ILE 160 Cb 0.34 -1.98 -0.11 0.00 -0.71 0.00 0.00 39.64 37.18 3i8b n ILE 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i8b n ALA 161 N 7.02 2.31 -3.31 -1.39 0.00 0.66 -4.88 120.51 120.93 3i8b n ALA 161 Ca 0.23 -0.46 -0.14 0.00 0.00 0.00 0.00 53.44 53.06 3i8b n ALA 161 Cb 0.32 -0.37 -0.09 0.00 0.00 0.00 0.00 19.45 19.31 3i8b n ALA 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i8b s ALA 162 N -2.81 -1.03 -0.06 0.00 0.00 -0.96 -0.57 121.76 116.32 3i8b s ALA 162 Ca -0.05 0.79 0.05 0.00 0.00 0.00 0.00 51.96 52.74 3i8b s ALA 162 Cb 0.08 -0.21 -0.00 0.00 0.00 0.00 0.00 23.12 22.99 3i8b s ALA 162 CO 0.57 -0.26 -0.21 0.42 0.00 0.00 0.00 175.76 176.28 3i8b s ILE 163 N -0.77 1.80 0.23 0.00 1.01 -1.02 -1.77 121.20 120.67 3i8b s ILE 163 Ca -0.09 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 59.56 3i8b s ILE 163 Cb -0.04 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 3i8b s ILE 163 CO 0.04 0.50 0.40 0.00 0.00 0.00 0.00 174.94 175.88 3i8b s LEU 165 N -3.03 3.75 0.16 0.00 1.02 -1.26 -1.09 118.68 118.22 3i8b s LEU 165 Ca 0.24 -0.18 -0.17 0.00 0.02 0.00 0.00 54.13 54.05 3i8b s LEU 165 Cb 0.01 -2.79 0.07 0.00 0.02 0.00 0.00 46.19 43.50 3i8b s LEU 165 CO 0.08 -0.66 1.70 -0.65 0.02 0.00 0.00 176.35 176.85 3i8b h PRO 166 N 0.65 0.09 -0.25 1.29 0.11 -1.80 -0.62 132.00 131.47 3i8b h PRO 166 Ca -0.44 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 3i8b h PRO 166 Cb 1.27 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3i8b h PRO 166 CO 0.51 0.06 0.05 1.12 -0.21 0.00 0.00 178.00 179.53 3i8b h HIS 167 N 0.10 0.36 -0.17 0.65 2.07 -1.90 -1.41 115.15 114.86 3i8b h HIS 167 Ca 0.17 -0.01 -0.03 0.00 -2.85 0.00 0.00 60.37 57.65 3i8b h HIS 167 Cb 0.23 -0.11 -0.01 0.00 2.57 0.00 0.00 27.41 30.09 3i8b h HIS 167 CO -0.24 0.33 -0.00 -0.44 -3.07 0.00 0.00 177.93 174.50 3i8b h ASP 168 N 0.36 0.29 -0.30 3.10 3.32 -1.55 -2.27 116.42 119.38 3i8b h ASP 168 Ca 0.09 -0.31 -0.05 0.00 0.02 0.00 0.00 57.03 56.78 3i8b h ASP 168 Cb 0.16 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3i8b h ASP 168 CO -0.00 0.53 -0.01 -0.25 -1.72 0.00 0.00 179.24 177.79 3i8b h TRP 169 N 0.04 0.58 -0.97 4.55 7.01 -0.71 -1.64 115.95 124.80 3i8b h TRP 169 Ca 0.05 -0.10 0.01 0.00 2.11 0.00 0.00 58.89 60.95 3i8b h TRP 169 Cb 0.38 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.25 3i8b h TRP 169 CO 0.04 0.67 0.63 1.25 -2.79 0.00 0.00 178.44 178.24 3i8b h LEU 170 N 0.32 1.13 -0.57 0.65 5.85 -1.32 -1.01 115.31 120.37 3i8b h LEU 170 Ca 0.08 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 3i8b h LEU 170 Cb 0.44 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3i8b h LEU 170 CO 0.02 0.83 0.23 0.28 -0.34 0.00 0.00 178.44 179.45 3i8b h SER 171 N 1.32 0.78 -0.68 1.25 0.02 -1.13 0.27 113.55 115.38 3i8b h SER 171 Ca 0.36 -0.17 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 3i8b h SER 171 Cb -0.14 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.17 3i8b h SER 171 CO -0.07 0.73 0.44 -0.25 -1.14 0.00 0.00 176.83 176.53 3i8b h TRP 172 N 0.77 0.83 -0.60 3.45 7.01 -0.91 -0.90 115.95 125.60 3i8b h TRP 172 Ca 0.19 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.13 3i8b h TRP 172 Cb 0.19 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 26.95 3i8b h TRP 172 CO 0.01 0.50 0.06 0.00 -2.79 0.00 0.00 178.44 176.22 3i8b h ARG 173 N 0.88 1.01 -0.73 2.65 2.47 -0.87 -2.12 114.38 117.67 3i8b h ARG 173 Ca 0.26 -0.28 -0.03 0.00 -1.26 0.00 0.00 59.98 58.68 3i8b h ARG 173 Cb -0.06 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.11 3i8b h ARG 173 CO -0.07 0.95 0.35 0.82 0.56 0.00 0.00 179.97 182.58 3i8b h ILE 174 N 0.94 1.23 0.00 2.04 2.04 -0.45 0.53 117.51 123.84 3i8b h ILE 174 Ca 0.18 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.40 3i8b h ILE 174 Cb 0.46 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3i8b h ILE 174 CO 0.02 0.27 0.00 0.00 0.00 0.00 0.00 178.15 178.44 3i8b n ALA 175 N -2.43 1.53 -0.20 1.87 0.00 -0.39 -1.23 120.51 119.66 3i8b n ALA 175 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3i8b n ALA 175 Cb 0.13 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.44 3i8b n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i8b n GLY 176 N -0.57 0.80 3.94 0.00 0.00 0.18 -3.74 105.19 105.79 3i8b n GLY 176 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 3i8b n GLY 176 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i8b s TYR 177 N -2.13 2.85 -5.00 1.61 2.02 -0.82 -5.00 117.35 110.88 3i8b s TYR 177 Ca 0.00 0.37 0.00 0.00 -0.37 0.00 0.00 57.07 57.07 3i8b s TYR 177 Cb 0.00 -3.16 0.00 0.00 -0.40 0.00 0.00 41.96 38.40 3i8b s TYR 177 CO 0.00 -1.39 0.00 0.41 -1.57 0.00 0.00 175.55 173.00 3i8b n GLY 178 N -2.87 -1.90 3.64 0.71 0.00 -1.26 -4.27 105.19 99.23 3i8b n GLY 178 Ca 0.08 -1.34 -0.46 0.00 0.00 0.00 0.00 46.02 44.31 3i8b n GLY 178 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3i8b n PRO 179 N -0.55 1.70 -4.57 1.61 -0.02 -1.25 -4.76 135.00 127.16 3i8b n PRO 179 Ca 0.00 0.60 -0.26 0.00 -2.02 0.00 0.00 63.50 61.82 3i8b n PRO 179 Cb 0.00 -2.17 -0.11 0.00 -0.02 0.00 0.00 33.50 31.20 3i8b n PRO 179 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3i8b s VAL 180 N -0.31 1.77 0.75 -1.45 -7.23 0.84 -5.00 120.40 109.78 3i8b s VAL 180 Ca 0.67 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.73 3i8b s VAL 180 Cb -0.71 -2.94 0.04 0.00 0.56 0.00 0.00 36.38 33.33 3i8b s VAL 180 CO 0.53 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 176.41 3i8b s ALA 181 N -2.88 2.53 0.21 1.32 0.00 -1.26 -4.84 121.76 116.84 3i8b s ALA 181 Ca 0.35 -0.23 -0.32 0.00 0.00 0.00 0.00 51.96 51.76 3i8b s ALA 181 Cb 0.10 -3.08 -0.13 0.00 0.00 0.00 0.00 23.12 20.00 3i8b s ALA 181 CO 0.17 -1.46 1.51 -1.91 0.00 0.00 0.00 175.76 174.07 3i8b n GLU 182 N -3.24 2.16 -1.00 0.00 2.13 -1.26 -1.52 120.64 117.90 3i8b n GLU 182 Ca 0.07 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.66 3i8b n GLU 182 Cb 0.56 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.78 3i8b n GLU 182 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3i8b n GLY 183 N 2.79 0.55 3.96 8.31 0.00 -1.26 -5.03 105.19 114.51 3i8b n GLY 183 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 3i8b n GLY 183 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i8b s GLU 184 N -0.01 3.46 -0.26 1.61 2.02 -0.57 -5.07 118.70 119.88 3i8b s GLU 184 Ca 0.00 -0.60 -0.29 0.00 0.02 0.00 0.00 54.97 54.10 3i8b s GLU 184 Cb 0.00 -2.81 0.01 0.00 0.10 0.00 0.00 34.13 31.44 3i8b s GLU 184 CO 0.00 0.33 1.05 0.34 0.02 0.00 0.00 175.26 176.99 3i8b s ASP 185 N -3.99 7.05 0.21 -0.19 -1.08 -1.26 -4.90 116.67 112.50 3i8b s ASP 185 Ca 0.36 1.28 0.26 0.00 -0.52 0.00 0.00 52.55 53.93 3i8b s ASP 185 Cb -0.09 -2.54 0.82 0.00 -1.46 0.00 0.00 42.92 39.65 3i8b s ASP 185 CO 0.32 -0.73 1.77 0.00 0.52 0.00 0.00 175.17 177.05 3i8b n ALA 186 N 6.47 2.26 -3.91 3.66 0.00 -1.26 -4.92 120.51 122.81 3i8b n ALA 186 Ca 0.12 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.25 3i8b n ALA 186 Cb 0.46 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.47 3i8b n ALA 186 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3i8b n HIS 187 N -2.26 -2.13 0.21 0.00 8.25 -1.26 -4.66 115.22 113.36 3i8b n HIS 187 Ca 0.05 0.87 0.07 0.00 -0.26 0.00 0.00 57.72 58.46 3i8b n HIS 187 Cb 0.42 -3.94 0.60 0.00 1.12 0.00 0.00 29.99 28.19 3i8b n HIS 187 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3i8b h LEU 188 N -1.98 0.08 -0.26 2.41 3.38 -1.95 -1.32 115.31 115.69 3i8b h LEU 188 Ca -0.59 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.38 3i8b h LEU 188 Cb 1.37 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.10 3i8b h LEU 188 CO 0.66 0.07 0.00 -0.62 0.09 0.00 0.00 178.44 178.64 3i8b n GLU 189 N -4.52 0.04 0.05 1.13 -0.58 -1.26 -1.40 120.64 114.11 3i8b n GLU 189 Ca -0.02 0.39 0.10 0.00 -0.42 0.00 0.00 57.16 57.22 3i8b n GLU 189 Cb 0.09 -1.61 0.43 0.00 -0.57 0.00 0.00 31.44 29.78 3i8b n GLU 189 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3i8b n ALA 190 N -1.57 1.85 -1.72 0.62 0.00 -0.50 -4.83 120.51 114.36 3i8b n ALA 190 Ca 0.02 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 3i8b n ALA 190 Cb 0.12 -1.35 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 3i8b n ALA 190 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i8b n LEU 191 N -1.83 3.96 -4.12 0.00 4.77 -0.49 -4.92 117.00 114.37 3i8b n LEU 191 Ca 0.04 1.15 -0.08 0.00 -0.03 0.00 0.00 56.01 57.09 3i8b n LEU 191 Cb 0.25 -1.54 -0.10 0.00 -2.33 0.00 0.00 43.42 39.70 3i8b n LEU 191 CO 0.20 -0.07 -0.37 0.72 -1.33 0.00 0.00 177.39 176.54 3i8b s PHE 192 N -0.11 0.66 0.09 -1.77 -0.12 -1.26 -2.41 117.98 113.05 3i8b s PHE 192 Ca 0.64 -1.00 0.00 0.00 -0.05 0.00 0.00 56.93 56.53 3i8b s PHE 192 Cb -0.54 -0.43 -0.00 0.00 -0.63 0.00 0.00 43.02 41.41 3i8b s PHE 192 CO 0.50 -0.29 0.11 -2.37 -0.05 0.00 0.00 175.22 173.12 3i8b n THR 193 N 0.09 0.00 -4.69 -4.49 5.66 0.25 -4.62 114.28 106.48 3i8b n THR 193 Ca -0.14 -0.50 -0.31 0.00 -3.05 0.00 0.00 64.05 60.06 3i8b n THR 193 Cb 0.61 0.29 -0.08 0.00 -1.55 0.00 0.00 70.33 69.59 3i8b n THR 193 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3i8b s ASP 194 N -1.56 3.77 0.35 1.09 3.84 -1.25 -0.76 116.67 122.15 3i8b s ASP 194 Ca 0.08 -1.62 0.05 0.00 -0.00 0.00 0.00 52.55 51.06 3i8b s ASP 194 Cb -0.00 0.41 0.66 0.00 -1.38 0.00 0.00 42.92 42.61 3i8b s ASP 194 CO 0.06 -0.82 1.91 0.03 -0.00 0.00 0.00 175.17 176.35 3i8b h ARG 195 N 1.51 0.51 -0.13 2.11 3.08 -1.87 -2.65 114.38 116.94 3i8b h ARG 195 Ca -0.42 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 59.45 3i8b h ARG 195 Cb 1.30 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3i8b h ARG 195 CO 0.71 0.51 -0.26 0.66 -1.07 0.00 0.00 179.97 180.52 3i8b h SER 196 N 0.50 0.46 -0.24 7.04 4.64 -1.73 -2.08 113.55 122.14 3i8b h SER 196 Ca 0.11 -0.55 -0.17 0.00 -0.47 0.00 0.00 61.79 60.71 3i8b h SER 196 Cb 0.25 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3i8b h SER 196 CO 0.00 0.93 -0.50 0.44 -0.87 0.00 0.00 176.83 176.83 3i8b h ASP 197 N 0.01 0.86 -0.60 4.97 3.32 -1.87 -3.13 116.42 119.98 3i8b h ASP 197 Ca 0.01 -0.55 0.03 0.00 0.02 0.00 0.00 57.03 56.53 3i8b h ASP 197 Cb 0.85 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 3i8b h ASP 197 CO 0.06 1.24 0.40 0.00 -1.72 0.00 0.00 179.24 179.22 3i8b h ALA 198 N 0.64 1.65 0.00 3.45 0.00 -1.51 -1.28 119.26 122.20 3i8b h ALA 198 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3i8b h ALA 198 Cb 1.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3i8b h ALA 198 CO 0.11 0.29 0.00 -1.13 0.00 0.00 0.00 179.25 178.52 3i8b n SER 199 N -4.46 0.00 -1.18 0.00 3.41 -0.78 -1.99 113.62 108.61 3i8b n SER 199 Ca 0.07 0.46 0.12 0.00 -0.26 0.00 0.00 58.87 59.26 3i8b n SER 199 Cb 0.11 -0.47 0.26 0.00 -0.26 0.00 0.00 64.21 63.85 3i8b n SER 199 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i8b n GLY 200 N -0.76 1.88 0.12 5.00 0.00 -0.48 -4.34 105.19 106.60 3i8b n GLY 200 Ca 0.02 -0.73 0.04 0.00 0.00 0.00 0.00 46.02 45.34 3i8b n GLY 200 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3i8b h THR 201 N 4.22 0.44 -2.68 2.61 1.35 -1.52 -3.31 112.91 114.01 3i8b h THR 201 Ca 0.00 -1.76 -0.25 0.00 -0.55 0.00 0.00 66.41 63.85 3i8b h THR 201 Cb 0.94 2.01 -0.05 0.00 -1.73 0.00 0.00 68.15 69.31 3i8b h THR 201 CO 0.00 0.25 -0.28 2.30 -0.25 0.00 0.00 175.52 177.54 3i8b n ILE 202 N -2.94 -0.31 -1.52 6.82 -5.35 -1.26 -1.53 119.36 113.27 3i8b n ILE 202 Ca -0.04 0.00 0.06 0.00 -0.27 0.00 0.00 62.75 62.51 3i8b n ILE 202 Cb 0.73 -1.49 0.11 0.00 -1.74 0.00 0.00 39.64 37.25 3i8b n ILE 202 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3i8b n TYR 203 N -2.65 0.00 -4.11 4.28 0.18 -1.26 -4.90 117.16 108.69 3i8b n TYR 203 Ca -0.14 -0.79 -0.16 0.00 1.88 0.00 0.00 57.90 58.68 3i8b n TYR 203 Cb 0.51 -0.14 -0.15 0.00 -0.38 0.00 0.00 39.34 39.18 3i8b n TYR 203 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 3i8b s TYR 204 N -1.97 0.47 -0.32 -3.48 5.04 -1.26 -0.27 117.35 115.56 3i8b s TYR 204 Ca 0.25 -0.09 -0.03 0.00 -2.44 0.00 0.00 57.07 54.77 3i8b s TYR 204 Cb 0.24 -0.36 0.05 0.00 0.35 0.00 0.00 41.96 42.24 3i8b s TYR 204 CO -0.01 -0.06 0.04 0.34 -1.34 0.00 0.00 175.55 174.52 3i8b s ASP 205 N 0.23 4.99 0.18 4.32 2.15 0.12 -4.74 116.67 123.93 3i8b s ASP 205 Ca -0.02 -1.32 -0.11 0.00 0.43 0.00 0.00 52.55 51.53 3i8b s ASP 205 Cb -0.06 -1.75 0.09 0.00 -0.30 0.00 0.00 42.92 40.91 3i8b s ASP 205 CO -0.00 -0.30 1.74 0.00 -0.17 0.00 0.00 175.17 176.44 3i8b h ALA 206 N 8.04 0.84 -0.83 3.66 0.00 -1.85 0.23 119.26 129.34 3i8b h ALA 206 Ca -0.21 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.65 3i8b h ALA 206 Cb 1.06 -0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.52 3i8b h ALA 206 CO 0.56 0.45 0.44 0.00 0.00 0.00 0.00 179.25 180.70 3i8b h ALA 207 N 1.11 1.22 -0.02 0.00 0.00 -1.96 -2.40 119.26 117.21 3i8b h ALA 207 Ca 0.21 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3i8b h ALA 207 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3i8b h ALA 207 CO -0.02 -0.02 -0.24 -1.13 0.00 0.00 0.00 179.25 177.84 3i8b n SER 208 N -4.82 2.35 -3.85 0.00 3.41 -1.05 -4.98 113.62 104.67 3i8b n SER 208 Ca 0.15 -1.67 -0.24 0.00 -0.26 0.00 0.00 58.87 56.85 3i8b n SER 208 Cb 0.37 0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.59 3i8b n SER 208 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3i8b n ASN 209 N 0.54 -1.15 -4.07 4.04 5.15 0.75 -5.00 115.26 115.52 3i8b n ASN 209 Ca 0.11 -0.91 -0.27 0.00 -0.60 0.00 0.00 54.58 52.91 3i8b n ASN 209 Cb 0.49 -3.55 -0.17 0.00 -0.53 0.00 0.00 39.78 36.03 3i8b n ASN 209 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3i8b s GLU 210 N -6.32 2.06 0.22 1.20 0.41 -0.75 -4.97 118.70 110.54 3i8b s GLU 210 Ca 0.08 -0.53 -0.30 0.00 -0.41 0.00 0.00 54.97 53.82 3i8b s GLU 210 Cb -0.04 -1.67 -0.09 0.00 -1.78 0.00 0.00 34.13 30.55 3i8b s GLU 210 CO 0.85 0.04 1.20 0.71 -0.49 0.00 0.00 175.26 177.57 3i8b s TYR 211 N 0.66 3.40 -1.06 1.61 2.02 -1.26 0.15 117.35 122.87 3i8b s TYR 211 Ca -0.14 1.46 -0.11 0.00 -0.37 0.00 0.00 57.07 57.91 3i8b s TYR 211 Cb -0.16 -3.44 0.26 0.00 -0.40 0.00 0.00 41.96 38.21 3i8b s TYR 211 CO 0.04 -1.20 1.07 1.03 -1.57 0.00 0.00 175.55 174.92 3i8b s ARG 212 N -0.61 4.07 0.57 -0.62 1.81 0.63 -4.87 118.95 119.94 3i8b s ARG 212 Ca 0.51 -3.01 0.36 0.00 -1.72 0.00 0.00 55.73 51.87 3i8b s ARG 212 Cb -0.34 -4.57 1.63 0.00 -0.45 0.00 0.00 34.95 31.22 3i8b s ARG 212 CO 0.39 -1.30 2.08 0.00 -0.68 0.00 0.00 175.30 175.80 3i8b h ARG 213 N 6.95 0.00 -0.11 3.54 3.08 -1.92 -1.85 114.38 124.08 3i8b h ARG 213 Ca 0.17 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.15 3i8b h ARG 213 Cb 0.91 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 3i8b h ARG 213 CO 0.98 0.02 -0.27 0.38 -1.07 0.00 0.00 179.97 180.01 3i8b h ASP 214 N 0.00 0.20 0.89 7.04 2.03 -1.94 -1.05 116.42 123.59 3i8b h ASP 214 Ca -0.00 -0.06 -0.12 0.00 -0.73 0.00 0.00 57.03 56.12 3i8b h ASP 214 Cb 0.38 -0.05 -0.02 0.00 -0.83 0.00 0.00 39.33 38.81 3i8b h ASP 214 CO 0.00 0.47 -0.59 -0.07 -1.03 0.00 0.00 179.24 178.02 3i8b h LEU 215 N 0.18 0.00 0.08 0.15 3.38 -1.73 -3.16 115.31 114.22 3i8b h LEU 215 Ca 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3i8b h LEU 215 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3i8b h LEU 215 CO 0.04 0.59 -0.04 0.40 0.09 0.00 0.00 178.44 179.53 3i8b h ILE 216 N 0.00 1.18 0.00 1.22 2.04 -1.45 -3.19 117.51 117.30 3i8b h ILE 216 Ca -0.01 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.69 3i8b h ILE 216 Cb 1.20 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.18 3i8b h ILE 216 CO 0.08 0.27 0.00 0.00 0.00 0.00 0.00 178.15 178.50 3i8b n ALA 217 N -2.44 0.62 0.00 1.87 0.00 -0.42 -1.95 120.51 118.19 3i8b n ALA 217 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3i8b n ALA 217 Cb 0.27 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.07 3i8b n ALA 217 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3i8b n VAL 219 N 1.12 0.00 0.23 0.00 0.24 -1.21 -1.66 118.33 117.05 3i8b n VAL 219 Ca 0.00 0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.42 3i8b n VAL 219 Cb 0.00 0.00 0.35 0.00 -1.47 0.00 0.00 33.84 32.72 3i8b n VAL 219 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3i8b h LEU 220 N 0.00 0.00 -1.23 1.34 3.38 -1.71 -3.32 115.31 113.77 3i8b h LEU 220 Ca 0.00 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.10 3i8b h LEU 220 Cb 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.68 3i8b h LEU 220 CO 0.00 0.10 0.58 -0.08 0.09 0.00 0.00 178.44 179.13 3i8b h GLU 221 N 0.00 0.75 -0.77 1.13 4.81 -1.57 -1.07 114.58 117.86 3i8b h GLU 221 Ca -0.00 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.27 3i8b h GLU 221 Cb 0.87 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.02 3i8b h GLU 221 CO 0.01 0.50 0.51 0.00 -0.73 0.00 0.00 179.01 179.30 3i8b h ALA 222 N 1.58 1.73 0.00 2.92 0.00 -1.88 -1.24 119.26 122.37 3i8b h ALA 222 Ca 0.45 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.13 3i8b h ALA 222 Cb 0.62 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3i8b h ALA 222 CO -0.21 0.13 -1.70 0.00 0.00 0.00 0.00 179.25 177.47 3i8b n ALA 223 N -2.44 1.87 0.00 0.00 0.00 -0.49 -4.74 120.51 114.70 3i8b n ALA 223 Ca 0.12 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.83 3i8b n ALA 223 Cb 0.28 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.96 3i8b n ALA 223 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3i8b n GLU 224 N -2.82 2.40 0.00 0.00 1.02 -0.71 -5.07 120.64 115.45 3i8b n GLU 224 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 3i8b n GLU 224 Cb 0.91 -0.82 0.00 0.00 -0.02 0.00 0.00 31.44 31.51 3i8b n GLU 224 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i8b n GLY 225 N 1.93 -0.33 0.32 0.62 0.00 -0.49 -4.49 105.19 102.75 3i8b n GLY 225 Ca 0.00 -1.61 -0.17 0.00 0.00 0.00 0.00 46.02 44.25 3i8b n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b h ALA 226 N 0.00 -0.76 -0.50 4.61 0.00 -1.94 -0.29 119.26 120.37 3i8b h ALA 226 Ca 0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 3i8b h ALA 226 Cb 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3i8b h ALA 226 CO 0.00 -0.91 -0.17 0.87 0.00 0.00 0.00 179.25 179.05 3i8b h LYS 227 N -0.80 0.99 -0.81 0.00 1.79 -1.99 -0.47 116.57 115.28 3i8b h LYS 227 Ca -0.08 -0.39 -0.03 0.00 -2.18 0.00 0.00 60.65 57.97 3i8b h LYS 227 Cb 0.60 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.17 3i8b h LYS 227 CO 0.13 1.07 0.38 0.00 -1.08 0.00 0.00 179.45 179.95 3i8b h ALA 228 N 0.93 1.15 -0.58 3.86 0.00 -1.78 -0.74 119.26 122.10 3i8b h ALA 228 Ca 0.12 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3i8b h ALA 228 Cb 0.73 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3i8b h ALA 228 CO 0.06 0.64 0.12 0.00 0.00 0.00 0.00 179.25 180.07 3i8b h ALA 229 N 1.26 0.77 -0.46 0.00 0.00 -0.70 -0.22 119.26 119.91 3i8b h ALA 229 Ca 0.28 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3i8b h ALA 229 Cb 0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3i8b h ALA 229 CO -0.03 0.49 0.26 0.37 0.00 0.00 0.00 179.25 180.34 3i8b h GLN 230 N 0.85 0.51 -0.37 0.00 4.15 -0.77 -0.99 115.11 118.48 3i8b h GLN 230 Ca 0.18 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 3i8b h GLN 230 Cb 0.38 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.94 3i8b h GLN 230 CO 0.01 0.34 0.16 0.77 -1.93 0.00 0.00 178.83 178.17 3i8b h SER 231 N 0.53 0.51 0.03 -0.69 0.02 -0.72 -2.39 113.55 110.83 3i8b h SER 231 Ca 0.19 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3i8b h SER 231 Cb 0.03 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 3i8b h SER 231 CO -0.09 0.52 -0.06 -0.74 -1.14 0.00 0.00 176.83 175.32 3i8b h HIS 232 N 0.46 -0.15 -0.02 3.45 -0.00 -0.87 -1.28 115.15 116.73 3i8b h HIS 232 Ca 0.13 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.47 3i8b h HIS 232 Cb 0.16 0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.63 3i8b h HIS 232 CO -0.01 -0.10 -0.12 0.00 -0.00 0.00 0.00 177.93 177.71 3i8b h ALA 233 N 0.84 1.76 -0.25 5.26 0.00 -1.07 0.13 119.26 125.93 3i8b h ALA 233 Ca 0.01 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 3i8b h ALA 233 Cb 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3i8b h ALA 233 CO -0.04 0.18 -0.53 0.93 0.00 0.00 0.00 179.25 179.79 3i8b h GLU 234 N 0.04 0.74 0.00 0.00 4.39 -1.19 -3.29 114.58 115.27 3i8b h GLU 234 Ca 0.01 -0.46 -0.04 0.00 0.34 0.00 0.00 59.36 59.20 3i8b h GLU 234 Cb 0.24 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3i8b h GLU 234 CO 0.02 1.09 -0.20 0.00 -1.16 0.00 0.00 179.01 178.76 3i8b h ALA 235 N 0.82 0.91 -2.73 3.43 0.00 0.18 -3.46 119.26 118.41 3i8b h ALA 235 Ca 0.02 -0.18 -0.53 0.00 0.00 0.00 0.00 54.91 54.22 3i8b h ALA 235 Cb 1.11 -0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.93 3i8b h ALA 235 CO 0.11 0.25 0.75 0.42 0.00 0.00 0.00 179.25 180.78 3i8b s ILE 236 N -3.28 2.73 -0.09 0.00 1.01 -0.51 -4.98 121.20 116.08 3i8b s ILE 236 Ca 0.04 0.60 -0.26 0.00 0.00 0.00 0.00 60.65 61.03 3i8b s ILE 236 Cb 0.07 -3.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 3i8b s ILE 236 CO 0.67 0.09 0.82 -0.69 0.00 0.00 0.00 174.94 175.83 3i8b s VAL 237 N 0.09 4.94 0.07 2.92 1.01 0.27 -4.97 120.40 124.74 3i8b s VAL 237 Ca 0.60 1.67 0.08 0.00 0.00 0.00 0.00 61.98 64.33 3i8b s VAL 237 Cb -0.41 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 31.79 3i8b s VAL 237 CO 0.42 0.15 -0.20 -0.76 0.00 0.00 0.00 175.10 174.70 3i8b s LEU 238 N 1.33 2.54 0.33 3.92 1.43 -1.26 -2.44 118.68 124.52 3i8b s LEU 238 Ca 0.41 -0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 52.71 3i8b s LEU 238 Cb -0.18 -1.46 -0.10 0.00 0.03 0.00 0.00 46.19 44.47 3i8b s LEU 238 CO 0.18 0.23 1.38 -2.84 0.23 0.00 0.00 176.35 175.53 3i8b s PRO 239 N -1.66 4.28 0.11 1.29 0.02 -1.26 -4.92 135.00 132.85 3i8b s PRO 239 Ca 0.15 2.32 -0.31 0.00 0.02 0.00 0.00 61.00 63.18 3i8b s PRO 239 Cb -0.10 -3.05 -0.10 0.00 0.02 0.00 0.00 34.50 31.26 3i8b s PRO 239 CO 0.06 -0.32 1.82 0.99 -0.33 0.00 0.00 177.00 179.23 3i8b s THR 240 N -0.92 2.62 -0.42 0.99 2.01 -1.01 -4.55 115.64 114.36 3i8b s THR 240 Ca 0.52 0.09 -0.26 0.00 0.31 0.00 0.00 61.69 62.34 3i8b s THR 240 Cb -0.42 -3.06 0.02 0.00 0.01 0.00 0.00 72.50 69.06 3i8b s THR 240 CO 0.54 -0.00 0.96 -0.69 -0.69 0.00 0.00 174.62 174.73 3i8b s VAL 241 N 2.87 4.49 0.34 3.82 1.01 -1.26 -0.58 120.40 131.08 3i8b s VAL 241 Ca 0.81 1.04 -0.10 0.00 0.00 0.00 0.00 61.98 63.73 3i8b s VAL 241 Cb -0.45 -4.41 -0.07 0.00 0.00 0.00 0.00 36.38 31.45 3i8b s VAL 241 CO 0.36 -0.71 0.68 -0.76 0.00 0.00 0.00 175.10 174.67 3i8b s LEU 242 N 3.72 3.97 0.84 3.92 1.43 0.06 -4.95 118.68 127.68 3i8b s LEU 242 Ca 0.39 1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 54.42 3i8b s LEU 242 Cb -0.11 -3.87 0.10 0.00 0.03 0.00 0.00 46.19 42.34 3i8b s LEU 242 CO 0.23 -0.27 1.11 -0.83 0.23 0.00 0.00 176.35 176.82 3i8b s GLY 243 N -2.87 1.67 0.51 -3.19 0.00 -1.26 -3.94 107.32 98.24 3i8b s GLY 243 Ca 0.50 0.31 0.25 0.00 0.00 0.00 0.00 44.72 45.78 3i8b s GLY 243 CO 0.27 0.71 1.95 -0.56 0.00 0.00 0.00 173.10 175.46 3i8b h PRO 244 N -1.44 0.09 0.00 2.90 0.13 -1.94 -2.63 132.00 129.11 3i8b h PRO 244 Ca -0.45 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 3i8b h PRO 244 Cb 1.25 -0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.27 3i8b h PRO 244 CO 0.49 0.06 -0.54 2.89 -0.23 0.00 0.00 178.00 180.67 3i8b n ARG 245 N -4.38 0.99 -3.21 0.86 1.85 -1.26 -4.81 116.66 106.71 3i8b n ARG 245 Ca 0.13 -2.63 -0.39 0.00 -1.00 0.00 0.00 57.85 53.96 3i8b n ARG 245 Cb 0.69 -1.09 -0.06 0.00 -1.05 0.00 0.00 32.46 30.95 3i8b n ARG 245 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3i8b s ASP 246 N -2.65 7.01 0.40 2.89 1.01 -0.99 -4.64 116.67 119.69 3i8b s ASP 246 Ca 0.32 1.20 -0.24 0.00 0.71 0.00 0.00 52.55 54.54 3i8b s ASP 246 Cb 0.32 -2.37 -0.09 0.00 1.01 0.00 0.00 42.92 41.80 3i8b s ASP 246 CO -0.07 0.14 1.08 0.00 0.21 0.00 0.00 175.17 176.53 3i8b s ALA 247 N -0.41 3.10 0.78 5.23 0.00 -1.26 -4.03 121.76 125.17 3i8b s ALA 247 Ca 0.31 0.78 -0.12 0.00 0.00 0.00 0.00 51.96 52.92 3i8b s ALA 247 Cb -0.19 -3.30 0.06 0.00 0.00 0.00 0.00 23.12 19.69 3i8b s ALA 247 CO 0.18 -0.30 1.14 0.00 0.00 0.00 0.00 175.76 176.77 3i8b s ALA 248 N -1.58 2.07 0.13 0.00 0.00 0.76 -4.91 121.76 118.23 3i8b s ALA 248 Ca 0.57 0.56 0.34 0.00 0.00 0.00 0.00 51.96 53.43 3i8b s ALA 248 Cb -0.25 -3.38 1.59 0.00 0.00 0.00 0.00 23.12 21.09 3i8b s ALA 248 CO 0.31 -1.95 2.02 -1.35 0.00 0.00 0.00 175.76 174.79 3i8b h PRO 249 N -0.88 0.00 -6.77 0.00 0.11 -1.94 -3.43 132.00 119.09 3i8b h PRO 249 Ca -0.45 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 64.98 3i8b h PRO 249 Cb 1.26 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.16 3i8b h PRO 249 CO 0.49 0.00 -0.83 0.14 -0.21 0.00 0.00 178.00 177.59 3i8b s VAL 250 N -3.74 2.62 0.45 3.15 -7.23 -1.26 -5.13 120.40 109.27 3i8b s VAL 250 Ca -0.00 -1.55 0.07 0.00 -1.81 0.00 0.00 61.98 58.69 3i8b s VAL 250 Cb 0.10 -2.17 0.02 0.00 0.56 0.00 0.00 36.38 34.89 3i8b s VAL 250 CO 0.44 0.13 0.62 -0.54 -0.31 0.00 0.00 175.10 175.44 3i8b s LYS 251 N -2.00 2.74 0.51 4.82 1.02 -1.26 -4.03 119.74 121.54 3i8b s LYS 251 Ca 0.16 -1.20 -0.23 0.00 0.02 0.00 0.00 55.97 54.72 3i8b s LYS 251 Cb -0.10 -2.71 -0.06 0.00 -0.52 0.00 0.00 37.83 34.43 3i8b s LYS 251 CO 0.08 -0.39 1.40 0.00 -0.92 0.00 0.00 175.35 175.53 3i8b s ALA 252 N -2.44 3.00 0.28 5.17 0.00 0.57 -4.43 121.76 123.92 3i8b s ALA 252 Ca 0.56 1.42 -0.30 0.00 0.00 0.00 0.00 51.96 53.64 3i8b s ALA 252 Cb -0.10 -3.59 -0.12 0.00 0.00 0.00 0.00 23.12 19.32 3i8b s ALA 252 CO 0.34 -1.34 1.63 0.34 0.00 0.00 0.00 175.76 176.73 3i8b s ASP 253 N -0.73 6.36 0.58 0.00 2.15 -0.36 -4.68 116.67 119.99 3i8b s ASP 253 Ca 0.67 2.95 0.33 0.00 0.43 0.00 0.00 52.55 56.94 3i8b s ASP 253 Cb -0.43 -2.63 1.79 0.00 -0.30 0.00 0.00 42.92 41.35 3i8b s ASP 253 CO 0.52 -0.94 2.19 -0.65 -0.17 0.00 0.00 175.17 176.12 3i8b h PRO 254 N 5.20 0.00 0.00 4.34 0.11 -1.90 0.16 132.00 139.91 3i8b h PRO 254 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 3i8b h PRO 254 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3i8b h PRO 254 CO 0.83 0.05 -0.09 0.00 -0.21 0.00 0.00 178.00 178.57 3i8b h ALA 255 N 1.95 1.04 0.01 -0.75 0.00 -1.96 -3.32 119.26 116.22 3i8b h ALA 255 Ca -0.00 -0.09 -0.40 0.00 0.00 0.00 0.00 54.91 54.42 3i8b h ALA 255 Cb 0.19 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3i8b h ALA 255 CO 0.01 0.12 -2.24 -0.89 0.00 0.00 0.00 179.25 176.24 3i8b n ILE 256 N -3.25 1.54 -3.80 0.00 5.41 0.45 -5.05 119.36 114.65 3i8b n ILE 256 Ca 0.00 -0.34 -0.11 0.00 1.00 0.00 0.00 62.75 63.31 3i8b n ILE 256 Cb 0.34 -1.86 -0.08 0.00 -0.71 0.00 0.00 39.64 37.33 3i8b n ILE 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i8b s ALA 257 N -2.48 -0.49 0.00 -1.39 0.00 -0.53 -4.26 121.76 112.61 3i8b s ALA 257 Ca -0.36 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3i8b s ALA 257 Cb 0.12 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.59 3i8b s ALA 257 CO 0.54 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.29 3i8b n GLY 258 N 0.48 0.59 0.28 0.00 0.00 -0.32 -4.06 105.19 102.16 3i8b n GLY 258 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 3i8b n GLY 258 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3i8b h LYS 259 N 1.52 0.00 -0.46 1.61 2.10 -1.68 -2.55 116.57 117.11 3i8b h LYS 259 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.59 3i8b h LYS 259 Cb 0.10 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.39 3i8b h LYS 259 CO 0.00 0.02 0.05 0.09 -2.00 0.00 0.00 179.45 177.62 3i8b n ASN 260 N -3.96 4.53 -4.27 7.07 3.02 -0.41 -4.97 115.26 116.28 3i8b n ASN 260 Ca -0.03 -3.10 -0.21 0.00 -0.03 0.00 0.00 54.58 51.21 3i8b n ASN 260 Cb 0.11 -0.64 -0.12 0.00 -0.61 0.00 0.00 39.78 38.52 3i8b n ASN 260 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3i8b s VAL 261 N -2.89 1.56 -0.10 2.41 -7.23 -0.96 -4.84 120.40 108.34 3i8b s VAL 261 Ca 0.49 -1.67 -0.31 0.00 -1.81 0.00 0.00 61.98 58.68 3i8b s VAL 261 Cb 0.39 -1.57 -0.09 0.00 0.56 0.00 0.00 36.38 35.67 3i8b s VAL 261 CO 0.11 -0.26 2.05 -0.62 -0.31 0.00 0.00 175.10 176.07 3i8b n GLU 262 N 0.72 2.27 -0.62 4.82 -0.58 -1.26 -2.00 120.64 123.98 3i8b n GLU 262 Ca -0.17 0.77 0.00 0.00 -0.42 0.00 0.00 57.16 57.34 3i8b n GLU 262 Cb 0.56 -2.94 0.00 0.00 -0.57 0.00 0.00 31.44 28.49 3i8b n GLU 262 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3i8b n GLY 263 N 5.06 0.76 7.00 0.62 0.00 -1.26 -4.92 105.19 112.45 3i8b n GLY 263 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3i8b n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i8b n GLY 264 N -2.25 0.26 3.24 -0.02 0.00 -0.85 -4.67 105.19 100.91 3i8b n GLY 264 Ca 0.00 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.71 3i8b n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b s LEU 266 N 1.36 2.88 -0.17 0.00 0.05 -0.74 -0.31 118.68 121.75 3i8b s LEU 266 Ca -0.02 1.58 -0.02 0.00 0.05 0.00 0.00 54.13 55.72 3i8b s LEU 266 Cb -0.19 -4.30 -0.01 0.00 -2.05 0.00 0.00 46.19 39.63 3i8b s LEU 266 CO 0.01 -1.86 -0.09 -0.76 -0.55 0.00 0.00 176.35 173.11 3i8b s LEU 267 N -5.78 2.83 0.69 1.48 1.43 -1.26 -1.64 118.68 116.43 3i8b s LEU 267 Ca 0.60 -0.34 -0.09 0.00 -1.03 0.00 0.00 54.13 53.27 3i8b s LEU 267 Cb -0.15 -1.68 0.04 0.00 0.03 0.00 0.00 46.19 44.43 3i8b s LEU 267 CO 0.55 0.09 1.04 0.00 0.23 0.00 0.00 176.35 178.26 3i8b s ALA 268 N 0.82 3.03 0.45 4.21 0.00 -0.21 -0.17 121.76 129.88 3i8b s ALA 268 Ca -0.03 -0.64 0.31 0.00 0.00 0.00 0.00 51.96 51.61 3i8b s ALA 268 Cb -0.15 -2.79 1.66 0.00 0.00 0.00 0.00 23.12 21.84 3i8b s ALA 268 CO 0.01 -1.18 2.14 -1.35 0.00 0.00 0.00 175.76 175.38 3i8b h PRO 269 N -0.58 0.00 0.00 0.00 0.11 -1.87 -3.44 132.00 126.22 3i8b h PRO 269 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3i8b h PRO 269 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3i8b h PRO 269 CO 0.63 0.07 0.00 0.41 -0.21 0.00 0.00 178.00 178.90 3i8b n GLY 270 N -0.78 -1.68 0.00 -0.55 0.00 -1.26 -3.92 105.19 97.00 3i8b n GLY 270 Ca -0.02 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3i8b n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i8b n GLY 271 N 0.00 -0.34 3.82 -0.02 0.00 -0.65 -4.57 105.19 103.44 3i8b n GLY 271 Ca 0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.67 3i8b n GLY 271 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i8b s GLY 272 N 0.00 2.14 0.12 -0.02 0.00 -1.26 -0.55 107.32 107.75 3i8b s GLY 272 Ca 0.00 0.30 -0.20 0.00 0.00 0.00 0.00 44.72 44.82 3i8b s GLY 272 CO 0.00 0.59 1.76 1.29 0.00 0.00 0.00 173.10 176.75 3i8b h ASP 273 N 0.87 0.14 -0.39 1.64 3.04 -0.99 -2.92 116.42 117.83 3i8b h ASP 273 Ca -0.47 0.00 0.08 0.00 -3.24 0.00 0.00 57.03 53.40 3i8b h ASP 273 Cb 1.20 -0.03 -0.07 0.00 -1.04 0.00 0.00 39.33 39.39 3i8b h ASP 273 CO 0.60 0.11 -0.08 0.78 -2.04 0.00 0.00 179.24 178.61 3i8b h ASN 274 N 0.19 -0.32 0.00 4.15 -0.26 -1.94 0.13 115.58 117.53 3i8b h ASN 274 Ca 0.06 0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.92 3i8b h ASN 274 Cb -0.00 0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 3i8b h ASN 274 CO -0.03 -0.11 0.00 0.00 -1.06 0.00 0.00 177.43 176.22 3i8b n ALA 275 N -2.66 1.94 0.00 -0.83 0.00 -1.10 -2.11 120.51 115.75 3i8b n ALA 275 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3i8b n ALA 275 Cb 0.21 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3i8b n ALA 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i8b n ALA 277 N 0.84 0.00 -0.21 0.00 0.00 0.03 -1.75 120.51 119.42 3i8b n ALA 277 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3i8b n ALA 277 Cb 0.21 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.69 3i8b n ALA 277 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3i8b h SER 278 N 0.00 0.73 -0.30 0.00 0.02 -1.66 0.11 113.55 112.45 3i8b h SER 278 Ca 0.00 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3i8b h SER 278 Cb 0.00 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 3i8b h SER 278 CO 0.00 0.59 0.18 0.25 -1.14 0.00 0.00 176.83 176.71 3i8b h LEU 279 N 0.82 0.30 -1.86 5.07 5.85 -1.63 -2.58 115.31 121.28 3i8b h LEU 279 Ca 0.22 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 3i8b h LEU 279 Cb -0.00 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 3i8b h LEU 279 CO -0.04 0.22 -0.11 1.23 -0.34 0.00 0.00 178.44 179.41 3i8b h GLY 280 N 0.37 0.00 0.71 3.75 0.00 -1.54 0.44 103.07 106.80 3i8b h GLY 280 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3i8b h GLY 280 CO -0.04 0.00 -0.04 1.04 0.00 0.00 0.00 176.54 177.50 3i8b n LEU 281 N -4.26 0.48 -1.36 3.11 4.77 0.31 -4.70 117.00 115.36 3i8b n LEU 281 Ca -0.03 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 3i8b n LEU 281 Cb 0.18 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3i8b n LEU 281 CO 0.34 0.08 -0.18 0.61 -1.33 0.00 0.00 177.39 176.92 3i8b n GLY 282 N 1.16 -4.05 3.98 -0.72 0.00 0.14 -5.05 105.19 100.66 3i8b n GLY 282 Ca 0.19 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.81 3i8b n GLY 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b s ALA 284 N -0.21 -2.39 -0.06 4.61 0.00 -1.26 -5.01 121.76 117.43 3i8b s ALA 284 Ca 0.00 -0.01 -0.36 0.00 0.00 0.00 0.00 51.96 51.59 3i8b s ALA 284 Cb 0.00 0.89 -0.14 0.00 0.00 0.00 0.00 23.12 23.87 3i8b s ALA 284 CO 0.00 -1.14 1.68 0.28 0.00 0.00 0.00 175.76 176.58 3i8b n VAL 285 N -0.89 0.28 0.00 0.00 0.31 -1.26 -1.42 118.33 115.35 3i8b n VAL 285 Ca 0.03 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3i8b n VAL 285 Cb 0.59 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 3i8b n VAL 285 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i8b n GLY 286 N 3.79 2.44 3.78 2.92 0.00 -0.37 -4.98 105.19 112.77 3i8b n GLY 286 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 3i8b n GLY 286 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i8b s ASP 287 N -1.52 7.37 0.07 1.61 1.01 -0.51 0.03 116.67 124.74 3i8b s ASP 287 Ca 0.00 1.68 0.08 0.00 0.71 0.00 0.00 52.55 55.02 3i8b s ASP 287 Cb 0.00 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 3i8b s ASP 287 CO 0.00 0.13 -0.20 0.54 0.21 0.00 0.00 175.17 175.85 3i8b s VAL 288 N -1.29 1.64 -0.04 -1.27 0.11 -0.56 -1.29 120.40 117.71 3i8b s VAL 288 Ca 0.40 -1.36 0.04 0.00 -2.93 0.00 0.00 61.98 58.14 3i8b s VAL 288 Cb -0.22 -1.47 -0.03 0.00 -1.53 0.00 0.00 36.38 33.14 3i8b s VAL 288 CO 0.26 0.06 -0.16 -0.94 -3.33 0.00 0.00 175.10 170.99 3i8b s SER 289 N -1.54 3.91 -0.30 3.54 1.04 0.48 -0.75 113.70 120.08 3i8b s SER 289 Ca 0.06 -0.24 -0.03 0.00 0.48 0.00 0.00 55.95 56.22 3i8b s SER 289 Cb -0.09 -0.77 0.04 0.00 0.10 0.00 0.00 66.02 65.29 3i8b s SER 289 CO 0.03 0.34 0.03 -0.63 0.98 0.00 0.00 173.24 173.98 3i8b s ILE 290 N -0.74 3.28 -0.38 -1.02 1.01 0.64 -1.24 121.20 122.77 3i8b s ILE 290 Ca 0.12 -1.20 -0.16 0.00 0.00 0.00 0.00 60.65 59.40 3i8b s ILE 290 Cb -0.11 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.54 3i8b s ILE 290 CO 0.01 -0.06 0.42 -0.55 0.00 0.00 0.00 174.94 174.75 3i8b s SER 291 N 1.33 6.20 -0.61 3.58 0.15 0.19 -1.10 113.70 123.44 3i8b s SER 291 Ca -0.03 -0.39 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 3i8b s SER 291 Cb -0.19 -2.22 0.16 0.00 -1.71 0.00 0.00 66.02 62.06 3i8b s SER 291 CO -0.00 -0.46 0.43 -0.22 1.20 0.00 0.00 173.24 174.19 3i8b s LEU 292 N 2.12 5.34 0.00 3.45 2.96 -0.74 -1.16 118.68 130.66 3i8b s LEU 292 Ca 0.13 -2.72 0.00 0.00 -0.22 0.00 0.00 54.13 51.32 3i8b s LEU 292 Cb -0.17 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.65 3i8b s LEU 292 CO 0.13 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 3i8b n GLY 293 N 3.68 1.99 0.37 7.98 0.00 -1.26 0.67 105.19 118.63 3i8b n GLY 293 Ca 0.06 -1.96 0.13 0.00 0.00 0.00 0.00 46.02 44.26 3i8b n GLY 293 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3i8b h THR 294 N 0.00 0.83 -1.67 2.61 1.35 -1.92 0.97 112.91 115.08 3i8b h THR 294 Ca 0.00 -0.21 -0.55 0.00 -0.55 0.00 0.00 66.41 65.10 3i8b h THR 294 Cb 0.00 0.18 -0.08 0.00 -1.73 0.00 0.00 68.15 66.52 3i8b h THR 294 CO 0.00 0.11 -0.50 -0.94 -0.25 0.00 0.00 175.52 173.94 3i8b s SER 295 N -5.85 4.56 0.18 5.36 1.04 -1.26 -0.31 113.70 117.42 3i8b s SER 295 Ca -0.09 -0.96 0.11 0.00 0.48 0.00 0.00 55.95 55.49 3i8b s SER 295 Cb 0.22 -0.55 -0.04 0.00 0.10 0.00 0.00 66.02 65.74 3i8b s SER 295 CO 0.78 -0.48 -0.20 -0.83 0.98 0.00 0.00 173.24 173.48 3i8b s GLY 296 N -3.91 1.71 -0.14 7.32 0.00 -0.10 -4.55 107.32 107.65 3i8b s GLY 296 Ca 0.41 -1.58 -0.03 0.00 0.00 0.00 0.00 44.72 43.53 3i8b s GLY 296 CO 0.23 -1.60 0.03 0.14 0.00 0.00 0.00 173.10 171.91 3i8b s VAL 297 N -1.62 0.36 -0.34 1.40 1.01 -0.31 -0.73 120.40 120.17 3i8b s VAL 297 Ca 0.21 -0.22 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 3i8b s VAL 297 Cb -0.08 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 3i8b s VAL 297 CO 0.11 -0.04 0.22 0.00 0.00 0.00 0.00 175.10 175.39 3i8b s ALA 298 N 1.95 3.42 -0.13 5.51 0.00 -0.00 -0.64 121.76 131.86 3i8b s ALA 298 Ca 0.02 -1.46 0.01 0.00 0.00 0.00 0.00 51.96 50.53 3i8b s ALA 298 Cb -0.15 -2.61 0.02 0.00 0.00 0.00 0.00 23.12 20.37 3i8b s ALA 298 CO -0.07 -1.06 -0.16 0.00 0.00 0.00 0.00 175.76 174.47 3i8b s ALA 299 N 1.67 1.88 0.14 0.00 0.00 -0.37 -0.29 121.76 124.78 3i8b s ALA 299 Ca 0.05 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.22 3i8b s ALA 299 Cb -0.18 -0.96 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 3i8b s ALA 299 CO 0.09 -0.21 -0.16 0.00 0.00 0.00 0.00 175.76 175.48 3i8b s ALA 300 N 1.18 2.74 -0.21 0.00 0.00 -0.93 -0.39 121.76 124.15 3i8b s ALA 300 Ca -0.01 -1.40 -0.16 0.00 0.00 0.00 0.00 51.96 50.39 3i8b s ALA 300 Cb -0.14 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 3i8b s ALA 300 CO -0.06 0.56 0.43 0.42 0.00 0.00 0.00 175.76 177.10 3i8b s ILE 301 N -1.30 5.17 -0.10 0.00 1.01 -0.41 -3.06 121.20 122.51 3i8b s ILE 301 Ca 0.20 0.75 0.03 0.00 0.00 0.00 0.00 60.65 61.63 3i8b s ILE 301 Cb -0.10 -3.75 -0.01 0.00 0.01 0.00 0.00 42.46 38.61 3i8b s ILE 301 CO 0.11 0.22 -0.19 -0.55 0.00 0.00 0.00 174.94 174.54 3i8b s SER 302 N 1.14 3.57 0.20 3.58 0.15 0.16 -1.24 113.70 121.26 3i8b s SER 302 Ca 0.20 -0.42 -0.11 0.00 0.70 0.00 0.00 55.95 56.32 3i8b s SER 302 Cb -0.15 -1.34 0.14 0.00 -1.71 0.00 0.00 66.02 62.97 3i8b s SER 302 CO 0.08 0.20 1.85 -0.08 1.20 0.00 0.00 173.24 176.49 3i8b h GLU 303 N 6.45 0.80 -6.16 5.44 4.57 -1.94 -0.41 114.58 123.33 3i8b h GLU 303 Ca -0.27 -0.05 -0.55 0.00 -1.18 0.00 0.00 59.36 57.31 3i8b h GLU 303 Cb 1.21 -0.18 -0.09 0.00 -0.16 0.00 0.00 28.75 29.53 3i8b h GLU 303 CO 0.51 0.53 -0.61 -0.80 -1.18 0.00 0.00 179.01 177.46 3i8b s ASN 304 N -5.73 4.58 0.68 1.04 0.02 -1.26 -4.59 114.94 109.67 3i8b s ASN 304 Ca -0.13 -0.70 -0.17 0.00 -1.02 0.00 0.00 52.86 50.85 3i8b s ASN 304 Cb 0.14 -0.81 -0.02 0.00 0.02 0.00 0.00 41.25 40.59 3i8b s ASN 304 CO 0.76 -0.10 0.89 -2.65 0.02 0.00 0.00 177.10 176.02 3i8b n PRO 305 N -0.98 0.60 -4.80 -0.60 -0.02 -1.26 -4.73 135.00 123.21 3i8b n PRO 305 Ca -0.05 0.25 -0.25 0.00 -2.02 0.00 0.00 63.50 61.43 3i8b n PRO 305 Cb 0.60 -2.13 -0.16 0.00 -0.02 0.00 0.00 33.50 31.79 3i8b n PRO 305 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3i8b s THR 306 N -1.72 1.35 -0.38 3.45 -4.23 -1.26 -5.01 115.64 107.83 3i8b s THR 306 Ca 0.73 -0.71 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 3i8b s THR 306 Cb -0.37 -1.14 0.13 0.00 1.34 0.00 0.00 72.50 72.46 3i8b s THR 306 CO 0.50 0.39 0.20 -0.31 -0.54 0.00 0.00 174.62 174.85 3i8b s TYR 307 N -0.24 1.44 -0.90 3.99 2.02 -1.26 -4.61 117.35 117.80 3i8b s TYR 307 Ca 0.03 -1.96 -0.22 0.00 -0.37 0.00 0.00 57.07 54.55 3i8b s TYR 307 Cb -0.08 -1.50 0.07 0.00 -0.40 0.00 0.00 41.96 40.05 3i8b s TYR 307 CO 0.00 -0.82 1.26 0.34 -1.57 0.00 0.00 175.55 174.76 3i8b s ASP 308 N 0.92 6.44 0.37 2.29 2.15 -1.26 -4.85 116.67 122.73 3i8b s ASP 308 Ca 0.16 -1.42 0.22 0.00 0.43 0.00 0.00 52.55 51.94 3i8b s ASP 308 Cb -0.22 -2.49 1.18 0.00 -0.30 0.00 0.00 42.92 41.08 3i8b s ASP 308 CO -0.06 -1.41 1.63 -0.07 -0.17 0.00 0.00 175.17 175.08 3i8b h LEU 309 N 11.90 0.00 -0.71 -1.34 3.38 -1.93 0.27 115.31 126.87 3i8b h LEU 309 Ca 0.05 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 3i8b h LEU 309 Cb 1.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 3i8b h LEU 309 CO 1.27 0.00 -0.57 0.74 0.09 0.00 0.00 178.44 179.98 3i8b h THR 310 N 0.00 1.26 0.00 0.22 2.02 -1.92 -3.32 112.91 111.17 3i8b h THR 310 Ca 0.00 -2.05 0.00 0.00 0.77 0.00 0.00 66.41 65.13 3i8b h THR 310 Cb 0.22 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 3i8b h THR 310 CO 0.00 0.56 0.00 0.61 0.37 0.00 0.00 175.52 177.06 3i8b n GLY 311 N 0.39 0.47 0.07 2.16 0.00 0.95 -4.88 105.19 104.35 3i8b n GLY 311 Ca -0.01 -0.95 -0.06 0.00 0.00 0.00 0.00 46.02 45.00 3i8b n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b h ALA 312 N 0.00 0.04 -2.27 4.61 0.00 -1.81 -3.42 119.26 116.40 3i8b h ALA 312 Ca 0.00 -0.49 -0.57 0.00 0.00 0.00 0.00 54.91 53.85 3i8b h ALA 312 Cb 0.02 0.40 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 3i8b h ALA 312 CO 0.00 0.40 0.55 0.08 0.00 0.00 0.00 179.25 180.28 3i8b s VAL 313 N -2.10 4.79 0.38 0.00 1.01 -1.26 -4.65 120.40 118.57 3i8b s VAL 313 Ca -0.14 1.94 -0.26 0.00 0.00 0.00 0.00 61.98 63.52 3i8b s VAL 313 Cb 0.02 -4.27 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 3i8b s VAL 313 CO 0.24 -0.01 1.23 -0.44 0.00 0.00 0.00 175.10 176.12 3i8b s SER 314 N 1.12 6.55 -0.98 3.32 0.01 -0.06 -4.45 113.70 119.21 3i8b s SER 314 Ca 0.45 2.49 -0.02 0.00 1.31 0.00 0.00 55.95 60.18 3i8b s SER 314 Cb -0.17 -2.63 0.28 0.00 0.21 0.00 0.00 66.02 63.71 3i8b s SER 314 CO 0.15 -0.67 1.21 0.61 0.41 0.00 0.00 173.24 174.95 3i8b n GLY 315 N 0.72 4.86 3.95 3.44 0.00 -0.57 -1.42 105.19 116.17 3i8b n GLY 315 Ca 0.03 -2.67 -0.23 0.00 0.00 0.00 0.00 46.02 43.15 3i8b n GLY 315 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i8b s PHE 316 N -2.38 2.87 0.15 1.61 0.08 -1.13 -4.61 117.98 114.57 3i8b s PHE 316 Ca 0.32 0.19 0.04 0.00 0.12 0.00 0.00 56.93 57.59 3i8b s PHE 316 Cb 0.03 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.49 3i8b s PHE 316 CO 0.03 -1.13 0.22 0.00 -0.10 0.00 0.00 175.22 174.24 3i8b s ALA 317 N -2.98 3.80 0.16 5.36 0.00 -1.26 -0.36 121.76 126.47 3i8b s ALA 317 Ca 0.59 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 51.44 3i8b s ALA 317 Cb -0.10 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.41 3i8b s ALA 317 CO 0.41 0.53 0.00 -0.40 0.00 0.00 0.00 175.76 176.30 3i8b n ASP 318 N -0.44 0.00 -1.58 0.00 5.75 -0.82 -4.22 116.55 115.24 3i8b n ASP 318 Ca -0.08 -0.69 -0.00 0.00 -0.01 0.00 0.00 54.79 54.01 3i8b n ASP 318 Cb 0.54 0.00 0.29 0.00 -1.03 0.00 0.00 41.12 40.92 3i8b n ASP 318 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3i8b n THR 320 N -0.30 1.10 -0.69 0.00 -2.24 -1.26 -4.84 114.28 106.05 3i8b n THR 320 Ca 0.33 -1.30 0.00 0.00 -2.27 0.00 0.00 64.05 60.82 3i8b n THR 320 Cb 1.19 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 3i8b n THR 320 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i8b n GLY 321 N -0.80 0.66 0.00 3.38 0.00 -1.26 -4.98 105.19 102.19 3i8b n GLY 321 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3i8b n GLY 321 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3i8b n HIS 322 N -2.65 0.00 -4.32 1.61 8.25 -1.26 -4.99 115.22 111.86 3i8b n HIS 322 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.25 3i8b n HIS 322 Cb 0.00 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 30.98 3i8b n HIS 322 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3i8b s TYR 323 N 2.57 1.48 -0.58 4.41 2.02 -0.17 -1.94 117.35 125.15 3i8b s TYR 323 Ca 0.00 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.35 3i8b s TYR 323 Cb 0.00 -0.84 0.21 0.00 -0.40 0.00 0.00 41.96 40.93 3i8b s TYR 323 CO 0.00 0.10 0.57 -0.11 -1.57 0.00 0.00 175.55 174.54 3i8b n LEU 324 N 1.45 2.24 -4.68 -1.29 7.94 0.51 0.38 117.00 123.55 3i8b n LEU 324 Ca -0.19 -5.07 -0.45 0.00 -1.11 0.00 0.00 56.01 49.18 3i8b n LEU 324 Cb 0.54 -0.27 -0.04 0.00 0.53 0.00 0.00 43.42 44.18 3i8b n LEU 324 CO 0.22 1.94 1.36 -0.81 -1.11 0.00 0.00 177.39 178.99 3i8b n PRO 325 N 1.59 2.36 -4.08 1.96 -0.04 -1.17 -2.85 135.00 132.76 3i8b n PRO 325 Ca 0.25 0.86 -0.27 0.00 -0.04 0.00 0.00 63.50 64.30 3i8b n PRO 325 Cb 0.42 -2.69 -0.17 0.00 -0.04 0.00 0.00 33.50 31.03 3i8b n PRO 325 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3i8b s LEU 326 N 2.33 1.38 -0.32 1.53 2.96 -0.51 -2.19 118.68 123.86 3i8b s LEU 326 Ca 0.84 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.40 3i8b s LEU 326 Cb -0.62 -0.91 0.07 0.00 0.50 0.00 0.00 46.19 45.23 3i8b s LEU 326 CO 0.41 -0.07 0.03 0.00 -1.32 0.00 0.00 176.35 175.40 3i8b s ALA 327 N 1.43 2.86 0.01 5.97 0.00 0.60 -0.88 121.76 131.74 3i8b s ALA 327 Ca 0.01 -1.96 -0.20 0.00 0.00 0.00 0.00 51.96 49.80 3i8b s ALA 327 Cb -0.13 -1.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.94 3i8b s ALA 327 CO -0.06 -1.39 0.59 0.00 0.00 0.00 0.00 175.76 174.89 3i8b s THR 329 N -0.33 2.52 0.21 0.00 -4.23 0.10 -2.39 115.64 111.51 3i8b s THR 329 Ca 0.30 -0.85 -0.10 0.00 -1.18 0.00 0.00 61.69 59.87 3i8b s THR 329 Cb -0.18 -2.02 0.16 0.00 1.34 0.00 0.00 72.50 71.80 3i8b s THR 329 CO 0.17 0.54 1.86 0.40 -0.54 0.00 0.00 174.62 177.05 3i8b h ILE 330 N 5.59 1.21 -3.20 2.99 1.08 -1.87 -0.23 117.51 123.09 3i8b h ILE 330 Ca -0.24 -0.45 -0.75 0.00 -0.39 0.00 0.00 64.86 63.04 3i8b h ILE 330 Cb 1.22 0.12 -0.24 0.00 -3.07 0.00 0.00 36.82 34.85 3i8b h ILE 330 CO 0.52 0.22 -0.28 0.20 -0.69 0.00 0.00 178.15 178.11 3i8b s ASN 331 N -5.98 6.10 0.00 1.72 0.01 -1.26 -4.16 114.94 111.37 3i8b s ASN 331 Ca -0.13 -1.64 0.00 0.00 -0.71 0.00 0.00 52.86 50.38 3i8b s ASN 331 Cb 0.15 -2.17 0.00 0.00 0.41 0.00 0.00 41.25 39.64 3i8b s ASN 331 CO 0.79 -0.76 0.00 0.61 -1.51 0.00 0.00 177.10 176.23 3i8b n GLY 332 N 5.18 1.23 0.34 0.66 0.00 0.58 -4.67 105.19 108.51 3i8b n GLY 332 Ca -0.13 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.06 3i8b n GLY 332 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3i8b h SER 333 N 0.00 0.00 -0.54 1.61 0.87 -0.37 -1.51 113.55 113.61 3i8b h SER 333 Ca 0.00 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.70 3i8b h SER 333 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 3i8b h SER 333 CO 0.00 0.00 0.38 0.08 -0.53 0.00 0.00 176.83 176.76 3i8b h ARG 334 N 0.00 0.06 -0.98 2.24 0.11 -1.67 0.31 114.38 114.45 3i8b h ARG 334 Ca 0.16 -0.00 0.16 0.00 0.10 0.00 0.00 59.98 60.40 3i8b h ARG 334 Cb 0.66 -0.01 -0.09 0.00 1.11 0.00 0.00 29.97 31.64 3i8b h ARG 334 CO -0.00 0.04 0.61 0.82 0.10 0.00 0.00 179.97 181.54 3i8b h ILE 335 N 0.06 0.79 0.00 0.08 2.04 -1.54 0.18 117.51 119.11 3i8b h ILE 335 Ca 0.25 -0.27 -0.12 0.00 1.00 0.00 0.00 64.86 65.72 3i8b h ILE 335 Cb 0.93 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 3i8b h ILE 335 CO -0.02 0.14 -0.59 -0.07 0.00 0.00 0.00 178.15 177.61 3i8b h LEU 336 N 0.79 0.00 -0.23 1.44 3.38 -0.56 -1.44 115.31 118.69 3i8b h LEU 336 Ca 0.52 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.45 3i8b h LEU 336 Cb 0.77 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3i8b h LEU 336 CO -0.30 0.59 -0.02 0.44 0.09 0.00 0.00 178.44 179.25 3i8b h ASP 337 N 0.00 0.42 -0.59 -0.43 3.32 -0.87 -2.14 116.42 116.13 3i8b h ASP 337 Ca -0.01 -0.33 0.11 0.00 0.02 0.00 0.00 57.03 56.83 3i8b h ASP 337 Cb 1.08 -0.11 -0.09 0.00 0.22 0.00 0.00 39.33 40.43 3i8b h ASP 337 CO 0.08 0.65 0.07 0.00 -1.72 0.00 0.00 179.24 178.32 3i8b h ALA 338 N 0.78 0.64 -0.97 3.45 0.00 -0.81 -1.31 119.26 121.05 3i8b h ALA 338 Ca 0.06 0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.20 3i8b h ALA 338 Cb 0.45 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 3i8b h ALA 338 CO 0.02 -0.35 0.61 0.78 0.00 0.00 0.00 179.25 180.31 3i8b h GLY 339 N 0.19 1.50 0.72 0.00 0.00 -1.04 0.51 103.07 104.95 3i8b h GLY 339 Ca 0.31 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 3i8b h GLY 339 CO -0.44 0.27 -0.07 3.21 0.00 0.00 0.00 176.54 179.51 3i8b h ARG 340 N 1.08 0.27 -0.09 4.80 3.08 -0.60 -1.78 114.38 121.15 3i8b h ARG 340 Ca 0.44 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.36 3i8b h ARG 340 Cb 0.25 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 3i8b h ARG 340 CO -0.20 0.62 0.06 0.00 -1.07 0.00 0.00 179.97 179.37 3i8b h ALA 341 N 0.65 0.11 -0.85 0.04 0.00 -1.10 0.22 119.26 118.33 3i8b h ALA 341 Ca 0.03 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.98 3i8b h ALA 341 Cb 0.54 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 3i8b h ALA 341 CO 0.02 -0.39 0.53 0.00 0.00 0.00 0.00 179.25 179.41 3i8b h ALA 342 N 1.02 1.16 -0.00 0.00 0.00 -0.89 -3.04 119.26 117.51 3i8b h ALA 342 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3i8b h ALA 342 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3i8b h ALA 342 CO -0.01 0.30 -0.88 1.28 0.00 0.00 0.00 179.25 179.94 3i8b n LEU 343 N -4.61 1.13 -3.22 0.00 4.32 -0.67 -5.00 117.00 108.95 3i8b n LEU 343 Ca 0.12 -0.51 -0.15 0.00 -0.02 0.00 0.00 56.01 55.45 3i8b n LEU 343 Cb 0.16 -0.02 0.07 0.00 -1.62 0.00 0.00 43.42 42.01 3i8b n LEU 343 CO 0.32 0.26 0.03 0.61 -1.22 0.00 0.00 177.39 177.39 3i8b n GLY 344 N 1.49 -1.12 3.24 -0.72 0.00 0.74 -5.05 105.19 103.76 3i8b n GLY 344 Ca 0.05 0.57 -0.09 0.00 0.00 0.00 0.00 46.02 46.55 3i8b n GLY 344 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i8b s VAL 345 N -3.38 0.11 0.63 1.61 -7.23 -0.96 -5.06 120.40 106.12 3i8b s VAL 345 Ca 0.45 -1.50 0.07 0.00 -1.81 0.00 0.00 61.98 59.18 3i8b s VAL 345 Cb -0.06 -1.74 0.11 0.00 0.56 0.00 0.00 36.38 35.26 3i8b s VAL 345 CO 0.73 -0.49 0.87 0.47 -0.31 0.00 0.00 175.10 176.36 3i8b n ASP 346 N -0.12 1.92 -0.03 4.85 8.00 -1.26 -4.56 116.55 125.36 3i8b n ASP 346 Ca -0.09 -2.45 -0.10 0.00 0.71 0.00 0.00 54.79 52.86 3i8b n ASP 346 Cb 0.63 -0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 3i8b n ASP 346 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 3i8b h TYR 347 N -0.10 -0.84 -0.74 1.24 0.05 -1.99 0.12 116.97 114.72 3i8b h TYR 347 Ca -0.29 0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.50 3i8b h TYR 347 Cb 1.26 0.40 -0.03 0.00 1.01 0.00 0.00 36.73 39.36 3i8b h TYR 347 CO 0.00 -0.38 0.33 -0.44 -1.05 0.00 0.00 178.16 176.62 3i8b h ASP 348 N -0.34 0.99 -0.29 3.88 3.32 -1.99 -1.33 116.42 120.65 3i8b h ASP 348 Ca 0.11 -0.15 0.06 0.00 0.02 0.00 0.00 57.03 57.07 3i8b h ASP 348 Cb 0.53 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 39.76 3i8b h ASP 348 CO -0.38 0.86 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.58 3i8b h GLU 349 N 1.04 -0.02 -0.36 3.56 3.07 -1.78 0.22 114.58 120.30 3i8b h GLU 349 Ca 0.25 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.16 3i8b h GLU 349 Cb 0.16 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.03 3i8b h GLU 349 CO -0.03 -0.02 0.11 1.25 -1.40 0.00 0.00 179.01 178.92 3i8b h LEU 350 N -0.02 0.09 0.02 1.33 5.85 -0.54 -1.47 115.31 120.56 3i8b h LEU 350 Ca 0.14 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3i8b h LEU 350 Cb 0.24 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.32 3i8b h LEU 350 CO -0.31 0.09 -0.01 0.00 -0.34 0.00 0.00 178.44 177.86 3i8b h ALA 351 N 1.25 -0.03 -0.50 1.25 0.00 -0.43 -0.39 119.26 120.41 3i8b h ALA 351 Ca 0.17 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.12 3i8b h ALA 351 Cb 0.17 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 3i8b h ALA 351 CO -0.19 -0.47 0.06 -0.22 0.00 0.00 0.00 179.25 178.42 3i8b h LYS 352 N -0.11 0.17 -0.02 0.00 3.64 -0.39 0.26 116.57 120.12 3i8b h LYS 352 Ca -0.00 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 3i8b h LYS 352 Cb 0.10 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 3i8b h LYS 352 CO 0.00 0.11 -0.33 1.25 -2.27 0.00 0.00 179.45 178.22 3i8b h LEU 353 N 0.18 -0.99 -0.87 5.20 5.85 -0.98 -1.22 115.31 122.48 3i8b h LEU 353 Ca 0.25 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3i8b h LEU 353 Cb 0.36 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 3i8b h LEU 353 CO -0.37 -0.39 0.56 0.00 -0.34 0.00 0.00 178.44 177.90 3i8b h ALA 354 N 0.26 1.10 0.00 1.25 0.00 0.10 -1.09 119.26 120.88 3i8b h ALA 354 Ca 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3i8b h ALA 354 Cb 0.57 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3i8b h ALA 354 CO -0.29 0.53 -0.07 0.74 0.00 0.00 0.00 179.25 180.16 3i8b h PHE 355 N 1.18 0.00 0.00 0.00 0.04 -0.72 -2.05 116.94 115.39 3i8b h PHE 355 Ca 0.32 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.09 3i8b h PHE 355 Cb -0.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.04 3i8b h PHE 355 CO -0.01 0.07 0.00 0.00 -0.60 0.00 0.00 178.31 177.77 3i8b h ALA 356 N 1.93 1.00 -3.00 2.45 0.00 0.05 -3.44 119.26 118.24 3i8b h ALA 356 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3i8b h ALA 356 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3i8b h ALA 356 CO 0.01 0.00 0.00 0.45 0.00 0.00 0.00 179.25 179.71 3i8b n SER 357 N -3.03 0.00 -4.09 0.00 2.88 -0.77 -5.03 113.62 103.57 3i8b n SER 357 Ca 0.01 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.47 3i8b n SER 357 Cb 0.30 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.66 3i8b n SER 357 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3i8b s LYS 358 N 0.33 0.62 -0.04 -1.46 1.02 -1.26 -5.05 119.74 113.89 3i8b s LYS 358 Ca 0.00 -1.17 -0.33 0.00 0.02 0.00 0.00 55.97 54.49 3i8b s LYS 358 Cb 0.00 0.12 -0.11 0.00 -0.52 0.00 0.00 37.83 37.32 3i8b s LYS 358 CO 0.00 -0.08 1.92 -2.30 -0.92 0.00 0.00 175.35 173.96 3i8b n PRO 359 N 0.26 2.43 0.00 -1.68 -0.02 -1.26 0.35 135.00 135.08 3i8b n PRO 359 Ca -0.15 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3i8b n PRO 359 Cb 0.60 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 3i8b n PRO 359 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i8b n GLY 360 N 4.46 0.75 3.68 -1.23 0.00 -1.26 -4.60 105.19 107.00 3i8b n GLY 360 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 3i8b n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b n ALA 361 N -1.39 -1.22 -3.42 4.61 0.00 0.16 -1.19 120.51 118.05 3i8b n ALA 361 Ca 0.00 0.24 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 3i8b n ALA 361 Cb 0.00 -4.48 -0.01 0.00 0.00 0.00 0.00 19.45 14.96 3i8b n ALA 361 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3i8b n ASN 362 N -2.78 -3.54 0.00 0.00 3.02 -1.26 -2.43 115.26 108.28 3i8b n ASN 362 Ca 0.01 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 3i8b n ASN 362 Cb 0.54 -2.94 0.00 0.00 -0.61 0.00 0.00 39.78 36.78 3i8b n ASN 362 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i8b n GLY 363 N -1.16 1.05 3.71 7.41 0.00 -0.33 -4.83 105.19 111.04 3i8b n GLY 363 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3i8b n GLY 363 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i8b s ILE 364 N -2.13 4.93 -0.07 -0.61 1.01 -1.02 -4.32 121.20 118.99 3i8b s ILE 364 Ca 0.00 1.83 0.05 0.00 0.00 0.00 0.00 60.65 62.53 3i8b s ILE 364 Cb 0.00 -4.21 -0.00 0.00 0.01 0.00 0.00 42.46 38.25 3i8b s ILE 364 CO 0.00 0.18 -0.22 -0.89 0.00 0.00 0.00 174.94 174.00 3i8b s THR 365 N 1.04 1.88 -0.21 2.92 2.01 -0.74 -4.59 115.64 117.96 3i8b s THR 365 Ca 0.46 -0.95 -0.07 0.00 0.31 0.00 0.00 61.69 61.44 3i8b s THR 365 Cb -0.20 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 3i8b s THR 365 CO 0.23 0.52 0.05 -0.22 -0.69 0.00 0.00 174.62 174.52 3i8b s LEU 366 N 0.08 3.56 -0.48 4.42 2.96 -1.26 -0.68 118.68 127.27 3i8b s LEU 366 Ca -0.09 -0.08 -0.13 0.00 -0.22 0.00 0.00 54.13 53.61 3i8b s LEU 366 Cb -0.15 -1.92 0.10 0.00 0.50 0.00 0.00 46.19 44.73 3i8b s LEU 366 CO 0.05 0.08 0.40 -0.69 -1.32 0.00 0.00 176.35 174.87 3i8b s VAL 367 N 0.90 4.86 -0.26 1.68 1.01 -0.37 -4.51 120.40 123.71 3i8b s VAL 367 Ca 0.03 -1.40 -0.04 0.00 0.00 0.00 0.00 61.98 60.57 3i8b s VAL 367 Cb -0.14 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3i8b s VAL 367 CO 0.02 -0.69 2.95 -0.81 0.00 0.00 0.00 175.10 176.57 3i8b n PRO 368 N 5.11 2.12 -1.07 2.72 -0.05 -1.26 -1.54 135.00 141.03 3i8b n PRO 368 Ca -0.12 -1.67 -0.14 0.00 -0.05 0.00 0.00 63.50 61.52 3i8b n PRO 368 Cb 0.42 -1.98 -0.14 0.00 -0.05 0.00 0.00 33.50 31.75 3i8b n PRO 368 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 3i8b n TYR 369 N 1.42 0.31 -1.67 0.54 4.01 -1.26 -4.75 117.16 115.77 3i8b n TYR 369 Ca 0.42 -1.57 -0.48 0.00 -0.16 0.00 0.00 57.90 56.12 3i8b n TYR 369 Cb 0.68 -1.51 -0.05 0.00 -0.31 0.00 0.00 39.34 38.15 3i8b n TYR 369 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3i8b n PHE 370 N 2.14 2.30 -2.27 -0.72 3.72 -1.26 -0.59 117.46 120.77 3i8b n PHE 370 Ca 0.42 -0.03 -0.14 0.00 -0.05 0.00 0.00 57.45 57.65 3i8b n PHE 370 Cb 0.83 -2.67 -0.01 0.00 -0.94 0.00 0.00 39.48 36.69 3i8b n PHE 370 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3i8b n ASP 371 N 7.10 -4.40 0.00 4.37 8.00 -1.26 -4.79 116.55 125.57 3i8b n ASP 371 Ca 0.24 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.72 3i8b n ASP 371 Cb 0.31 -3.55 0.00 0.00 -0.02 0.00 0.00 41.12 37.85 3i8b n ASP 371 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i8b n GLY 372 N -1.01 -2.14 3.21 0.44 0.00 0.24 -4.87 105.19 101.06 3i8b n GLY 372 Ca -0.17 -1.57 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 3i8b n GLY 372 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i8b s GLU 373 N -0.17 0.66 -0.05 1.61 0.41 -0.43 -4.66 118.70 116.07 3i8b s GLU 373 Ca 0.00 -0.31 -0.21 0.00 -0.41 0.00 0.00 54.97 54.04 3i8b s GLU 373 Cb 0.00 0.29 -0.31 0.00 -1.78 0.00 0.00 34.13 32.32 3i8b s GLU 373 CO 0.00 -0.18 0.88 0.00 -0.49 0.00 0.00 175.26 175.47 3i8b h ARG 374 N 3.82 0.31 -4.01 1.61 2.47 -1.87 -1.79 114.38 114.91 3i8b h ARG 374 Ca -0.30 -0.52 -0.54 0.00 -1.26 0.00 0.00 59.98 57.35 3i8b h ARG 374 Cb 1.18 0.19 -0.38 0.00 -1.65 0.00 0.00 29.97 29.31 3i8b h ARG 374 CO 0.42 1.25 -0.78 0.99 0.56 0.00 0.00 179.97 182.40 3i8b s THR 375 N -2.44 0.96 1.06 2.04 2.01 -1.01 -2.86 115.64 115.41 3i8b s THR 375 Ca -0.14 -0.61 -0.13 0.00 0.31 0.00 0.00 61.69 61.11 3i8b s THR 375 Cb 0.01 -1.22 0.22 0.00 0.01 0.00 0.00 72.50 71.52 3i8b s THR 375 CO 0.83 0.04 1.08 -2.16 -0.69 0.00 0.00 174.62 173.73 3i8b s PRO 376 N 1.69 -0.09 -1.21 4.92 0.05 -1.26 -4.83 135.00 134.27 3i8b s PRO 376 Ca -0.00 0.45 -0.19 0.00 0.05 0.00 0.00 61.00 61.31 3i8b s PRO 376 Cb -0.16 -1.68 0.07 0.00 0.05 0.00 0.00 34.50 32.78 3i8b s PRO 376 CO -0.07 -3.07 1.63 1.21 0.05 0.00 0.00 177.00 176.75 3i8b s ASN 377 N -3.39 6.75 -0.43 6.66 3.84 -1.14 -4.58 114.94 122.66 3i8b s ASN 377 Ca 0.67 -2.19 0.06 0.00 0.21 0.00 0.00 52.86 51.61 3i8b s ASN 377 Cb -0.18 -2.57 0.20 0.00 -0.55 0.00 0.00 41.25 38.15 3i8b s ASN 377 CO 0.58 -1.24 0.44 0.54 -2.79 0.00 0.00 177.10 174.63 3i8b n ARG 378 N 8.37 0.60 -0.37 0.43 1.74 -0.67 -5.00 116.66 121.76 3i8b n ARG 378 Ca 0.43 -3.35 -0.01 0.00 -0.77 0.00 0.00 57.85 54.15 3i8b n ARG 378 Cb 0.47 -1.57 0.12 0.00 -1.02 0.00 0.00 32.46 30.46 3i8b n ARG 378 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3i8b h PRO 379 N 4.95 1.25 -0.62 5.56 0.11 -1.88 -1.04 132.00 140.33 3i8b h PRO 379 Ca 0.19 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.22 3i8b h PRO 379 Cb 0.88 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 31.70 3i8b h PRO 379 CO 0.45 0.83 0.00 0.09 -0.21 0.00 0.00 178.00 179.16 3i8b n ASN 380 N -4.43 5.27 -4.86 -2.05 4.13 -1.26 -4.17 115.26 107.89 3i8b n ASN 380 Ca 0.12 -2.75 -0.30 0.00 1.68 0.00 0.00 54.58 53.33 3i8b n ASN 380 Cb 0.05 -0.65 0.04 0.00 -1.54 0.00 0.00 39.78 37.68 3i8b n ASN 380 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3i8b s ALA 381 N -2.42 2.86 0.12 5.41 0.00 -1.01 -4.88 121.76 121.83 3i8b s ALA 381 Ca 0.52 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.28 3i8b s ALA 381 Cb 0.37 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.39 3i8b s ALA 381 CO 0.18 -1.08 -0.06 -0.08 0.00 0.00 0.00 175.76 174.72 3i8b s THR 382 N -3.25 0.78 0.46 0.00 -1.32 -1.24 -0.77 115.64 110.29 3i8b s THR 382 Ca 0.58 -1.97 -0.20 0.00 -1.21 0.00 0.00 61.69 58.89 3i8b s THR 382 Cb -0.12 -1.77 -0.10 0.00 -1.51 0.00 0.00 72.50 69.01 3i8b s THR 382 CO 0.53 -0.80 0.99 0.00 -2.21 0.00 0.00 174.62 173.13 3i8b s ALA 383 N -3.57 2.96 -0.05 11.08 0.00 -1.11 -4.41 121.76 126.67 3i8b s ALA 383 Ca 0.14 0.48 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 3i8b s ALA 383 Cb 0.05 -3.19 0.03 0.00 0.00 0.00 0.00 23.12 20.01 3i8b s ALA 383 CO -0.03 -0.08 0.07 0.99 0.00 0.00 0.00 175.76 176.71 3i8b s THR 384 N -2.12 -0.13 -0.14 0.00 2.01 -0.59 -4.91 115.64 109.77 3i8b s THR 384 Ca 0.64 0.40 -0.19 0.00 0.31 0.00 0.00 61.69 62.85 3i8b s THR 384 Cb -0.12 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 3i8b s THR 384 CO 0.17 0.17 0.52 -0.36 -0.69 0.00 0.00 174.62 174.43 3i8b s PHE 385 N 2.09 3.48 0.36 4.92 0.08 -1.26 -1.23 117.98 126.42 3i8b s PHE 385 Ca 0.03 0.91 0.03 0.00 0.12 0.00 0.00 56.93 58.03 3i8b s PHE 385 Cb -0.12 -2.62 -0.04 0.00 -0.57 0.00 0.00 43.02 39.67 3i8b s PHE 385 CO -0.03 0.08 0.11 -1.54 -0.10 0.00 0.00 175.22 173.73 3i8b s SER 386 N 0.80 2.43 -0.12 1.36 1.04 0.14 -4.98 113.70 114.37 3i8b s SER 386 Ca 0.27 -1.56 -0.01 0.00 0.48 0.00 0.00 55.95 55.13 3i8b s SER 386 Cb -0.16 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.27 3i8b s SER 386 CO 0.11 -0.82 0.05 0.61 0.98 0.00 0.00 173.24 174.16 3i8b n GLY 387 N -0.78 -2.78 0.00 7.32 0.00 -1.26 -1.79 105.19 105.90 3i8b n GLY 387 Ca -0.04 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3i8b n GLY 387 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3i8b n THR 389 N 0.09 0.00 0.01 2.61 -1.04 -1.26 -4.19 114.28 110.49 3i8b n THR 389 Ca 0.01 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.92 3i8b n THR 389 Cb 0.04 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.50 3i8b n THR 389 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3i8b h LEU 390 N 0.00 -0.10 -0.79 -4.42 5.85 -2.03 -0.32 115.31 113.50 3i8b h LEU 390 Ca 0.00 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.82 3i8b h LEU 390 Cb 0.00 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 3i8b h LEU 390 CO 0.00 -0.04 0.47 0.00 -0.34 0.00 0.00 178.44 178.53 3i8b h ALA 391 N 1.07 1.10 -0.01 1.25 0.00 -2.01 -3.09 119.26 117.56 3i8b h ALA 391 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3i8b h ALA 391 Cb 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3i8b h ALA 391 CO -0.10 0.15 -0.46 0.27 0.00 0.00 0.00 179.25 179.12 3i8b n ASN 392 N -4.71 1.24 -4.55 0.00 0.23 -1.08 -4.72 115.26 101.67 3i8b n ASN 392 Ca 0.12 -0.99 -0.43 0.00 -0.53 0.00 0.00 54.58 52.75 3i8b n ASN 392 Cb 0.21 0.37 -0.01 0.00 -2.08 0.00 0.00 39.78 38.27 3i8b n ASN 392 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3i8b s THR 393 N -2.64 4.26 0.10 5.53 2.01 -0.15 -4.65 115.64 120.10 3i8b s THR 393 Ca 0.18 -1.70 -0.01 0.00 0.31 0.00 0.00 61.69 60.47 3i8b s THR 393 Cb 0.18 -5.09 -0.04 0.00 0.01 0.00 0.00 72.50 67.57 3i8b s THR 393 CO 0.61 -1.90 0.02 0.42 -0.69 0.00 0.00 174.62 173.08 3i8b s THR 394 N 3.89 0.15 0.27 -0.82 -4.23 -1.26 -5.01 115.64 108.63 3i8b s THR 394 Ca 0.48 -1.87 -0.03 0.00 -1.18 0.00 0.00 61.69 59.09 3i8b s THR 394 Cb 0.01 -1.85 0.20 0.00 1.34 0.00 0.00 72.50 72.20 3i8b s THR 394 CO 0.01 -0.66 1.87 0.03 -0.54 0.00 0.00 174.62 175.33 3i8b h ARG 395 N 2.97 1.02 0.40 3.99 3.08 -1.99 -1.15 114.38 122.70 3i8b h ARG 395 Ca -0.35 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.55 3i8b h ARG 395 Cb 1.18 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 3i8b h ARG 395 CO 0.62 0.79 -0.21 0.93 -1.07 0.00 0.00 179.97 181.02 3i8b h GLU 396 N 1.02 -0.55 -0.66 0.04 3.07 -1.95 0.21 114.58 115.76 3i8b h GLU 396 Ca 0.25 0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 59.07 3i8b h GLU 396 Cb 0.10 0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.11 3i8b h GLU 396 CO -0.03 -0.37 0.11 -0.91 -1.40 0.00 0.00 179.01 176.41 3i8b h ASN 397 N -0.57 1.05 -0.11 1.42 -0.26 -1.79 -0.69 115.58 114.62 3i8b h ASN 397 Ca -0.05 -0.25 -0.00 0.00 -0.56 0.00 0.00 56.30 55.44 3i8b h ASN 397 Cb 0.45 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.43 3i8b h ASN 397 CO 0.07 1.03 0.06 -0.07 -1.06 0.00 0.00 177.43 177.46 3i8b h LEU 398 N 1.02 0.14 -0.39 1.61 3.38 -1.11 0.09 115.31 120.05 3i8b h LEU 398 Ca 0.20 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.16 3i8b h LEU 398 Cb 0.43 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.06 3i8b h LEU 398 CO 0.01 0.20 -0.20 0.00 0.09 0.00 0.00 178.44 178.55 3i8b h ALA 399 N 0.95 0.09 -0.43 1.53 0.00 -0.29 -0.11 119.26 120.99 3i8b h ALA 399 Ca 0.04 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3i8b h ALA 399 Cb 0.09 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3i8b h ALA 399 CO -0.01 -0.56 0.18 -0.09 0.00 0.00 0.00 179.25 178.77 3i8b h ARG 400 N -0.13 0.61 -0.21 0.00 9.65 -0.92 -2.14 114.38 121.25 3i8b h ARG 400 Ca 0.19 -0.08 -0.11 0.00 -1.10 0.00 0.00 59.98 58.89 3i8b h ARG 400 Cb 0.42 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 3i8b h ARG 400 CO -0.47 0.50 -0.33 0.00 2.80 0.00 0.00 179.97 182.47 3i8b h ALA 401 N 1.59 1.05 -0.17 2.80 0.00 0.40 0.80 119.26 125.73 3i8b h ALA 401 Ca 0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3i8b h ALA 401 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3i8b h ALA 401 CO -0.02 0.58 0.07 0.74 0.00 0.00 0.00 179.25 180.63 3i8b h PHE 402 N 0.37 0.25 -0.25 0.00 0.04 -0.43 -0.24 116.94 116.67 3i8b h PHE 402 Ca 0.04 -0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.75 3i8b h PHE 402 Cb 0.76 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.83 3i8b h PHE 402 CO 0.02 0.29 -0.05 0.28 -0.60 0.00 0.00 178.31 178.26 3i8b h VAL 403 N 0.13 1.28 0.00 -0.55 2.07 -1.30 -2.37 116.25 115.50 3i8b h VAL 403 Ca 0.06 -1.03 -0.05 0.00 0.82 0.00 0.00 66.70 66.49 3i8b h VAL 403 Cb 0.14 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3i8b h VAL 403 CO -0.01 0.32 -0.24 -0.33 0.02 0.00 0.00 177.57 177.34 3i8b h GLU 404 N 0.22 0.00 -0.11 1.57 5.08 -0.85 -2.33 114.58 118.16 3i8b h GLU 404 Ca 0.06 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 3i8b h GLU 404 Cb 0.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 3i8b h GLU 404 CO 0.02 0.24 -0.17 0.78 -1.00 0.00 0.00 179.01 178.88 3i8b h GLY 405 N 0.87 0.33 0.35 -3.84 0.00 -0.89 -0.24 103.07 99.65 3i8b h GLY 405 Ca -0.00 -0.38 0.05 0.00 0.00 0.00 0.00 47.33 47.00 3i8b h GLY 405 CO 0.03 0.34 -0.20 -2.00 0.00 0.00 0.00 176.54 174.72 3i8b h LEU 406 N -0.13 -0.61 -0.71 3.11 6.46 -1.16 -2.08 115.31 120.19 3i8b h LEU 406 Ca 0.01 0.11 -0.10 0.00 -0.12 0.00 0.00 57.88 57.78 3i8b h LEU 406 Cb 0.74 0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.94 3i8b h LEU 406 CO 0.04 -0.24 -0.09 -0.07 -0.62 0.00 0.00 178.44 177.46 3i8b h LEU 407 N -0.24 0.89 -1.02 2.25 -0.00 -1.42 -3.06 115.31 112.71 3i8b h LEU 407 Ca 0.11 -0.27 -0.04 0.00 -0.00 0.00 0.00 57.88 57.67 3i8b h LEU 407 Cb 0.39 -0.24 -0.03 0.00 -0.00 0.00 0.00 40.66 40.78 3i8b h LEU 407 CO -0.29 1.00 0.21 0.00 -0.00 0.00 0.00 178.44 179.36 3i8b h SER 409 N 0.89 0.45 -0.69 0.00 0.87 -1.29 0.19 113.55 113.99 3i8b h SER 409 Ca 0.21 -0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 3i8b h SER 409 Cb 0.23 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 3i8b h SER 409 CO -0.01 0.40 0.29 1.56 -0.53 0.00 0.00 176.83 178.54 3i8b h GLN 410 N 0.47 1.04 -0.33 2.24 1.08 -1.38 -0.76 115.11 117.46 3i8b h GLN 410 Ca 0.13 -0.17 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 3i8b h GLN 410 Cb 0.05 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 3i8b h GLN 410 CO -0.02 0.83 0.17 -0.09 -0.95 0.00 0.00 178.83 178.77 3i8b h ARG 411 N 1.02 0.47 -0.90 1.46 9.65 -0.88 -1.83 114.38 123.38 3i8b h ARG 411 Ca 0.24 -0.06 0.18 0.00 -1.10 0.00 0.00 59.98 59.24 3i8b h ARG 411 Cb 0.18 -0.09 -0.11 0.00 -1.39 0.00 0.00 29.97 28.56 3i8b h ARG 411 CO -0.02 0.42 0.46 0.22 2.80 0.00 0.00 179.97 183.85 3i8b h ASP 412 N 0.41 0.53 -0.45 -3.80 3.58 0.13 0.45 116.42 117.27 3i8b h ASP 412 Ca 0.12 0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 3i8b h ASP 412 Cb 0.09 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 3i8b h ASP 412 CO -0.02 0.16 0.25 0.00 -2.88 0.00 0.00 179.24 176.76 3i8b h LEU 414 N 0.59 0.91 -0.70 0.00 4.07 -0.18 -0.67 115.31 119.33 3i8b h LEU 414 Ca 0.16 -0.01 -0.12 0.00 0.08 0.00 0.00 57.88 57.99 3i8b h LEU 414 Cb 0.03 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 3i8b h LEU 414 CO -0.03 0.63 -0.25 -0.33 -1.08 0.00 0.00 178.44 177.38 3i8b h GLU 415 N 1.07 0.73 -0.30 1.13 4.39 -0.77 -0.30 114.58 120.53 3i8b h GLU 415 Ca 0.33 -0.31 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 3i8b h GLU 415 Cb -0.03 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 3i8b h GLU 415 CO -0.10 0.91 0.02 1.25 -1.16 0.00 0.00 179.01 179.93 3i8b h LEU 416 N 0.63 0.50 -0.35 1.33 5.85 -0.80 -0.88 115.31 121.60 3i8b h LEU 416 Ca 0.08 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3i8b h LEU 416 Cb 0.76 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3i8b h LEU 416 CO 0.06 0.66 0.21 0.40 -0.34 0.00 0.00 178.44 179.43 3i8b h ILE 417 N 0.32 1.12 -0.99 4.05 2.04 -0.95 -1.57 117.51 121.53 3i8b h ILE 417 Ca 0.09 -0.28 0.16 0.00 1.00 0.00 0.00 64.86 65.83 3i8b h ILE 417 Cb 0.39 0.68 -0.09 0.00 -0.74 0.00 0.00 36.82 37.06 3i8b h ILE 417 CO 0.01 0.12 0.62 0.03 0.00 0.00 0.00 178.15 178.93 3i8b h ARG 418 N 0.45 0.81 0.00 2.37 3.08 -0.98 -0.76 114.38 119.35 3i8b h ARG 418 Ca 0.12 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3i8b h ARG 418 Cb 0.01 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.88 3i8b h ARG 418 CO -0.02 0.54 -0.00 0.66 -1.07 0.00 0.00 179.97 180.07 3i8b h SER 419 N 0.83 0.00 -0.06 7.04 4.64 -0.15 -0.43 113.55 125.42 3i8b h SER 419 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3i8b h SER 419 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 3i8b h SER 419 CO -0.31 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.83 3i8b n LEU 420 N -3.10 0.47 0.00 5.97 4.77 -0.29 -4.88 117.00 119.93 3i8b n LEU 420 Ca -0.01 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 3i8b n LEU 420 Cb 0.23 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3i8b n LEU 420 CO 0.25 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3i8b n GLY 421 N 0.80 0.71 3.47 -0.72 0.00 -0.17 -4.60 105.19 104.68 3i8b n GLY 421 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3i8b n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i8b s ALA 422 N -2.61 3.40 0.47 4.61 0.00 -1.21 -4.97 121.76 121.44 3i8b s ALA 422 Ca 0.00 -1.59 -0.24 0.00 0.00 0.00 0.00 51.96 50.13 3i8b s ALA 422 Cb 0.00 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.79 3i8b s ALA 422 CO 0.00 -1.84 1.30 0.43 0.00 0.00 0.00 175.76 175.65 3i8b n SER 423 N 5.99 2.61 -3.91 0.00 7.64 -1.26 -3.71 113.62 120.97 3i8b n SER 423 Ca -0.06 1.06 -0.29 0.00 1.01 0.00 0.00 58.87 60.59 3i8b n SER 423 Cb 0.46 -1.53 -0.16 0.00 -1.01 0.00 0.00 64.21 61.97 3i8b n SER 423 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i8b s ILE 424 N -1.24 1.22 0.00 0.44 1.01 -1.26 -4.13 121.20 117.24 3i8b s ILE 424 Ca 0.65 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 60.59 3i8b s ILE 424 Cb -0.47 -1.37 0.00 0.00 0.01 0.00 0.00 42.46 40.63 3i8b s ILE 424 CO 0.55 0.14 0.30 0.35 0.00 0.00 0.00 174.94 176.28 3i8b n THR 425 N 4.84 0.00 -3.70 2.92 -2.24 0.11 -5.01 114.28 111.20 3i8b n THR 425 Ca -0.12 -0.50 -0.14 0.00 -2.27 0.00 0.00 64.05 61.02 3i8b n THR 425 Cb 0.47 1.00 -0.09 0.00 -2.10 0.00 0.00 70.33 69.62 3i8b n THR 425 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3i8b s ARG 426 N -0.39 0.61 -0.13 -0.78 3.52 -1.18 -5.02 118.95 115.59 3i8b s ARG 426 Ca 0.00 0.64 0.02 0.00 -0.13 0.00 0.00 55.73 56.26 3i8b s ARG 426 Cb 0.00 0.30 -0.00 0.00 -1.56 0.00 0.00 34.95 33.68 3i8b s ARG 426 CO 0.00 -0.09 -0.19 0.42 -0.81 0.00 0.00 175.30 174.63 3i8b s ILE 427 N 0.13 2.44 -0.10 4.11 1.01 -1.26 -1.49 121.20 126.04 3i8b s ILE 427 Ca -0.01 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 3i8b s ILE 427 Cb -0.03 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 3i8b s ILE 427 CO 0.01 0.54 -0.03 -0.76 0.00 0.00 0.00 174.94 174.70 3i8b s LEU 428 N 0.53 3.36 -0.20 2.97 1.02 0.07 -1.38 118.68 125.04 3i8b s LEU 428 Ca -0.12 0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.05 3i8b s LEU 428 Cb -0.16 -1.76 0.02 0.00 0.02 0.00 0.00 46.19 44.30 3i8b s LEU 428 CO 0.04 0.32 -0.15 -0.22 0.02 0.00 0.00 176.35 176.36 3i8b s LEU 429 N -0.56 2.50 0.00 1.79 2.96 0.38 -0.26 118.68 125.49 3i8b s LEU 429 Ca 0.09 -0.72 0.03 0.00 -0.22 0.00 0.00 54.13 53.31 3i8b s LEU 429 Cb -0.12 -1.55 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 3i8b s LEU 429 CO 0.02 -0.04 0.11 2.30 -1.32 0.00 0.00 176.35 177.42 3i8b n ILE 430 N 4.63 0.00 0.00 6.68 -5.35 -0.26 -4.21 119.36 120.85 3i8b n ILE 430 Ca -0.19 -1.74 0.00 0.00 -0.27 0.00 0.00 62.75 60.54 3i8b n ILE 430 Cb 0.49 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 39.01 3i8b n ILE 430 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3i8b n GLY 431 N 0.04 -1.31 0.32 3.28 0.00 -1.26 -1.78 105.19 104.49 3i8b n GLY 431 Ca -0.04 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.45 3i8b n GLY 431 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i8b h GLY 432 N 0.00 1.42 1.60 -0.02 0.00 -1.92 -0.95 103.07 103.21 3i8b h GLY 432 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.01 3i8b h GLY 432 CO 0.00 0.08 0.20 -1.33 0.00 0.00 0.00 176.54 175.49 3i8b h GLY 433 N 0.79 0.00 2.00 4.60 0.00 0.00 -1.80 103.07 108.66 3i8b h GLY 433 Ca 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.75 3i8b h GLY 433 CO -0.29 0.00 -0.13 0.00 0.00 0.00 0.00 176.54 176.12 3i8b h ALA 434 N 1.62 1.05 -0.01 3.60 0.00 -1.34 -2.03 119.26 122.16 3i8b h ALA 434 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3i8b h ALA 434 Cb 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3i8b h ALA 434 CO -0.00 0.16 -0.10 0.36 0.00 0.00 0.00 179.25 179.67 3i8b n LYS 435 N -3.32 0.98 -2.39 0.00 0.00 -0.68 -4.73 118.16 108.04 3i8b n LYS 435 Ca -0.00 -0.43 -0.43 0.00 -0.00 0.00 0.00 58.31 57.45 3i8b n LYS 435 Cb 0.35 -1.49 -0.02 0.00 -0.00 0.00 0.00 35.03 33.86 3i8b n LYS 435 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3i8b s SER 436 N -2.32 6.77 0.31 -5.58 0.15 -0.76 -4.91 113.70 107.36 3i8b s SER 436 Ca 0.32 1.49 0.00 0.00 0.70 0.00 0.00 55.95 58.46 3i8b s SER 436 Cb 0.20 -2.54 0.52 0.00 -1.71 0.00 0.00 66.02 62.50 3i8b s SER 436 CO 0.44 -0.95 1.95 -0.08 1.20 0.00 0.00 173.24 175.81 3i8b h GLU 437 N 8.93 1.00 -0.16 5.44 4.81 -1.88 0.42 114.58 133.13 3i8b h GLU 437 Ca -0.27 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 58.80 3i8b h GLU 437 Cb 1.11 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.26 3i8b h GLU 437 CO 1.00 0.66 -0.29 0.00 -0.73 0.00 0.00 179.01 179.65 3i8b h ALA 438 N 1.52 0.25 0.30 2.92 0.00 -1.96 0.32 119.26 122.61 3i8b h ALA 438 Ca 0.32 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3i8b h ALA 438 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3i8b h ALA 438 CO -0.09 0.27 -0.14 0.82 0.00 0.00 0.00 179.25 180.10 3i8b h ILE 439 N 0.11 0.73 -1.00 0.00 2.04 -1.77 -1.18 117.51 116.45 3i8b h ILE 439 Ca 0.01 -0.35 0.21 0.00 1.00 0.00 0.00 64.86 65.73 3i8b h ILE 439 Cb 0.88 0.93 -0.11 0.00 -0.74 0.00 0.00 36.82 37.77 3i8b h ILE 439 CO 0.07 0.07 0.61 -0.09 0.00 0.00 0.00 178.15 178.81 3i8b h ARG 440 N -0.59 0.67 0.12 2.37 2.43 -0.19 0.03 114.38 119.22 3i8b h ARG 440 Ca -0.04 -0.04 -0.30 0.00 -0.81 0.00 0.00 59.98 58.79 3i8b h ARG 440 Cb 0.43 -0.15 0.03 0.00 -0.42 0.00 0.00 29.97 29.86 3i8b h ARG 440 CO 0.07 0.44 -1.25 1.15 -1.51 0.00 0.00 179.97 178.86 3i8b h THR 441 N 0.69 1.28 0.00 0.20 2.02 -0.14 -3.34 112.91 113.62 3i8b h THR 441 Ca 0.60 -2.47 0.00 0.00 0.77 0.00 0.00 66.41 65.31 3i8b h THR 441 Cb 1.03 2.70 0.00 0.00 -1.74 0.00 0.00 68.15 70.14 3i8b h THR 441 CO -0.41 0.75 -0.65 0.18 0.37 0.00 0.00 175.52 175.76 3i8b n LEU 442 N -3.79 0.59 -0.01 2.58 4.77 -0.46 -4.48 117.00 116.21 3i8b n LEU 442 Ca -0.14 0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.80 3i8b n LEU 442 Cb 0.99 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.86 3i8b n LEU 442 CO 0.58 0.06 0.75 0.00 -1.33 0.00 0.00 177.39 177.45 3i8b h ALA 443 N 2.77 -0.09 -0.54 -1.18 0.00 -1.12 -2.57 119.26 116.53 3i8b h ALA 443 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3i8b h ALA 443 Cb 0.61 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3i8b h ALA 443 CO 0.00 -0.62 0.36 -1.35 0.00 0.00 0.00 179.25 177.64 3i8b h PRO 444 N -0.20 0.70 -0.13 0.00 0.11 -1.82 0.31 132.00 130.97 3i8b h PRO 444 Ca 0.10 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.21 3i8b h PRO 444 Cb 0.35 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 31.24 3i8b h PRO 444 CO -0.26 0.47 -0.33 1.03 -0.21 0.00 0.00 178.00 178.70 3i8b h SER 445 N 0.72 -1.01 0.47 -2.05 0.87 -1.64 -0.22 113.55 110.68 3i8b h SER 445 Ca 0.20 0.15 -0.30 0.00 -1.23 0.00 0.00 61.79 60.61 3i8b h SER 445 Cb -0.07 0.43 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 3i8b h SER 445 CO -0.05 -0.36 -1.71 0.16 -0.53 0.00 0.00 176.83 174.33 3i8b h ILE 446 N -0.40 0.86 0.00 2.23 -0.00 -1.19 -2.11 117.51 116.89 3i8b h ILE 446 Ca 0.10 -2.69 -0.08 0.00 -0.00 0.00 0.00 64.86 62.19 3i8b h ILE 446 Cb 0.55 2.45 -0.01 0.00 -0.00 0.00 0.00 36.82 39.81 3i8b h ILE 446 CO -0.36 0.56 -0.39 -0.07 -0.00 0.00 0.00 178.15 177.89 3i8b h LEU 447 N 0.01 0.00 0.00 0.16 3.38 -0.43 -3.46 115.31 114.97 3i8b h LEU 447 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3i8b h LEU 447 Cb 2.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.76 3i8b h LEU 447 CO 0.08 0.39 0.00 0.61 0.09 0.00 0.00 178.44 179.61 3i8b n GLY 448 N -0.13 1.51 3.67 0.83 0.00 -0.09 -5.00 105.19 105.97 3i8b n GLY 448 Ca -0.01 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 3i8b n GLY 448 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3i8b n ASP 450 N 0.50 1.94 -3.97 1.61 9.92 -1.26 -4.92 116.55 120.37 3i8b n ASP 450 Ca 0.00 1.01 -0.31 0.00 -0.53 0.00 0.00 54.79 54.97 3i8b n ASP 450 Cb 0.11 -1.46 -0.15 0.00 -0.64 0.00 0.00 41.12 38.98 3i8b n ASP 450 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3i8b s VAL 451 N -1.29 1.72 0.12 2.53 1.01 -0.29 -4.27 120.40 119.93 3i8b s VAL 451 Ca 0.66 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 3i8b s VAL 451 Cb -0.49 -1.96 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 3i8b s VAL 451 CO 0.54 -0.11 0.96 -0.89 0.00 0.00 0.00 175.10 175.60 3i8b s THR 452 N 1.30 4.48 -0.49 3.92 2.01 -0.48 -0.31 115.64 126.08 3i8b s THR 452 Ca -0.06 2.06 -0.03 0.00 0.31 0.00 0.00 61.69 63.97 3i8b s THR 452 Cb -0.19 -4.32 0.13 0.00 0.01 0.00 0.00 72.50 68.13 3i8b s THR 452 CO -0.06 0.33 0.29 -0.13 -0.69 0.00 0.00 174.62 174.36 3i8b s ARG 453 N -0.08 2.21 0.40 4.92 0.52 0.12 -0.47 118.95 126.57 3i8b s ARG 453 Ca 0.46 -2.07 -0.27 0.00 -0.52 0.00 0.00 55.73 53.34 3i8b s ARG 453 Cb -0.23 -3.65 -0.09 0.00 0.52 0.00 0.00 34.95 31.50 3i8b s ARG 453 CO 0.30 -1.11 1.36 -2.14 0.02 0.00 0.00 175.30 173.72 3i8b s PRO 454 N 0.73 3.98 0.35 3.54 0.02 -1.26 0.05 135.00 142.42 3i8b s PRO 454 Ca 0.11 2.28 -0.28 0.00 0.02 0.00 0.00 61.00 63.13 3i8b s PRO 454 Cb -0.22 -2.81 -0.12 0.00 0.02 0.00 0.00 34.50 31.37 3i8b s PRO 454 CO -0.04 -0.52 1.39 0.00 -0.33 0.00 0.00 177.00 177.50 3i8b n ALA 455 N 0.20 1.78 -1.73 -1.55 0.00 -0.08 -4.53 120.51 114.61 3i8b n ALA 455 Ca 0.03 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 3i8b n ALA 455 Cb 0.42 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.52 3i8b n ALA 455 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3i8b n THR 456 N 0.50 0.78 -3.78 0.00 5.66 -1.26 -4.95 114.28 111.22 3i8b n THR 456 Ca 0.04 -0.20 -0.02 0.00 -3.05 0.00 0.00 64.05 60.82 3i8b n THR 456 Cb 0.37 -1.87 -0.00 0.00 -1.55 0.00 0.00 70.33 67.28 3i8b n THR 456 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3i8b s ASP 457 N 0.60 -0.09 -1.36 1.09 -1.08 -1.26 -5.07 116.67 109.51 3i8b s ASP 457 Ca 0.67 -0.44 -0.15 0.00 -0.52 0.00 0.00 52.55 52.11 3i8b s ASP 457 Cb -0.53 0.42 0.07 0.00 -1.46 0.00 0.00 42.92 41.42 3i8b s ASP 457 CO 0.45 -0.80 1.94 -0.62 0.52 0.00 0.00 175.17 176.66 3i8b n GLU 458 N -0.57 3.10 -0.05 4.34 -0.58 -1.26 -4.80 120.64 120.82 3i8b n GLU 458 Ca -0.05 -3.06 0.02 0.00 -0.42 0.00 0.00 57.16 53.65 3i8b n GLU 458 Cb 0.61 -3.33 0.34 0.00 -0.57 0.00 0.00 31.44 28.49 3i8b n GLU 458 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 3i8b h TYR 459 N 6.72 0.63 -0.00 -0.32 0.05 -1.95 -0.01 116.97 122.10 3i8b h TYR 459 Ca 0.49 -0.01 -0.00 0.00 0.05 0.00 0.00 58.73 59.26 3i8b h TYR 459 Cb 0.75 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 38.29 3i8b h TYR 459 CO 1.40 0.46 -0.00 0.28 -1.05 0.00 0.00 178.16 179.25 3i8b h VAL 460 N 0.66 1.31 -0.89 -2.88 2.07 -1.87 0.55 116.25 115.20 3i8b h VAL 460 Ca 0.17 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 3i8b h VAL 460 Cb 0.04 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 3i8b h VAL 460 CO -0.03 0.24 0.52 0.00 0.02 0.00 0.00 177.57 178.33 3i8b h ALA 461 N 0.61 1.25 -0.35 1.67 0.00 -1.78 -0.22 119.26 120.44 3i8b h ALA 461 Ca 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3i8b h ALA 461 Cb 0.39 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3i8b h ALA 461 CO 0.00 0.63 0.01 0.82 0.00 0.00 0.00 179.25 180.72 3i8b h ILE 462 N 1.23 1.25 -0.89 0.00 2.04 -0.95 -1.79 117.51 118.41 3i8b h ILE 462 Ca 0.32 -0.95 0.02 0.00 1.00 0.00 0.00 64.86 65.25 3i8b h ILE 462 Cb -0.03 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 3i8b h ILE 462 CO -0.06 0.31 0.58 1.23 0.00 0.00 0.00 178.15 180.22 3i8b h GLY 463 N 0.42 1.27 1.16 5.37 0.00 -0.48 0.24 103.07 111.04 3i8b h GLY 463 Ca 0.10 -0.45 -0.10 0.00 0.00 0.00 0.00 47.33 46.88 3i8b h GLY 463 CO 0.02 0.41 -0.04 0.00 0.00 0.00 0.00 176.54 176.92 3i8b h ALA 464 N 1.35 0.86 -0.47 3.60 0.00 -0.93 -1.27 119.26 122.40 3i8b h ALA 464 Ca 0.34 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3i8b h ALA 464 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3i8b h ALA 464 CO -0.10 0.66 -0.08 0.00 0.00 0.00 0.00 179.25 179.73 3i8b h ALA 465 N 1.03 0.98 -0.46 0.00 0.00 -0.93 -1.45 119.26 118.43 3i8b h ALA 465 Ca 0.16 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3i8b h ALA 465 Cb 0.59 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3i8b h ALA 465 CO 0.04 0.61 0.06 -0.09 0.00 0.00 0.00 179.25 179.87 3i8b h ARG 466 N 0.75 0.71 -0.15 0.00 2.43 -0.64 0.09 114.38 117.57 3i8b h ARG 466 Ca 0.13 -0.15 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 3i8b h ARG 466 Cb 0.57 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.03 3i8b h ARG 466 CO 0.04 0.68 -0.76 0.37 -1.51 0.00 0.00 179.97 178.79 3i8b h GLN 467 N 0.68 0.74 -0.56 0.20 4.15 -0.93 0.61 115.11 119.99 3i8b h GLN 467 Ca 0.15 -0.60 -0.05 0.00 0.77 0.00 0.00 58.65 58.92 3i8b h GLN 467 Cb 0.33 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 3i8b h GLN 467 CO 0.01 1.21 0.16 0.00 -1.93 0.00 0.00 178.83 178.28 3i8b h ALA 468 N 0.62 0.74 -0.60 3.38 0.00 -1.01 -1.02 119.26 121.36 3i8b h ALA 468 Ca -0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3i8b h ALA 468 Cb 1.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 3i8b h ALA 468 CO 0.15 0.42 0.13 0.00 0.00 0.00 0.00 179.25 179.96 3i8b h ALA 469 N 1.03 1.10 0.12 0.00 0.00 -0.89 -0.39 119.26 120.23 3i8b h ALA 469 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3i8b h ALA 469 Cb 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3i8b h ALA 469 CO -0.00 0.60 -0.11 2.35 0.00 0.00 0.00 179.25 182.08 3i8b h TRP 470 N 0.91 -0.29 -0.20 0.00 7.01 -0.58 -0.73 115.95 122.07 3i8b h TRP 470 Ca 0.19 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.19 3i8b h TRP 470 Cb 0.34 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 3i8b h TRP 470 CO 0.02 -0.17 0.12 0.28 -2.79 0.00 0.00 178.44 175.89 3i8b h VAL 471 N -0.25 1.10 -0.76 2.65 2.07 -1.07 -2.63 116.25 117.35 3i8b h VAL 471 Ca 0.00 -0.25 0.07 0.00 0.82 0.00 0.00 66.70 67.35 3i8b h VAL 471 Cb 0.24 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 3i8b h VAL 471 CO -0.03 0.09 0.50 0.25 0.02 0.00 0.00 177.57 178.40 3i8b h LEU 472 N 0.23 0.69 -0.35 2.57 5.85 -0.95 -2.76 115.31 120.58 3i8b h LEU 472 Ca 0.07 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.63 3i8b h LEU 472 Cb 0.05 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3i8b h LEU 472 CO -0.01 0.44 -0.78 0.77 -0.34 0.00 0.00 178.44 178.52 3i8b h SER 473 N 0.78 0.00 0.00 1.25 4.64 -0.83 -3.47 113.55 115.92 3i8b h SER 473 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3i8b h SER 473 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3i8b h SER 473 CO -0.11 0.78 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 3i8b n GLY 474 N 0.85 0.48 3.87 -0.77 0.00 -1.02 -5.00 105.19 103.60 3i8b n GLY 474 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 3i8b n GLY 474 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i8b s GLU 475 N -0.51 3.62 0.17 1.61 2.02 -1.26 -5.00 118.70 119.36 3i8b s GLU 475 Ca 0.00 0.66 -0.06 0.00 0.02 0.00 0.00 54.97 55.59 3i8b s GLU 475 Cb 0.00 -2.15 0.05 0.00 0.10 0.00 0.00 34.13 32.13 3i8b s GLU 475 CO 0.00 -0.46 1.48 1.15 0.02 0.00 0.00 175.26 177.45 3i8b h THR 476 N -0.07 1.30 -2.89 3.63 2.02 -1.94 -3.44 112.91 111.52 3i8b h THR 476 Ca -0.45 -1.73 -0.63 0.00 0.77 0.00 0.00 66.41 64.38 3i8b h THR 476 Cb 1.19 1.66 -0.05 0.00 -1.74 0.00 0.00 68.15 69.22 3i8b h THR 476 CO 0.62 0.55 -0.50 -1.61 0.37 0.00 0.00 175.52 174.95 3i8b s GLU 477 N -4.11 3.42 0.74 6.66 0.41 -1.26 -5.09 118.70 119.47 3i8b s GLU 477 Ca -0.09 -0.41 -0.14 0.00 -0.41 0.00 0.00 54.97 53.93 3i8b s GLU 477 Cb 0.11 -3.05 0.05 0.00 -1.78 0.00 0.00 34.13 29.46 3i8b s GLU 477 CO 0.86 0.63 1.15 -1.25 -0.49 0.00 0.00 175.26 176.16 3i8b s PRO 478 N -2.32 2.19 -0.03 0.39 0.05 -1.26 -4.90 135.00 129.10 3i8b s PRO 478 Ca 0.32 1.54 -0.37 0.00 0.05 0.00 0.00 61.00 62.53 3i8b s PRO 478 Cb -0.13 -1.86 -0.16 0.00 0.05 0.00 0.00 34.50 32.40 3i8b s PRO 478 CO 0.25 -1.75 1.51 -2.30 0.05 0.00 0.00 177.00 174.76 3i8b n PRO 479 N -2.97 1.28 -1.79 0.56 -0.02 -1.26 -4.87 135.00 125.93 3i8b n PRO 479 Ca 0.12 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 3i8b n PRO 479 Cb 0.51 -2.14 -0.00 0.00 -0.02 0.00 0.00 33.50 31.85 3i8b n PRO 479 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i8b n ALA 480 N 3.70 5.30 -1.79 3.55 0.00 -1.26 -4.98 120.51 125.04 3i8b n ALA 480 Ca 0.21 -3.86 -0.36 0.00 0.00 0.00 0.00 53.44 49.43 3i8b n ALA 480 Cb 0.18 -3.55 -0.06 0.00 0.00 0.00 0.00 19.45 16.03 3i8b n ALA 480 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3i8b s TRP 481 N 3.36 3.55 0.29 0.00 0.51 -1.26 -5.01 118.94 120.37 3i8b s TRP 481 Ca 0.48 1.73 -0.30 0.00 -2.12 0.00 0.00 56.10 55.89 3i8b s TRP 481 Cb 0.13 -2.97 -0.11 0.00 -0.81 0.00 0.00 33.47 29.72 3i8b s TRP 481 CO -0.07 -0.03 1.53 -0.65 -0.51 0.00 0.00 176.95 177.22 3i8b s GLN 482 N -2.28 4.17 -0.12 4.98 -1.52 -1.26 -5.02 119.66 118.61 3i8b s GLN 482 Ca 0.53 2.49 -0.01 0.00 -1.95 0.00 0.00 55.36 56.42 3i8b s GLN 482 Cb -0.18 -3.04 -0.02 0.00 -0.22 0.00 0.00 33.01 29.54 3i8b s GLN 482 CO 0.24 -0.55 -0.07 -0.51 -0.25 0.00 0.00 175.29 174.14 3i8b s LEU 483 N -0.65 3.07 -0.15 2.90 1.43 -1.26 -5.04 118.68 118.97 3i8b s LEU 483 Ca 0.61 -0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 53.37 3i8b s LEU 483 Cb -0.46 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 3i8b s LEU 483 CO 0.48 0.23 0.53 -0.89 0.23 0.00 0.00 176.35 176.93 3i8b s THR 484 N -0.01 5.13 -0.16 5.49 2.01 -1.26 -5.06 115.64 121.78 3i8b s THR 484 Ca -0.01 1.02 -0.02 0.00 0.31 0.00 0.00 61.69 63.00 3i8b s THR 484 Cb -0.14 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.50 3i8b s THR 484 CO 0.03 0.24 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.48 3i8b s ILE 485 N 1.13 3.25 0.16 1.82 -1.09 -1.26 -0.90 121.20 124.32 3i8b s ILE 485 Ca 0.27 -0.57 -0.07 0.00 -2.23 0.00 0.00 60.65 58.05 3i8b s ILE 485 Cb -0.16 -2.41 -0.07 0.00 -1.58 0.00 0.00 42.46 38.24 3i8b s ILE 485 CO 0.11 0.49 1.46 0.44 -1.23 0.00 0.00 174.94 176.21 3i8b h ASP 486 N 7.17 0.78 0.00 3.58 3.32 -0.61 -3.44 116.42 127.22 3i8b h ASP 486 Ca -0.32 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.31 3i8b h ASP 486 Cb 1.19 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.52 3i8b h ASP 486 CO 0.59 1.17 0.00 0.61 -1.72 0.00 0.00 179.24 179.89 3i8b n GLY 487 N 0.31 0.71 3.06 2.75 0.00 -1.08 -5.02 105.19 105.91 3i8b n GLY 487 Ca -0.04 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 3i8b n GLY 487 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i8b s VAL 488 N -2.00 1.67 -0.15 1.61 1.01 -1.26 0.13 120.40 121.40 3i8b s VAL 488 Ca 0.00 -0.71 -0.20 0.00 0.00 0.00 0.00 61.98 61.07 3i8b s VAL 488 Cb 0.00 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 3i8b s VAL 488 CO 0.00 0.47 0.56 -1.61 0.00 0.00 0.00 175.10 174.53 3i8b s GLU 489 N 1.26 4.29 0.13 2.72 0.41 0.58 -4.92 118.70 123.18 3i8b s GLU 489 Ca 0.01 0.55 0.10 0.00 -0.41 0.00 0.00 54.97 55.22 3i8b s GLU 489 Cb -0.14 -3.50 -0.04 0.00 -1.78 0.00 0.00 34.13 28.67 3i8b s GLU 489 CO -0.08 -0.03 -0.25 0.95 -0.49 0.00 0.00 175.26 175.37 3i8b s THR 490 N 1.21 2.12 -0.29 3.63 -4.23 -1.26 -1.14 115.64 115.69 3i8b s THR 490 Ca 0.28 -1.75 -0.25 0.00 -1.18 0.00 0.00 61.69 58.79 3i8b s THR 490 Cb -0.16 -1.90 0.16 0.00 1.34 0.00 0.00 72.50 71.94 3i8b s THR 490 CO 0.11 0.01 1.24 -0.83 -0.54 0.00 0.00 174.62 174.62 3i8b s GLY 491 N -2.13 0.11 0.21 3.99 0.00 -1.26 -4.90 107.32 103.35 3i8b s GLY 491 Ca 0.13 3.11 -0.32 0.00 0.00 0.00 0.00 44.72 47.64 3i8b s GLY 491 CO 0.06 1.88 1.55 1.18 0.00 0.00 0.00 173.10 177.77 3i8b n GLU 492 N 1.86 2.30 -1.81 2.90 -0.58 -1.26 -3.97 120.64 120.08 3i8b n GLU 492 Ca -0.11 0.83 -0.41 0.00 -0.42 0.00 0.00 57.16 57.04 3i8b n GLU 492 Cb 0.56 -2.58 -0.02 0.00 -0.57 0.00 0.00 31.44 28.84 3i8b n GLU 492 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 3i8b s PRO 493 N 0.31 4.14 -0.48 3.49 0.02 -1.26 -4.28 135.00 136.94 3i8b s PRO 493 Ca 0.72 2.54 0.03 0.00 0.02 0.00 0.00 61.00 64.32 3i8b s PRO 493 Cb -0.61 -3.03 0.13 0.00 0.02 0.00 0.00 34.50 31.00 3i8b s PRO 493 CO 0.42 -0.60 0.23 0.95 -0.33 0.00 0.00 177.00 177.68 3i8b s THR 494 N -0.06 2.21 0.32 0.99 -4.23 -0.79 -4.98 115.64 109.09 3i8b s THR 494 Ca 0.62 -3.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.24 3i8b s THR 494 Cb -0.47 -2.55 0.04 0.00 1.34 0.00 0.00 72.50 70.86 3i8b s THR 494 CO 0.48 -0.81 1.72 -0.08 -0.54 0.00 0.00 174.62 175.40 3i8b h GLU 495 N 6.68 0.06 0.00 3.99 4.57 -1.95 -3.04 114.58 124.90 3i8b h GLU 495 Ca -0.06 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 3i8b h GLU 495 Cb 0.91 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 3i8b h GLU 495 CO 0.62 0.51 -0.07 0.00 -1.18 0.00 0.00 179.01 178.89 3i8b h ALA 496 N 1.48 1.74 0.93 2.92 0.00 -1.98 -0.45 119.26 123.90 3i8b h ALA 496 Ca 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3i8b h ALA 496 Cb 0.84 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.63 3i8b h ALA 496 CO 0.06 0.09 -0.45 0.28 0.00 0.00 0.00 179.25 179.23 3i8b h VAL 497 N 0.00 0.08 -0.27 0.00 2.07 -1.89 -1.39 116.25 114.85 3i8b h VAL 497 Ca -0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 3i8b h VAL 497 Cb 0.14 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 3i8b h VAL 497 CO 0.01 0.00 -0.07 0.22 0.02 0.00 0.00 177.57 177.75 3i8b h TYR 498 N -1.25 0.46 -0.79 1.57 3.20 -1.63 -2.15 116.97 116.36 3i8b h TYR 498 Ca -0.13 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.67 3i8b h TYR 498 Cb 0.96 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 39.07 3i8b h TYR 498 CO -0.01 0.51 0.41 0.93 -1.64 0.00 0.00 178.16 178.36 3i8b h GLU 499 N 0.42 1.12 -0.46 1.82 5.08 -0.99 0.11 114.58 121.68 3i8b h GLU 499 Ca 0.08 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 3i8b h GLU 499 Cb 0.39 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 3i8b h GLU 499 CO 0.02 0.84 -0.05 0.00 -1.00 0.00 0.00 179.01 178.82 3i8b h ALA 500 N 1.33 0.62 -0.48 3.43 0.00 -0.97 -2.55 119.26 120.64 3i8b h ALA 500 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3i8b h ALA 500 Cb 0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3i8b h ALA 500 CO -0.04 0.46 0.30 -0.92 0.00 0.00 0.00 179.25 179.05 3i8b h TYR 501 N 0.68 0.62 -0.49 0.00 5.03 -0.91 -1.73 116.97 120.17 3i8b h TYR 501 Ca 0.12 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.42 3i8b h TYR 501 Cb 0.57 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.62 3i8b h TYR 501 CO 0.04 0.42 0.25 0.00 -1.32 0.00 0.00 178.16 177.56 3i8b h ALA 502 N 1.15 0.64 0.07 1.82 0.00 -0.71 -0.64 119.26 121.58 3i8b h ALA 502 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3i8b h ALA 502 Cb -0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 3i8b h ALA 502 CO -0.03 0.18 -0.29 0.87 0.00 0.00 0.00 179.25 179.97 3i8b h LYS 503 N 0.66 -0.46 -0.44 0.00 1.57 -1.26 -1.84 116.57 114.79 3i8b h LYS 503 Ca 0.17 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.04 3i8b h LYS 503 Cb 0.09 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.45 3i8b h LYS 503 CO -0.02 -0.31 0.15 0.00 -0.57 0.00 0.00 179.45 178.69 3i8b h ALA 504 N 0.25 0.52 0.00 3.86 0.00 -0.84 -2.12 119.26 120.93 3i8b h ALA 504 Ca 0.04 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3i8b h ALA 504 Cb 0.53 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3i8b h ALA 504 CO -0.21 -0.24 -0.06 0.07 0.00 0.00 0.00 179.25 178.81 3i8b h ARG 505 N 0.31 0.00 0.00 0.00 -0.00 -1.03 -3.50 114.38 110.16 3i8b h ARG 505 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.19 3i8b h ARG 505 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.18 3i8b h ARG 505 CO -0.22 0.06 0.00 0.41 -0.00 0.00 0.00 179.97 180.22