#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8n n THR 3 N 0.41 0.00 -4.51 0.00 -2.24 -1.26 -4.99 114.28 101.70 1x8n n THR 3 Ca -0.03 -0.18 -0.34 0.00 -2.27 0.00 0.00 64.05 61.22 1x8n n THR 3 Cb 0.52 1.33 -0.12 0.00 -2.10 0.00 0.00 70.33 69.97 1x8n n THR 3 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1x8n s LYS 4 N -0.18 3.23 -0.83 -0.78 -0.14 -1.26 -5.04 119.74 114.74 1x8n s LYS 4 Ca 0.00 -0.53 -0.17 0.00 -1.36 0.00 0.00 55.97 53.91 1x8n s LYS 4 Cb 0.00 -2.76 0.15 0.00 -1.68 0.00 0.00 37.83 33.54 1x8n s LYS 4 CO 0.00 0.45 0.93 1.21 -0.76 0.00 0.00 175.35 177.18 1x8n s ASN 5 N -0.21 6.59 0.33 2.83 2.47 -1.26 -5.04 114.94 120.64 1x8n s ASN 5 Ca 0.03 -2.14 -0.29 0.00 0.42 0.00 0.00 52.86 50.89 1x8n s ASN 5 Cb -0.13 -2.32 -0.10 0.00 -1.45 0.00 0.00 41.25 37.25 1x8n s ASN 5 CO 0.02 -0.91 1.25 0.00 -3.72 0.00 0.00 177.10 173.74 1x8n s ALA 6 N 1.86 3.45 -0.19 1.71 0.00 -1.26 -4.99 121.76 122.33 1x8n s ALA 6 Ca 0.24 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 53.21 1x8n s ALA 6 Cb -0.10 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 1x8n s ALA 6 CO -0.06 -0.52 0.30 0.42 0.00 0.00 0.00 175.76 175.90 1x8n s ILE 7 N -1.17 5.28 0.63 0.00 -1.09 -1.26 -5.01 121.20 118.57 1x8n s ILE 7 Ca 0.49 0.53 -0.16 0.00 -2.23 0.00 0.00 60.65 59.27 1x8n s ILE 7 Cb -0.37 -3.64 -0.02 0.00 -1.58 0.00 0.00 42.46 36.85 1x8n s ILE 7 CO 0.49 0.33 1.11 0.00 -1.23 0.00 0.00 174.94 175.63 1x8n s ALA 8 N 0.92 2.55 0.17 9.38 0.00 -1.26 -4.35 121.76 129.16 1x8n s ALA 8 Ca 0.15 0.59 -0.33 0.00 0.00 0.00 0.00 51.96 52.37 1x8n s ALA 8 Cb -0.14 -3.32 -0.13 0.00 0.00 0.00 0.00 23.12 19.53 1x8n s ALA 8 CO 0.05 -1.11 1.61 0.94 0.00 0.00 0.00 175.76 177.25 1x8n n GLN 9 N -2.14 2.28 -1.75 0.00 7.27 -0.17 -4.91 117.38 117.96 1x8n n GLN 9 Ca 0.10 0.82 -0.42 0.00 0.07 0.00 0.00 57.00 57.58 1x8n n GLN 9 Cb 0.52 -2.61 -0.03 0.00 2.41 0.00 0.00 30.24 30.53 1x8n n GLN 9 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1x8n s THR 10 N 1.01 2.22 -0.83 1.69 2.01 -1.26 -2.24 115.64 118.23 1x8n s THR 10 Ca 0.78 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.86 1x8n s THR 10 Cb -0.64 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 68.81 1x8n s THR 10 CO 0.37 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.91 1x8n n GLY 11 N 4.01 0.93 3.59 4.40 0.00 -1.26 -4.94 105.19 111.91 1x8n n GLY 11 Ca 0.16 -0.67 -0.51 0.00 0.00 0.00 0.00 46.02 45.00 1x8n n GLY 11 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1x8n n PHE 12 N -2.86 1.51 -3.34 1.61 7.35 -0.95 -4.91 117.46 115.86 1x8n n PHE 12 Ca -0.08 0.63 -0.46 0.00 -0.76 0.00 0.00 57.45 56.78 1x8n n PHE 12 Cb 0.28 -2.33 -0.03 0.00 0.35 0.00 0.00 39.48 37.75 1x8n n PHE 12 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1x8n s ASN 13 N 0.41 6.50 0.19 -2.13 3.84 -1.26 -4.94 114.94 117.54 1x8n s ASN 13 Ca 0.82 -2.40 -0.10 0.00 0.21 0.00 0.00 52.86 51.39 1x8n s ASN 13 Cb -0.92 -2.19 0.10 0.00 -0.55 0.00 0.00 41.25 37.69 1x8n s ASN 13 CO 0.47 -0.66 1.73 0.50 -2.79 0.00 0.00 177.10 176.36 1x8n h LYS 14 N 8.12 1.01 -0.14 0.43 3.64 -2.00 -2.54 116.57 125.09 1x8n h LYS 14 Ca -0.03 -0.20 -0.08 0.00 -1.27 0.00 0.00 60.65 59.06 1x8n h LYS 14 Cb 1.06 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1x8n h LYS 14 CO 0.84 0.87 -0.27 -0.44 -2.27 0.00 0.00 179.45 178.18 1x8n h ASP 15 N 0.95 0.26 -0.30 4.20 3.32 -1.92 0.24 116.42 123.17 1x8n h ASP 15 Ca 0.22 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1x8n h ASP 15 Cb 0.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1x8n h ASP 15 CO -0.01 0.53 -0.24 0.11 -1.72 0.00 0.00 179.24 177.91 1x8n h LYS 16 N 0.23 0.70 -0.12 3.56 1.57 -1.96 -3.16 116.57 117.38 1x8n h LYS 16 Ca 0.04 -0.35 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 1x8n h LYS 16 Cb 0.61 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 1x8n h LYS 16 CO 0.04 0.96 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.92 1x8n h TYR 17 N 0.44 0.28 -1.45 -1.35 3.20 -1.18 -3.27 116.97 113.64 1x8n h TYR 17 Ca 0.05 -0.06 -0.73 0.00 3.14 0.00 0.00 58.73 61.13 1x8n h TYR 17 Cb 0.80 -0.07 -0.17 0.00 1.54 0.00 0.00 36.73 38.83 1x8n h TYR 17 CO 0.07 0.56 1.75 1.19 -1.64 0.00 0.00 178.16 180.08 1x8n n PHE 18 N -4.72 2.52 -0.04 -3.82 3.72 0.05 -4.63 117.46 110.54 1x8n n PHE 18 Ca -0.06 -2.61 0.11 0.00 -0.05 0.00 0.00 57.45 54.84 1x8n n PHE 18 Cb 0.26 -1.59 0.25 0.00 -0.94 0.00 0.00 39.48 37.46 1x8n n PHE 18 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1x8n n ASN 19 N 1.06 3.59 0.00 4.37 6.94 -1.13 -3.75 115.26 126.35 1x8n n ASN 19 Ca 0.57 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 53.15 1x8n n ASN 19 Cb 0.29 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.36 1x8n n ASN 19 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x8n n GLY 20 N 1.44 0.87 4.00 4.83 0.00 0.50 -4.96 105.19 111.86 1x8n n GLY 20 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1x8n n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x8n s ASP 21 N -2.89 4.56 -0.05 1.61 2.15 -1.24 -4.69 116.67 116.12 1x8n s ASP 21 Ca 0.00 -0.39 -0.10 0.00 0.43 0.00 0.00 52.55 52.50 1x8n s ASP 21 Cb 0.00 -0.08 -0.05 0.00 -0.30 0.00 0.00 42.92 42.49 1x8n s ASP 21 CO 0.00 -1.70 0.26 -0.69 -0.17 0.00 0.00 175.17 172.87 1x8n s VAL 22 N -3.03 5.30 -0.10 1.11 1.01 -1.26 -2.64 120.40 120.78 1x8n s VAL 22 Ca 0.65 0.42 0.03 0.00 0.00 0.00 0.00 61.98 63.07 1x8n s VAL 22 Cb -0.06 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1x8n s VAL 22 CO 0.43 0.55 -0.20 0.26 0.00 0.00 0.00 175.10 176.14 1x8n s TRP 23 N -1.11 2.64 -0.14 5.22 0.52 0.79 -4.61 118.94 122.25 1x8n s TRP 23 Ca 0.21 -0.83 -0.07 0.00 0.02 0.00 0.00 56.10 55.42 1x8n s TRP 23 Cb -0.14 -1.74 -0.04 0.00 -1.15 0.00 0.00 33.47 30.40 1x8n s TRP 23 CO 0.10 -0.30 0.12 0.71 0.02 0.00 0.00 176.95 177.60 1x8n s TYR 24 N 0.25 3.49 -0.11 -1.98 2.02 -0.22 -0.92 117.35 119.87 1x8n s TYR 24 Ca -0.13 0.42 -0.30 0.00 -0.37 0.00 0.00 57.07 56.69 1x8n s TYR 24 Cb -0.17 -1.99 -0.03 0.00 -0.40 0.00 0.00 41.96 39.38 1x8n s TYR 24 CO 0.07 0.56 1.29 0.08 -1.57 0.00 0.00 175.55 175.99 1x8n s VAL 25 N -0.59 4.16 -0.11 0.71 1.01 -0.52 -1.29 120.40 123.77 1x8n s VAL 25 Ca 0.12 1.44 0.18 0.00 0.00 0.00 0.00 61.98 63.73 1x8n s VAL 25 Cb -0.12 -3.93 -0.27 0.00 0.00 0.00 0.00 36.38 32.06 1x8n s VAL 25 CO 0.02 -0.08 0.25 0.35 0.00 0.00 0.00 175.10 175.64 1x8n n THR 26 N 5.13 0.64 -3.70 3.92 -2.24 -0.05 -4.68 114.28 113.29 1x8n n THR 26 Ca 0.13 -0.63 -0.14 0.00 -2.27 0.00 0.00 64.05 61.14 1x8n n THR 26 Cb 0.45 -0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 68.37 1x8n n THR 26 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x8n s ASP 27 N -4.81 -0.36 0.06 3.42 1.11 -1.20 -0.98 116.67 113.91 1x8n s ASP 27 Ca -0.08 0.41 -0.04 0.00 0.18 0.00 0.00 52.55 53.01 1x8n s ASP 27 Cb 0.09 0.50 -0.02 0.00 1.07 0.00 0.00 42.92 44.56 1x8n s ASP 27 CO 0.80 -0.42 0.07 -0.72 1.18 0.00 0.00 175.17 176.08 1x8n s TYR 28 N -0.95 0.32 -0.09 4.23 1.13 -0.12 -0.93 117.35 120.94 1x8n s TYR 28 Ca -0.10 -0.77 -0.03 0.00 -1.41 0.00 0.00 57.07 54.76 1x8n s TYR 28 Cb -0.04 -0.22 0.04 0.00 -1.10 0.00 0.00 41.96 40.65 1x8n s TYR 28 CO 0.05 -0.43 0.08 -1.17 -2.51 0.00 0.00 175.55 171.57 1x8n s LEU 29 N -2.68 0.19 -0.25 -3.49 2.96 -0.25 -0.31 118.68 114.86 1x8n s LEU 29 Ca 0.03 -0.15 -0.10 0.00 -0.22 0.00 0.00 54.13 53.69 1x8n s LEU 29 Cb 0.04 -0.14 -0.05 0.00 0.50 0.00 0.00 46.19 46.55 1x8n s LEU 29 CO -0.09 -0.29 0.14 -0.62 -1.32 0.00 0.00 176.35 174.18 1x8n s ASP 30 N 2.17 5.88 0.46 3.68 3.68 -1.26 -0.74 116.67 130.53 1x8n s ASP 30 Ca 0.04 0.02 0.31 0.00 2.13 0.00 0.00 52.55 55.05 1x8n s ASP 30 Cb -0.13 -2.07 1.27 0.00 -1.45 0.00 0.00 42.92 40.54 1x8n s ASP 30 CO -0.05 0.03 1.91 -0.07 0.13 0.00 0.00 175.17 177.11 1x8n h LEU 31 N 7.78 0.00 -9.71 -1.34 3.38 -1.42 -3.44 115.31 110.56 1x8n h LEU 31 Ca -0.37 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.98 1x8n h LEU 31 Cb 1.18 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 1x8n h LEU 31 CO 0.62 0.00 -0.29 -1.61 0.09 0.00 0.00 178.44 177.25 1x8n s GLU 32 N -3.57 3.75 0.12 1.13 2.02 -1.26 -4.98 118.70 115.91 1x8n s GLU 32 Ca 0.02 0.20 -0.32 0.00 0.02 0.00 0.00 54.97 54.89 1x8n s GLU 32 Cb 0.09 -3.15 -0.12 0.00 0.10 0.00 0.00 34.13 31.05 1x8n s GLU 32 CO 0.49 0.68 1.77 -0.35 0.02 0.00 0.00 175.26 177.87 1x8n n PRO 33 N 1.58 2.58 -3.98 0.39 -0.04 -1.26 -3.42 135.00 130.85 1x8n n PRO 33 Ca -0.14 0.94 -0.33 0.00 -0.04 0.00 0.00 63.50 63.93 1x8n n PRO 33 Cb 0.53 -2.79 0.01 0.00 -0.04 0.00 0.00 33.50 31.21 1x8n n PRO 33 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1x8n n ASP 34 N 5.04 -2.68 0.10 3.54 9.92 -1.26 -4.85 116.55 126.36 1x8n n ASP 34 Ca 0.18 -0.93 -0.23 0.00 -0.53 0.00 0.00 54.79 53.29 1x8n n ASP 34 Cb 0.34 -1.11 -0.15 0.00 -0.64 0.00 0.00 41.12 39.56 1x8n n ASP 34 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 1x8n h ASP 35 N -0.97 0.68 -4.23 -2.24 3.58 -1.95 -3.47 116.42 107.82 1x8n h ASP 35 Ca -0.50 -0.86 -0.29 0.00 0.42 0.00 0.00 57.03 55.79 1x8n h ASP 35 Cb 0.99 -0.22 -0.15 0.00 1.72 0.00 0.00 39.33 41.67 1x8n h ASP 35 CO 0.37 1.71 -0.70 0.68 -2.88 0.00 0.00 179.24 178.42 1x8n s VAL 36 N -2.59 0.96 0.69 2.25 -7.23 -1.26 -5.08 120.40 108.14 1x8n s VAL 36 Ca -0.12 -2.01 -0.15 0.00 -1.81 0.00 0.00 61.98 57.89 1x8n s VAL 36 Cb 0.05 -1.82 0.02 0.00 0.56 0.00 0.00 36.38 35.18 1x8n s VAL 36 CO 0.89 -0.76 1.15 -2.84 -0.31 0.00 0.00 175.10 173.23 1x8n s PRO 37 N -3.79 2.52 0.34 4.82 0.02 -1.26 -4.93 135.00 132.72 1x8n s PRO 37 Ca 0.16 1.53 0.17 0.00 0.02 0.00 0.00 61.00 62.88 1x8n s PRO 37 Cb 0.04 -1.90 0.54 0.00 0.02 0.00 0.00 34.50 33.19 1x8n s PRO 37 CO -0.01 -1.49 1.67 -0.22 -0.33 0.00 0.00 177.00 176.62 1x8n h LYS 38 N -0.12 0.00 -5.10 5.54 3.64 -2.01 -3.41 116.57 115.12 1x8n h LYS 38 Ca -0.47 0.00 -0.66 0.00 -1.27 0.00 0.00 60.65 58.25 1x8n h LYS 38 Cb 1.26 0.00 -0.29 0.00 -0.41 0.00 0.00 32.23 32.79 1x8n h LYS 38 CO 0.52 0.45 -0.77 1.03 -2.27 0.00 0.00 179.45 178.41 1x8n s ARG 39 N -3.52 3.29 -0.04 1.90 0.52 -1.26 -4.94 118.95 114.90 1x8n s ARG 39 Ca 0.00 -0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 54.22 1x8n s ARG 39 Cb 0.11 -2.80 0.07 0.00 0.52 0.00 0.00 34.95 32.85 1x8n s ARG 39 CO 0.71 -0.09 0.67 -0.47 0.02 0.00 0.00 175.30 176.15 1x8n s TYR 40 N 1.12 -0.65 -0.13 -0.53 6.14 -1.26 -4.45 117.35 117.58 1x8n s TYR 40 Ca 0.01 1.08 0.02 0.00 0.64 0.00 0.00 57.07 58.81 1x8n s TYR 40 Cb -0.14 0.42 0.02 0.00 0.42 0.00 0.00 41.96 42.67 1x8n s TYR 40 CO -0.03 -0.62 -0.17 0.00 0.64 0.00 0.00 175.55 175.37 1x8n s ALA 42 N 1.07 -0.37 0.19 0.00 0.00 -1.26 -0.91 121.76 120.48 1x8n s ALA 42 Ca -0.03 -0.17 -0.16 0.00 0.00 0.00 0.00 51.96 51.61 1x8n s ALA 42 Cb -0.14 0.18 0.02 0.00 0.00 0.00 0.00 23.12 23.17 1x8n s ALA 42 CO -0.05 -0.28 0.48 0.00 0.00 0.00 0.00 175.76 175.92 1x8n s ALA 43 N -1.88 -0.72 0.09 0.00 0.00 -0.67 -1.44 121.76 117.14 1x8n s ALA 43 Ca -0.11 -0.39 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 1x8n s ALA 43 Cb -0.05 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.95 1x8n s ALA 43 CO -0.00 -0.78 0.25 -0.48 0.00 0.00 0.00 175.76 174.74 1x8n s LEU 44 N -2.90 1.14 0.10 0.00 2.34 -0.09 -1.00 118.68 118.27 1x8n s LEU 44 Ca 0.11 -0.50 0.07 0.00 0.06 0.00 0.00 54.13 53.87 1x8n s LEU 44 Cb -0.00 1.23 -0.04 0.00 -0.56 0.00 0.00 46.19 46.82 1x8n s LEU 44 CO -0.01 -0.73 -0.11 0.00 -1.06 0.00 0.00 176.35 174.44 1x8n s ALA 45 N -3.58 2.90 -0.04 1.48 0.00 0.29 -0.15 121.76 122.65 1x8n s ALA 45 Ca 0.02 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.71 1x8n s ALA 45 Cb 0.03 -0.85 0.03 0.00 0.00 0.00 0.00 23.12 22.33 1x8n s ALA 45 CO -0.10 0.63 0.09 0.00 0.00 0.00 0.00 175.76 176.38 1x8n s ALA 46 N -1.19 -0.06 0.03 0.00 0.00 -1.08 -1.09 121.76 118.36 1x8n s ALA 46 Ca 0.21 0.47 -0.29 0.00 0.00 0.00 0.00 51.96 52.34 1x8n s ALA 46 Cb -0.11 -0.40 0.10 0.00 0.00 0.00 0.00 23.12 22.72 1x8n s ALA 46 CO 0.13 -0.19 1.20 0.20 0.00 0.00 0.00 175.76 177.10 1x8n s GLY 47 N 1.28 -0.35 -0.14 0.00 0.00 -0.57 -0.37 107.32 107.16 1x8n s GLY 47 Ca -0.07 0.50 -0.13 0.00 0.00 0.00 0.00 44.72 45.02 1x8n s GLY 47 CO -0.04 0.34 0.29 -1.59 0.00 0.00 0.00 173.10 172.09 1x8n s THR 48 N -2.61 5.30 -0.16 0.90 2.01 -1.25 -0.60 115.64 119.23 1x8n s THR 48 Ca 0.14 0.54 -0.00 0.00 0.31 0.00 0.00 61.69 62.68 1x8n s THR 48 Cb 0.03 -3.62 0.04 0.00 0.01 0.00 0.00 72.50 68.96 1x8n s THR 48 CO -0.02 0.43 -0.07 0.00 -0.69 0.00 0.00 174.62 174.27 1x8n s ALA 49 N 0.19 1.55 -1.41 7.40 0.00 0.09 -4.75 121.76 124.83 1x8n s ALA 49 Ca 0.17 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 1x8n s ALA 49 Cb -0.13 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.88 1x8n s ALA 49 CO 0.05 -0.72 0.39 0.43 0.00 0.00 0.00 175.76 175.91 1x8n n SER 50 N 4.85 -0.33 0.00 0.00 7.64 -1.26 -1.39 113.62 123.14 1x8n n SER 50 Ca -0.13 -1.03 0.00 0.00 1.01 0.00 0.00 58.87 58.73 1x8n n SER 50 Cb 0.48 -2.95 0.00 0.00 -1.01 0.00 0.00 64.21 60.73 1x8n n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x8n n GLY 51 N -2.02 2.44 3.65 0.23 0.00 -1.26 -5.02 105.19 103.20 1x8n n GLY 51 Ca -0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1x8n n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8n s LYS 52 N -0.11 3.70 -0.14 1.61 -0.14 -0.48 -5.07 119.74 119.10 1x8n s LYS 52 Ca 0.00 -0.36 -0.29 0.00 -1.36 0.00 0.00 55.97 53.96 1x8n s LYS 52 Cb 0.00 -3.09 -0.02 0.00 -1.68 0.00 0.00 37.83 33.04 1x8n s LYS 52 CO 0.00 0.40 1.21 -1.17 -0.76 0.00 0.00 175.35 175.03 1x8n s LEU 53 N -0.00 4.20 0.08 3.17 2.96 -1.26 -0.73 118.68 127.10 1x8n s LEU 53 Ca 0.05 1.67 0.05 0.00 -0.22 0.00 0.00 54.13 55.68 1x8n s LEU 53 Cb -0.12 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1x8n s LEU 53 CO 0.01 -0.69 -0.13 -0.54 -1.32 0.00 0.00 176.35 173.68 1x8n s LYS 54 N 3.09 0.83 0.03 1.98 -0.14 0.23 -0.86 119.74 124.90 1x8n s LYS 54 Ca 0.53 -1.01 0.04 0.00 -1.36 0.00 0.00 55.97 54.17 1x8n s LYS 54 Cb -0.21 -0.76 -0.02 0.00 -1.68 0.00 0.00 37.83 35.15 1x8n s LYS 54 CO 0.15 0.16 -0.11 -1.21 -0.76 0.00 0.00 175.35 173.58 1x8n s GLU 55 N -2.01 0.78 -0.10 1.68 2.02 0.01 -1.51 118.70 119.57 1x8n s GLU 55 Ca 0.00 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.41 1x8n s GLU 55 Cb -0.08 -0.73 -0.01 0.00 0.10 0.00 0.00 34.13 33.41 1x8n s GLU 55 CO 0.02 0.18 -0.21 0.00 0.02 0.00 0.00 175.26 175.27 1x8n s ALA 56 N -0.74 2.29 0.14 5.21 0.00 -0.25 0.20 121.76 128.61 1x8n s ALA 56 Ca -0.00 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.08 1x8n s ALA 56 Cb -0.07 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 1x8n s ALA 56 CO 0.01 0.31 -0.12 -0.51 0.00 0.00 0.00 175.76 175.44 1x8n s LEU 57 N 0.23 2.91 -0.04 0.00 1.43 0.17 -0.55 118.68 122.83 1x8n s LEU 57 Ca -0.14 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.45 1x8n s LEU 57 Cb -0.17 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1x8n s LEU 57 CO 0.07 0.15 -0.04 -0.47 0.23 0.00 0.00 176.35 176.29 1x8n s TYR 58 N -1.39 0.62 -0.03 0.29 5.04 -0.17 -1.69 117.35 120.02 1x8n s TYR 58 Ca 0.22 -0.15 0.06 0.00 -2.44 0.00 0.00 57.07 54.76 1x8n s TYR 58 Cb -0.10 -0.57 -0.01 0.00 0.35 0.00 0.00 41.96 41.63 1x8n s TYR 58 CO 0.13 -0.15 -0.19 -1.01 -1.34 0.00 0.00 175.55 172.98 1x8n s HIS 59 N 0.81 1.80 -0.12 4.97 3.76 -0.36 -1.66 115.29 124.50 1x8n s HIS 59 Ca -0.10 -0.40 -0.05 0.00 -0.15 0.00 0.00 55.06 54.36 1x8n s HIS 59 Cb -0.13 -1.17 0.06 0.00 1.11 0.00 0.00 32.58 32.44 1x8n s HIS 59 CO -0.00 -0.08 0.26 -0.47 -0.85 0.00 0.00 174.74 173.59 1x8n s TYR 60 N -0.31 -0.38 -0.43 1.40 5.04 -0.09 -1.64 117.35 120.94 1x8n s TYR 60 Ca 0.04 0.88 -0.22 0.00 -2.44 0.00 0.00 57.07 55.33 1x8n s TYR 60 Cb -0.09 0.00 0.02 0.00 0.35 0.00 0.00 41.96 42.24 1x8n s TYR 60 CO 0.00 -0.30 0.71 0.34 -1.34 0.00 0.00 175.55 174.97 1x8n s ASP 61 N 1.86 6.38 0.07 4.32 -1.08 -0.12 -1.03 116.67 127.07 1x8n s ASP 61 Ca -0.04 -0.15 0.17 0.00 -0.52 0.00 0.00 52.55 52.01 1x8n s ASP 61 Cb -0.11 -2.35 0.73 0.00 -1.46 0.00 0.00 42.92 39.73 1x8n s ASP 61 CO -0.09 -0.81 1.55 -0.81 0.52 0.00 0.00 175.17 175.53 1x8n n PRO 62 N 6.44 0.05 -0.13 4.34 -0.04 -1.26 -0.53 135.00 143.87 1x8n n PRO 62 Ca 0.00 0.29 -0.28 0.00 -0.04 0.00 0.00 63.50 63.47 1x8n n PRO 62 Cb 0.48 -1.60 -0.10 0.00 -0.04 0.00 0.00 33.50 32.24 1x8n n PRO 62 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1x8n n LYS 63 N -1.70 0.58 0.15 0.54 4.76 -1.26 -4.58 118.16 116.65 1x8n n LYS 63 Ca 0.03 0.31 0.12 0.00 -2.87 0.00 0.00 58.31 55.91 1x8n n LYS 63 Cb 0.19 -1.53 0.22 0.00 -1.84 0.00 0.00 35.03 32.07 1x8n n LYS 63 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1x8n h THR 64 N -1.00 0.00 0.00 -0.18 1.35 -1.96 -3.47 112.91 107.65 1x8n h THR 64 Ca -0.63 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 1x8n h THR 64 Cb 1.55 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 1x8n h THR 64 CO -0.38 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 174.89 1x8n n GLN 65 N -2.67 -0.04 -1.70 4.72 1.13 0.31 -4.99 117.38 114.13 1x8n n GLN 65 Ca 0.04 0.01 -0.43 0.00 -1.94 0.00 0.00 57.00 54.68 1x8n n GLN 65 Cb 0.49 -2.83 -0.02 0.00 0.11 0.00 0.00 30.24 28.00 1x8n n GLN 65 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1x8n n ASP 66 N -0.02 3.05 -3.68 1.08 2.03 -1.25 -4.75 116.55 113.02 1x8n n ASP 66 Ca 0.00 1.17 -0.15 0.00 0.52 0.00 0.00 54.79 56.33 1x8n n ASP 66 Cb 0.01 -1.49 -0.08 0.00 -0.72 0.00 0.00 41.12 38.84 1x8n n ASP 66 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1x8n s THR 67 N -0.39 0.04 -0.06 5.18 -1.32 -1.26 -0.95 115.64 116.87 1x8n s THR 67 Ca 0.63 -0.30 -0.30 0.00 -1.21 0.00 0.00 61.69 60.50 1x8n s THR 67 Cb -0.58 -0.75 0.08 0.00 -1.51 0.00 0.00 72.50 69.74 1x8n s THR 67 CO 0.54 -0.17 0.75 0.72 -2.21 0.00 0.00 174.62 174.25 1x8n s PHE 68 N -1.24 -0.59 0.17 9.09 -0.71 -0.65 -5.02 117.98 119.04 1x8n s PHE 68 Ca -0.12 0.98 0.08 0.00 -1.04 0.00 0.00 56.93 56.82 1x8n s PHE 68 Cb -0.03 0.43 -0.04 0.00 -1.21 0.00 0.00 43.02 42.16 1x8n s PHE 68 CO 0.06 -0.56 -0.04 0.71 -1.34 0.00 0.00 175.22 174.05 1x8n s TYR 69 N -1.31 2.77 0.02 3.49 1.51 -1.24 -1.22 117.35 121.38 1x8n s TYR 69 Ca -0.08 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1x8n s TYR 69 Cb -0.00 -1.35 -0.02 0.00 -0.11 0.00 0.00 41.96 40.48 1x8n s TYR 69 CO 0.07 0.51 -0.02 -0.51 -1.11 0.00 0.00 175.55 174.50 1x8n s ASP 70 N -2.88 0.24 -0.04 2.29 1.11 -0.68 -1.57 116.67 115.15 1x8n s ASP 70 Ca 0.26 -0.52 0.06 0.00 0.18 0.00 0.00 52.55 52.53 1x8n s ASP 70 Cb -0.09 0.12 -0.01 0.00 1.07 0.00 0.00 42.92 44.00 1x8n s ASP 70 CO 0.17 -0.34 -0.23 -0.69 1.18 0.00 0.00 175.17 175.26 1x8n s VAL 71 N -1.69 1.90 -0.08 -1.27 1.01 -0.40 -0.66 120.40 119.21 1x8n s VAL 71 Ca -0.14 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 60.84 1x8n s VAL 71 Cb -0.08 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.73 1x8n s VAL 71 CO -0.02 0.53 -0.04 -0.44 0.00 0.00 0.00 175.10 175.14 1x8n s SER 72 N -0.29 1.63 -0.23 3.32 0.01 0.13 -1.67 113.70 116.60 1x8n s SER 72 Ca 0.01 -0.17 -0.20 0.00 1.31 0.00 0.00 55.95 56.91 1x8n s SER 72 Cb -0.12 -0.58 -0.02 0.00 0.21 0.00 0.00 66.02 65.50 1x8n s SER 72 CO 0.02 -0.13 0.58 -1.61 0.41 0.00 0.00 173.24 172.52 1x8n s GLU 73 N 1.57 4.15 -0.08 12.44 2.02 -1.26 -0.81 118.70 136.73 1x8n s GLU 73 Ca 0.00 0.50 -0.17 0.00 0.02 0.00 0.00 54.97 55.32 1x8n s GLU 73 Cb -0.13 -3.61 -0.05 0.00 0.10 0.00 0.00 34.13 30.44 1x8n s GLU 73 CO -0.04 -0.30 0.44 -0.51 0.02 0.00 0.00 175.26 174.86 1x8n s LEU 74 N 2.13 4.35 -0.02 1.80 1.02 -0.04 -3.05 118.68 124.86 1x8n s LEU 74 Ca 0.25 0.84 -0.03 0.00 0.02 0.00 0.00 54.13 55.22 1x8n s LEU 74 Cb -0.16 -2.63 -0.04 0.00 0.02 0.00 0.00 46.19 43.38 1x8n s LEU 74 CO 0.09 0.13 0.15 -1.10 0.02 0.00 0.00 176.35 175.64 1x8n s GLN 75 N -0.00 3.35 -0.14 1.70 -1.52 0.06 -4.62 119.66 118.48 1x8n s GLN 75 Ca 0.24 -0.34 -0.20 0.00 -1.95 0.00 0.00 55.36 53.12 1x8n s GLN 75 Cb -0.16 -3.05 -0.03 0.00 -0.22 0.00 0.00 33.01 29.55 1x8n s GLN 75 CO 0.11 0.68 0.57 0.08 -0.25 0.00 0.00 175.29 176.48 1x8n s VAL 76 N -1.25 5.10 -0.21 1.09 1.01 -1.26 -1.54 120.40 123.34 1x8n s VAL 76 Ca 0.25 1.12 0.02 0.00 0.00 0.00 0.00 61.98 63.36 1x8n s VAL 76 Cb -0.12 -3.90 -0.20 0.00 0.00 0.00 0.00 36.38 32.15 1x8n s VAL 76 CO 0.16 0.23 -0.01 -0.62 0.00 0.00 0.00 175.10 174.86 1x8n n GLU 77 N 4.24 0.68 -3.80 2.72 -0.58 -0.01 -4.96 120.64 118.93 1x8n n GLU 77 Ca -0.04 0.17 -0.02 0.00 -0.42 0.00 0.00 57.16 56.85 1x8n n GLU 77 Cb 0.51 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1x8n n GLU 77 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1x8n s SER 78 N -6.54 -0.06 0.08 1.62 1.04 -1.08 -5.02 113.70 103.74 1x8n s SER 78 Ca -0.28 -0.43 -0.31 0.00 0.48 0.00 0.00 55.95 55.42 1x8n s SER 78 Cb 0.08 0.38 -0.10 0.00 0.10 0.00 0.00 66.02 66.49 1x8n s SER 78 CO 0.68 -0.74 1.90 -0.22 0.98 0.00 0.00 173.24 175.84 1x8n s LEU 79 N -3.22 4.42 0.00 2.42 2.96 -1.26 -1.25 118.68 122.74 1x8n s LEU 79 Ca 0.18 2.72 0.00 0.00 -0.22 0.00 0.00 54.13 56.81 1x8n s LEU 79 Cb -0.00 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1x8n s LEU 79 CO 0.02 -1.03 0.00 0.61 -1.32 0.00 0.00 176.35 174.63 1x8n n GLY 80 N 4.39 0.52 2.85 7.98 0.00 -1.26 -4.76 105.19 114.92 1x8n n GLY 80 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1x8n n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8n s LYS 81 N -0.16 0.96 0.11 1.61 1.02 -0.38 -1.15 119.74 121.75 1x8n s LYS 81 Ca 0.00 -0.07 0.03 0.00 0.02 0.00 0.00 55.97 55.95 1x8n s LYS 81 Cb 0.00 -1.12 -0.04 0.00 -0.52 0.00 0.00 37.83 36.15 1x8n s LYS 81 CO 0.00 -0.21 -0.08 0.71 -0.92 0.00 0.00 175.35 174.84 1x8n s TYR 82 N 1.54 1.02 -0.11 3.18 2.02 -0.07 -0.83 117.35 124.10 1x8n s TYR 82 Ca -0.01 -0.82 0.03 0.00 -0.37 0.00 0.00 57.07 55.91 1x8n s TYR 82 Cb -0.13 -0.56 0.01 0.00 -0.40 0.00 0.00 41.96 40.88 1x8n s TYR 82 CO -0.04 -0.06 -0.21 0.99 -1.57 0.00 0.00 175.55 174.66 1x8n s THR 83 N -3.29 1.92 -0.14 -0.71 2.01 -0.59 -1.26 115.64 113.59 1x8n s THR 83 Ca 0.12 -0.92 -0.00 0.00 0.31 0.00 0.00 61.69 61.19 1x8n s THR 83 Cb 0.03 -1.68 0.03 0.00 0.01 0.00 0.00 72.50 70.89 1x8n s THR 83 CO -0.02 0.53 -0.07 0.00 -0.69 0.00 0.00 174.62 174.36 1x8n s ALA 84 N 0.59 1.44 1.23 7.40 0.00 0.30 -0.76 121.76 131.95 1x8n s ALA 84 Ca -0.13 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 50.94 1x8n s ALA 84 Cb -0.17 -1.01 0.30 0.00 0.00 0.00 0.00 23.12 22.24 1x8n s ALA 84 CO 0.04 -0.57 1.05 0.54 0.00 0.00 0.00 175.76 176.81 1x8n s ASN 85 N 1.66 0.59 -0.19 0.00 6.03 -1.17 -1.00 114.94 120.85 1x8n s ASN 85 Ca 0.03 0.87 -0.22 0.00 -1.03 0.00 0.00 52.86 52.51 1x8n s ASN 85 Cb -0.14 -1.28 0.06 0.00 -3.03 0.00 0.00 41.25 36.86 1x8n s ASN 85 CO -0.08 -4.36 0.60 0.72 -2.03 0.00 0.00 177.10 171.95 1x8n s PHE 86 N -2.73 -0.63 -0.07 1.54 -0.12 -1.24 -4.24 117.98 110.48 1x8n s PHE 86 Ca 0.69 1.46 0.05 0.00 -0.05 0.00 0.00 56.93 59.08 1x8n s PHE 86 Cb -0.14 0.25 -0.01 0.00 -0.63 0.00 0.00 43.02 42.49 1x8n s PHE 86 CO 0.58 -0.37 -0.24 -1.59 -0.05 0.00 0.00 175.22 173.55 1x8n s LYS 87 N -0.02 2.70 0.06 1.99 -2.85 -0.67 -4.18 119.74 116.78 1x8n s LYS 87 Ca -0.03 -0.87 -0.30 0.00 -1.00 0.00 0.00 55.97 53.77 1x8n s LYS 87 Cb -0.04 -2.17 -0.05 0.00 -2.06 0.00 0.00 37.83 33.51 1x8n s LYS 87 CO 0.02 0.28 1.01 0.21 0.10 0.00 0.00 175.35 176.98 1x8n s LYS 88 N 0.07 4.59 0.12 1.78 2.20 -0.60 -1.28 119.74 126.62 1x8n s LYS 88 Ca -0.10 1.50 0.02 0.00 -0.36 0.00 0.00 55.97 57.03 1x8n s LYS 88 Cb -0.15 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 1x8n s LYS 88 CO 0.06 0.02 -0.06 0.14 -0.36 0.00 0.00 175.35 175.15 1x8n s VAL 89 N 0.60 0.78 0.99 4.02 -7.23 -0.61 -0.49 120.40 118.46 1x8n s VAL 89 Ca 0.51 -1.97 -0.17 0.00 -1.81 0.00 0.00 61.98 58.55 1x8n s VAL 89 Cb -0.23 -1.79 0.23 0.00 0.56 0.00 0.00 36.38 35.15 1x8n s VAL 89 CO 0.29 -0.78 1.21 -0.90 -0.31 0.00 0.00 175.10 174.62 1x8n n ASP 90 N -0.11 -0.43 0.18 4.85 5.68 -0.32 -3.67 116.55 122.73 1x8n n ASP 90 Ca -0.11 -1.38 0.13 0.00 -0.50 0.00 0.00 54.79 52.94 1x8n n ASP 90 Cb 0.61 -0.97 0.59 0.00 -1.14 0.00 0.00 41.12 40.22 1x8n n ASP 90 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1x8n h LYS 91 N 0.00 0.00 -0.12 0.11 2.10 -1.96 -1.58 116.57 115.12 1x8n h LYS 91 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 1x8n h LYS 91 Cb 1.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 1x8n h LYS 91 CO 0.28 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.82 1x8n n ASN 92 N -2.46 2.50 0.00 7.07 3.02 -1.26 -4.80 115.26 119.32 1x8n n ASN 92 Ca 0.01 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.74 1x8n n ASN 92 Cb 0.20 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 1x8n n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x8n n GLY 93 N 1.30 0.75 3.73 7.41 0.00 -0.60 -5.00 105.19 112.78 1x8n n GLY 93 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1x8n n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x8n s ASN 94 N -2.38 7.15 0.02 1.61 0.01 -1.26 -4.77 114.94 115.32 1x8n s ASN 94 Ca 0.00 2.11 -0.30 0.00 -0.71 0.00 0.00 52.86 53.96 1x8n s ASN 94 Cb 0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1x8n s ASN 94 CO 0.00 -0.34 1.15 -0.69 -1.51 0.00 0.00 177.10 175.70 1x8n s VAL 95 N 0.22 4.28 -0.19 1.60 1.01 -1.26 -1.17 120.40 124.89 1x8n s VAL 95 Ca 0.53 1.63 0.06 0.00 0.00 0.00 0.00 61.98 64.20 1x8n s VAL 95 Cb -0.30 -4.05 -0.16 0.00 0.00 0.00 0.00 36.38 31.87 1x8n s VAL 95 CO 0.34 0.09 -0.11 0.29 0.00 0.00 0.00 175.10 175.71 1x8n n LYS 96 N 4.26 0.78 -3.64 2.72 5.02 0.36 -4.93 118.16 122.73 1x8n n LYS 96 Ca 0.09 0.08 -0.23 0.00 -2.02 0.00 0.00 58.31 56.22 1x8n n LYS 96 Cb 0.47 -1.41 -0.17 0.00 -0.02 0.00 0.00 35.03 33.90 1x8n n LYS 96 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1x8n s VAL 97 N -2.41 -0.09 0.79 -0.18 1.01 -0.88 -4.98 120.40 113.65 1x8n s VAL 97 Ca -0.22 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.75 1x8n s VAL 97 Cb 0.06 -0.38 0.07 0.00 0.00 0.00 0.00 36.38 36.13 1x8n s VAL 97 CO 0.53 -0.07 1.14 0.00 0.00 0.00 0.00 175.10 176.71 1x8n s ALA 98 N 2.15 2.02 0.27 5.51 0.00 -1.26 -1.56 121.76 128.89 1x8n s ALA 98 Ca 0.03 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 1x8n s ALA 98 Cb -0.14 -3.39 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 1x8n s ALA 98 CO -0.06 -2.02 1.24 0.28 0.00 0.00 0.00 175.76 175.19 1x8n n VAL 99 N -3.36 1.52 -3.75 0.00 0.31 -1.26 -4.80 118.33 106.99 1x8n n VAL 99 Ca 0.11 -0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 63.93 1x8n n VAL 99 Cb 0.52 -1.30 -0.09 0.00 -0.91 0.00 0.00 33.84 32.06 1x8n n VAL 99 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1x8n s THR 100 N -0.63 0.05 0.35 2.52 -1.32 -1.26 -5.07 115.64 110.28 1x8n s THR 100 Ca 0.63 -0.39 -0.29 0.00 -1.21 0.00 0.00 61.69 60.43 1x8n s THR 100 Cb -0.67 -0.61 -0.11 0.00 -1.51 0.00 0.00 72.50 69.61 1x8n s THR 100 CO 0.56 -0.21 1.53 0.00 -2.21 0.00 0.00 174.62 174.29 1x8n n ALA 101 N 1.50 2.50 0.00 11.08 0.00 -1.26 -1.40 120.51 132.93 1x8n n ALA 101 Ca -0.20 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1x8n n ALA 101 Cb 0.56 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1x8n n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x8n n GLY 102 N 0.96 2.16 3.25 0.00 0.00 -1.26 -4.95 105.19 105.35 1x8n n GLY 102 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1x8n n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x8n s ASN 103 N -1.63 6.00 0.11 1.61 -0.87 -0.49 -3.33 114.94 116.34 1x8n s ASN 103 Ca 0.00 -2.17 -0.16 0.00 -1.57 0.00 0.00 52.86 48.96 1x8n s ASN 103 Cb 0.00 -2.09 0.03 0.00 -0.02 0.00 0.00 41.25 39.18 1x8n s ASN 103 CO 0.00 -0.67 0.40 -0.72 -2.57 0.00 0.00 177.10 173.54 1x8n s TYR 104 N 0.98 -0.21 0.08 2.20 1.13 -0.47 -3.67 117.35 117.39 1x8n s TYR 104 Ca 0.09 -0.06 0.07 0.00 -1.41 0.00 0.00 57.07 55.76 1x8n s TYR 104 Cb -0.23 0.25 -0.03 0.00 -1.10 0.00 0.00 41.96 40.85 1x8n s TYR 104 CO -0.02 -0.68 -0.19 1.52 -2.51 0.00 0.00 175.55 173.68 1x8n s TYR 105 N -3.57 1.61 0.37 -3.49 1.13 -0.17 -0.69 117.35 112.53 1x8n s TYR 105 Ca 0.02 -0.41 -0.05 0.00 -1.41 0.00 0.00 57.07 55.22 1x8n s TYR 105 Cb 0.01 -0.91 -0.05 0.00 -1.10 0.00 0.00 41.96 39.92 1x8n s TYR 105 CO -0.10 0.13 0.65 0.95 -2.51 0.00 0.00 175.55 174.66 1x8n s THR 106 N -1.06 4.97 -0.14 -3.49 -4.23 -0.51 -0.54 115.64 110.64 1x8n s THR 106 Ca 0.04 0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 1x8n s THR 106 Cb -0.09 -3.79 0.07 0.00 1.34 0.00 0.00 72.50 70.03 1x8n s THR 106 CO 0.03 -0.53 0.29 0.12 -0.54 0.00 0.00 174.62 174.00 1x8n s PHE 107 N -2.33 -0.49 -0.11 3.99 5.36 -0.39 -2.68 117.98 121.34 1x8n s PHE 107 Ca 0.45 1.06 0.02 0.00 -0.96 0.00 0.00 56.93 57.50 1x8n s PHE 107 Cb -0.10 0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.63 1x8n s PHE 107 CO 0.35 -0.37 -0.15 0.99 -1.46 0.00 0.00 175.22 174.58 1x8n s THR 108 N 2.34 1.47 -0.60 0.12 2.01 -0.02 -0.89 115.64 120.07 1x8n s THR 108 Ca -0.00 -0.62 -0.21 0.00 0.31 0.00 0.00 61.69 61.16 1x8n s THR 108 Cb -0.12 -1.34 0.07 0.00 0.01 0.00 0.00 72.50 71.12 1x8n s THR 108 CO -0.09 0.43 0.83 -0.69 -0.69 0.00 0.00 174.62 174.41 1x8n s VAL 109 N 1.00 4.56 0.14 3.82 1.01 -0.30 -1.31 120.40 129.33 1x8n s VAL 109 Ca -0.06 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.57 1x8n s VAL 109 Cb -0.15 -4.54 -0.15 0.00 0.00 0.00 0.00 36.38 31.54 1x8n s VAL 109 CO -0.02 -1.20 1.37 0.24 0.00 0.00 0.00 175.10 175.50 1x8n h MET 110 N 9.32 0.00 -2.40 2.72 2.86 -1.22 -0.43 114.93 125.79 1x8n h MET 110 Ca -0.28 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.27 1x8n h MET 110 Cb 1.08 0.00 -0.22 0.00 0.06 0.00 0.00 31.60 32.52 1x8n h MET 110 CO 1.11 0.88 -0.05 -0.47 1.06 0.00 0.00 176.91 179.44 1x8n s TYR 111 N -2.94 -0.58 -0.11 -0.22 5.04 -1.07 -3.08 117.35 114.39 1x8n s TYR 111 Ca 0.01 1.32 -0.25 0.00 -2.44 0.00 0.00 57.07 55.70 1x8n s TYR 111 Cb 0.11 0.23 0.06 0.00 0.35 0.00 0.00 41.96 42.70 1x8n s TYR 111 CO 0.80 -0.35 0.61 0.00 -1.34 0.00 0.00 175.55 175.27 1x8n s ALA 112 N -0.07 -1.55 0.00 3.97 0.00 -1.26 -0.96 121.76 121.88 1x8n s ALA 112 Ca -0.03 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.25 1x8n s ALA 112 Cb -0.03 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1x8n s ALA 112 CO 0.02 -0.33 0.00 -0.40 0.00 0.00 0.00 175.76 175.06 1x8n n ASP 113 N 1.58 0.33 0.24 0.00 5.68 -0.25 -4.95 116.55 119.19 1x8n n ASP 113 Ca -0.18 -0.55 0.11 0.00 -0.50 0.00 0.00 54.79 53.68 1x8n n ASP 113 Cb 0.56 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.15 1x8n n ASP 113 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1x8n h ASP 114 N 0.00 0.00 0.00 -1.12 3.32 -2.02 -3.32 116.42 113.28 1x8n h ASP 114 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1x8n h ASP 114 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1x8n h ASP 114 CO 0.00 0.18 -1.08 -1.20 -1.72 0.00 0.00 179.24 175.42 1x8n n SER 115 N -3.52 3.39 -3.95 6.45 7.64 -1.26 -4.87 113.62 117.49 1x8n n SER 115 Ca -0.01 -0.09 -0.08 0.00 1.01 0.00 0.00 58.87 59.70 1x8n n SER 115 Cb 0.33 1.19 -0.08 0.00 -1.01 0.00 0.00 64.21 64.63 1x8n n SER 115 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x8n s SER 116 N -2.40 0.27 0.15 6.43 1.04 -1.25 -1.11 113.70 116.84 1x8n s SER 116 Ca -0.01 -0.79 -0.22 0.00 0.48 0.00 0.00 55.95 55.41 1x8n s SER 116 Cb 0.03 0.28 0.07 0.00 0.10 0.00 0.00 66.02 66.50 1x8n s SER 116 CO 0.20 -0.67 0.58 0.00 0.98 0.00 0.00 173.24 174.33 1x8n s ALA 117 N -3.83 -1.53 -0.11 5.32 0.00 -0.78 -1.09 121.76 119.74 1x8n s ALA 117 Ca 0.05 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.46 1x8n s ALA 117 Cb 0.06 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.06 1x8n s ALA 117 CO -0.10 -0.75 -0.14 -1.17 0.00 0.00 0.00 175.76 173.59 1x8n s LEU 118 N -2.75 1.65 0.22 0.00 2.96 -0.14 -0.46 118.68 120.17 1x8n s LEU 118 Ca 0.01 -0.40 0.09 0.00 -0.22 0.00 0.00 54.13 53.60 1x8n s LEU 118 Cb -0.01 -1.04 -0.05 0.00 0.50 0.00 0.00 46.19 45.60 1x8n s LEU 118 CO -0.13 -0.00 -0.15 0.27 -1.32 0.00 0.00 176.35 175.02 1x8n s ILE 119 N 1.07 1.88 -0.03 6.68 -5.25 -0.38 -0.91 121.20 124.27 1x8n s ILE 119 Ca -0.05 -2.25 0.07 0.00 -0.99 0.00 0.00 60.65 57.43 1x8n s ILE 119 Cb -0.15 -2.10 -0.02 0.00 2.95 0.00 0.00 42.46 43.15 1x8n s ILE 119 CO -0.03 -0.55 -0.25 -2.28 -1.79 0.00 0.00 174.94 170.04 1x8n s HIS 120 N -2.89 2.29 0.02 1.37 5.65 -0.43 -1.16 115.29 120.14 1x8n s HIS 120 Ca 0.24 -0.49 0.02 0.00 0.25 0.00 0.00 55.06 55.08 1x8n s HIS 120 Cb -0.01 -1.48 -0.01 0.00 -1.18 0.00 0.00 32.58 29.89 1x8n s HIS 120 CO 0.08 -0.08 -0.07 -0.08 -0.65 0.00 0.00 174.74 173.95 1x8n s THR 121 N -0.49 0.51 -0.22 0.89 -1.32 0.20 -0.84 115.64 114.37 1x8n s THR 121 Ca 0.07 -0.62 0.02 0.00 -1.21 0.00 0.00 61.69 59.95 1x8n s THR 121 Cb -0.11 -0.49 0.04 0.00 -1.51 0.00 0.00 72.50 70.43 1x8n s THR 121 CO 0.00 -0.09 -0.15 0.00 -2.21 0.00 0.00 174.62 172.17 1x8n s LEU 123 N 1.19 4.27 -0.20 0.00 2.96 -1.26 -1.42 118.68 124.22 1x8n s LEU 123 Ca -0.03 0.83 -0.01 0.00 -0.22 0.00 0.00 54.13 54.70 1x8n s LEU 123 Cb -0.17 -2.72 0.01 0.00 0.50 0.00 0.00 46.19 43.81 1x8n s LEU 123 CO -0.08 -0.01 -0.13 -1.00 -1.32 0.00 0.00 176.35 173.80 1x8n s HIS 124 N 0.66 2.86 -0.37 5.38 3.76 0.14 -4.62 115.29 123.10 1x8n s HIS 124 Ca 0.27 -1.34 0.02 0.00 -0.15 0.00 0.00 55.06 53.86 1x8n s HIS 124 Cb -0.15 -2.00 0.15 0.00 1.11 0.00 0.00 32.58 31.69 1x8n s HIS 124 CO 0.11 -0.69 0.30 0.21 -0.85 0.00 0.00 174.74 173.82 1x8n s LYS 125 N 1.37 0.64 1.31 1.40 2.20 -1.24 -1.36 119.74 124.05 1x8n s LYS 125 Ca 0.05 -1.25 0.00 0.00 -0.36 0.00 0.00 55.97 54.42 1x8n s LYS 125 Cb -0.14 -1.06 0.00 0.00 -1.51 0.00 0.00 37.83 35.12 1x8n s LYS 125 CO -0.09 -1.23 0.00 0.41 -0.36 0.00 0.00 175.35 174.08 1x8n n GLY 126 N 3.93 1.87 0.12 5.54 0.00 -1.21 -2.92 105.19 112.53 1x8n n GLY 126 Ca 0.14 0.52 0.02 0.00 0.00 0.00 0.00 46.02 46.70 1x8n n GLY 126 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1x8n h ASN 127 N 0.00 0.00 -4.05 1.61 2.35 -1.98 -3.46 115.58 110.04 1x8n h ASN 127 Ca 0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 1x8n h ASN 127 Cb 0.00 0.00 0.16 0.00 0.05 0.00 0.00 38.32 38.53 1x8n h ASN 127 CO 0.00 0.52 0.47 2.29 -1.65 0.00 0.00 177.43 179.07 1x8n n LYS 128 N -3.05 1.08 -3.84 0.81 0.00 -1.15 -4.99 118.16 107.03 1x8n n LYS 128 Ca -0.03 0.43 -0.36 0.00 -0.00 0.00 0.00 58.31 58.34 1x8n n LYS 128 Cb 0.78 -2.50 -0.13 0.00 -0.00 0.00 0.00 35.03 33.18 1x8n n LYS 128 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1x8n s ASP 129 N -1.38 4.84 0.17 -5.58 2.15 -1.26 -4.71 116.67 110.90 1x8n s ASP 129 Ca 0.82 -0.79 0.09 0.00 0.43 0.00 0.00 52.55 53.10 1x8n s ASP 129 Cb -0.38 -1.80 -0.04 0.00 -0.30 0.00 0.00 42.92 40.40 1x8n s ASP 129 CO 0.41 -0.17 -0.20 -0.76 -0.17 0.00 0.00 175.17 174.28 1x8n s LEU 130 N 1.43 2.43 0.48 -1.34 1.02 -1.26 -4.47 118.68 116.97 1x8n s LEU 130 Ca 0.01 -0.85 0.05 0.00 0.02 0.00 0.00 54.13 53.37 1x8n s LEU 130 Cb -0.17 -0.90 -0.01 0.00 0.02 0.00 0.00 46.19 45.13 1x8n s LEU 130 CO -0.00 0.00 0.24 -0.83 0.02 0.00 0.00 176.35 175.78 1x8n s GLY 131 N -2.62 2.48 0.23 -3.19 0.00 -1.26 -1.21 107.32 101.76 1x8n s GLY 131 Ca 0.16 -1.43 -0.31 0.00 0.00 0.00 0.00 44.72 43.13 1x8n s GLY 131 CO 0.07 -1.97 1.66 0.99 0.00 0.00 0.00 173.10 173.85 1x8n s ASP 132 N -4.05 6.40 -0.13 1.64 1.01 -1.26 -4.66 116.67 115.61 1x8n s ASP 132 Ca 0.32 2.87 0.00 0.00 0.71 0.00 0.00 52.55 56.45 1x8n s ASP 132 Cb 0.01 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.35 1x8n s ASP 132 CO 0.18 -0.94 -0.13 -0.22 0.21 0.00 0.00 175.17 174.28 1x8n s LEU 133 N 0.58 1.60 -0.04 1.23 2.96 -0.64 -1.08 118.68 123.29 1x8n s LEU 133 Ca 0.70 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1x8n s LEU 133 Cb -0.48 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 1x8n s LEU 133 CO 0.37 -0.05 0.09 -0.31 -1.32 0.00 0.00 176.35 175.14 1x8n s TYR 134 N 1.42 3.36 -0.02 5.38 2.02 0.08 -0.63 117.35 128.97 1x8n s TYR 134 Ca 0.03 0.29 0.00 0.00 -0.37 0.00 0.00 57.07 57.01 1x8n s TYR 134 Cb -0.13 -1.80 0.03 0.00 -0.40 0.00 0.00 41.96 39.66 1x8n s TYR 134 CO -0.08 0.59 0.02 0.00 -1.57 0.00 0.00 175.55 174.50 1x8n s ALA 135 N -1.14 0.12 -0.12 3.71 0.00 -0.31 -1.09 121.76 122.94 1x8n s ALA 135 Ca 0.21 0.24 -0.22 0.00 0.00 0.00 0.00 51.96 52.19 1x8n s ALA 135 Cb -0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1x8n s ALA 135 CO 0.11 -0.09 0.65 0.08 0.00 0.00 0.00 175.76 176.52 1x8n s VAL 136 N 0.91 5.05 0.16 0.00 1.01 -0.10 -1.24 120.40 126.19 1x8n s VAL 136 Ca -0.08 1.31 0.08 0.00 0.00 0.00 0.00 61.98 63.29 1x8n s VAL 136 Cb -0.11 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1x8n s VAL 136 CO -0.02 0.21 -0.08 -0.76 0.00 0.00 0.00 175.10 174.45 1x8n s LEU 137 N 1.17 3.04 0.02 3.92 1.43 0.39 -0.87 118.68 127.77 1x8n s LEU 137 Ca 0.33 -0.51 -0.08 0.00 -1.03 0.00 0.00 54.13 52.84 1x8n s LEU 137 Cb -0.17 -1.74 -0.00 0.00 0.03 0.00 0.00 46.19 44.31 1x8n s LEU 137 CO 0.14 0.11 0.15 0.21 0.23 0.00 0.00 176.35 177.19 1x8n s ASN 138 N -2.73 0.07 0.48 2.29 3.84 -0.41 -1.86 114.94 116.61 1x8n s ASN 138 Ca 0.25 -0.35 0.26 0.00 0.21 0.00 0.00 52.86 53.23 1x8n s ASN 138 Cb -0.09 0.24 1.13 0.00 -0.55 0.00 0.00 41.25 41.98 1x8n s ASN 138 CO 0.15 -0.47 1.92 0.03 -2.79 0.00 0.00 177.10 175.94 1x8n h ARG 139 N 3.83 0.00 -4.91 0.43 2.47 -1.37 -0.57 114.38 114.25 1x8n h ARG 139 Ca -0.32 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 57.74 1x8n h ARG 139 Cb 1.19 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 29.26 1x8n h ARG 139 CO 0.46 0.17 -0.64 1.21 0.56 0.00 0.00 179.97 181.73 1x8n s ASN 140 N -6.11 4.98 0.61 7.04 2.47 -1.26 -4.80 114.94 117.85 1x8n s ASN 140 Ca -0.00 -0.39 0.32 0.00 0.42 0.00 0.00 52.86 53.21 1x8n s ASN 140 Cb 0.11 -1.88 1.94 0.00 -1.45 0.00 0.00 41.25 39.97 1x8n s ASN 140 CO 0.61 -0.08 2.28 0.07 -3.72 0.00 0.00 177.10 176.26 1x8n h LYS 141 N 8.22 0.00 -0.02 0.43 2.10 -1.93 -2.21 116.57 123.15 1x8n h LYS 141 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1x8n h LYS 141 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1x8n h LYS 141 CO 0.59 0.00 -0.07 -0.25 -2.00 0.00 0.00 179.45 177.72 1x8n n ASP 142 N -3.71 2.46 -4.71 7.07 8.00 -1.26 -4.88 116.55 119.52 1x8n n ASP 142 Ca -0.03 -1.78 -0.42 0.00 0.71 0.00 0.00 54.79 53.27 1x8n n ASP 142 Cb 0.09 0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 1x8n n ASP 142 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x8n s ALA 143 N -2.08 3.62 0.48 2.24 0.00 -0.83 -4.99 121.76 120.19 1x8n s ALA 143 Ca 0.29 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 53.17 1x8n s ALA 143 Cb 0.20 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.69 1x8n s ALA 143 CO 0.35 -0.68 1.21 0.00 0.00 0.00 0.00 175.76 176.64 1x8n s ALA 144 N 1.27 2.94 0.11 0.00 0.00 -1.26 -4.95 121.76 119.86 1x8n s ALA 144 Ca 0.66 1.03 -0.31 0.00 0.00 0.00 0.00 51.96 53.33 1x8n s ALA 144 Cb -0.38 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.23 1x8n s ALA 144 CO 0.30 -0.82 1.60 0.00 0.00 0.00 0.00 175.76 176.84 1x8n s ALA 145 N -1.49 3.71 0.80 0.00 0.00 -1.26 -5.00 121.76 118.52 1x8n s ALA 145 Ca 0.65 1.26 -0.07 0.00 0.00 0.00 0.00 51.96 53.80 1x8n s ALA 145 Cb -0.31 -3.65 0.14 0.00 0.00 0.00 0.00 23.12 19.29 1x8n s ALA 145 CO 0.38 -0.94 1.11 0.20 0.00 0.00 0.00 175.76 176.51 1x8n s GLY 146 N 1.80 1.76 0.36 0.00 0.00 -1.26 -4.88 107.32 105.10 1x8n s GLY 146 Ca 0.71 -1.42 0.07 0.00 0.00 0.00 0.00 44.72 44.08 1x8n s GLY 146 CO 0.32 -0.81 1.89 -0.55 0.00 0.00 0.00 173.10 173.95 1x8n h ASP 147 N -0.91 0.37 0.30 1.64 3.45 -1.98 -1.02 116.42 118.27 1x8n h ASP 147 Ca -0.40 -0.07 -0.01 0.00 0.43 0.00 0.00 57.03 56.97 1x8n h ASP 147 Cb 1.26 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.94 1x8n h ASP 147 CO 0.43 0.48 -0.15 0.11 -1.57 0.00 0.00 179.24 178.54 1x8n h LYS 148 N 0.38 -0.39 -0.13 3.56 1.57 -1.99 -0.03 116.57 119.54 1x8n h LYS 148 Ca 0.08 0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.73 1x8n h LYS 148 Cb 0.34 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1x8n h LYS 148 CO 0.01 -0.17 -0.59 -0.24 -0.57 0.00 0.00 179.45 177.89 1x8n h VAL 149 N -0.54 1.35 -0.58 0.50 3.04 -1.93 -1.83 116.25 116.26 1x8n h VAL 149 Ca -0.04 -1.90 -0.07 0.00 -1.01 0.00 0.00 66.70 63.68 1x8n h VAL 149 Cb 0.40 1.90 -0.02 0.00 -2.01 0.00 0.00 31.29 31.56 1x8n h VAL 149 CO 0.07 0.58 0.08 0.11 -1.01 0.00 0.00 177.57 177.40 1x8n h LYS 150 N 0.32 0.93 -0.71 4.17 1.57 -1.10 -0.70 116.57 121.05 1x8n h LYS 150 Ca -0.00 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 1x8n h LYS 150 Cb 1.13 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.29 1x8n h LYS 150 CO 0.10 0.87 0.24 0.77 -0.57 0.00 0.00 179.45 180.87 1x8n h SER 151 N 0.88 1.01 -0.55 0.86 0.02 -0.86 -1.55 113.55 113.36 1x8n h SER 151 Ca 0.18 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.92 1x8n h SER 151 Cb 0.40 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 1x8n h SER 151 CO 0.01 0.92 0.20 0.00 -1.14 0.00 0.00 176.83 176.83 1x8n h ALA 152 N 1.21 1.24 -0.25 3.77 0.00 -0.71 0.15 119.26 124.68 1x8n h ALA 152 Ca 0.23 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1x8n h ALA 152 Cb 0.26 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1x8n h ALA 152 CO -0.01 0.54 0.16 0.28 0.00 0.00 0.00 179.25 180.22 1x8n h VAL 153 N 0.86 1.07 -0.91 0.00 2.07 -0.59 -1.74 116.25 117.00 1x8n h VAL 153 Ca 0.20 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.62 1x8n h VAL 153 Cb 0.22 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1x8n h VAL 153 CO -0.01 0.06 0.60 0.28 0.02 0.00 0.00 177.57 178.52 1x8n h SER 154 N 0.33 1.01 0.51 0.57 0.02 -0.68 -2.23 113.55 113.08 1x8n h SER 154 Ca 0.09 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 1x8n h SER 154 Cb -0.04 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 1x8n h SER 154 CO -0.02 0.71 -0.20 0.00 -1.14 0.00 0.00 176.83 176.18 1x8n h ALA 155 N 1.36 1.23 0.00 3.77 0.00 -0.27 0.58 119.26 125.93 1x8n h ALA 155 Ca 0.35 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1x8n h ALA 155 Cb -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1x8n h ALA 155 CO -0.10 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1x8n n ALA 156 N -2.30 2.56 -2.88 0.00 0.00 -0.70 -4.89 120.51 112.29 1x8n n ALA 156 Ca -0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 53.44 53.11 1x8n n ALA 156 Cb 0.32 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.41 1x8n n ALA 156 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1x8n n THR 157 N -0.91 -1.57 -4.25 0.00 -1.04 0.19 -5.03 114.28 101.67 1x8n n THR 157 Ca 0.18 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.96 1x8n n THR 157 Cb 0.08 -2.88 -0.07 0.00 -1.82 0.00 0.00 70.33 65.64 1x8n n THR 157 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x8n s LEU 158 N -5.03 3.28 -0.31 -4.42 1.43 -0.88 -5.04 118.68 107.71 1x8n s LEU 158 Ca 0.25 -0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 52.68 1x8n s LEU 158 Cb -0.11 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.34 1x8n s LEU 158 CO 0.31 -0.04 0.07 -1.61 0.23 0.00 0.00 176.35 175.31 1x8n s GLU 159 N -3.71 2.83 0.49 1.70 0.41 -1.26 -3.87 118.70 115.28 1x8n s GLU 159 Ca 0.32 -1.02 0.16 0.00 -0.41 0.00 0.00 54.97 54.02 1x8n s GLU 159 Cb -0.06 -3.35 1.20 0.00 -1.78 0.00 0.00 34.13 30.13 1x8n s GLU 159 CO 0.21 -0.54 2.07 0.35 -0.49 0.00 0.00 175.26 176.86 1x8n h PHE 160 N 8.19 0.16 -0.08 1.61 3.57 -1.91 -1.41 116.94 127.07 1x8n h PHE 160 Ca -0.28 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.25 1x8n h PHE 160 Cb 1.10 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 1x8n h PHE 160 CO 0.60 0.09 0.18 0.66 -2.23 0.00 0.00 178.31 177.61 1x8n h SER 161 N 0.16 0.00 0.81 0.41 4.64 -2.01 -0.57 113.55 116.99 1x8n h SER 161 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1x8n h SER 161 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1x8n h SER 161 CO -0.02 0.00 -0.59 0.29 -0.87 0.00 0.00 176.83 175.64 1x8n n LYS 162 N -3.34 0.24 -2.17 4.77 5.02 -0.53 -4.88 118.16 117.27 1x8n n LYS 162 Ca -0.01 0.07 -0.38 0.00 -2.02 0.00 0.00 58.31 55.97 1x8n n LYS 162 Cb 0.27 -1.65 -0.01 0.00 -0.02 0.00 0.00 35.03 33.62 1x8n n LYS 162 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1x8n s PHE 163 N -3.14 2.86 -0.21 2.13 0.40 -0.22 -4.89 117.98 114.92 1x8n s PHE 163 Ca 0.07 1.49 -0.13 0.00 -0.60 0.00 0.00 56.93 57.77 1x8n s PHE 163 Cb 0.14 -3.50 -0.05 0.00 0.51 0.00 0.00 43.02 40.13 1x8n s PHE 163 CO 0.71 -1.73 0.25 0.42 0.70 0.00 0.00 175.22 175.57 1x8n s ILE 164 N -1.41 5.31 0.39 0.64 1.01 0.58 -4.84 121.20 122.88 1x8n s ILE 164 Ca 0.61 0.42 -0.24 0.00 0.00 0.00 0.00 60.65 61.43 1x8n s ILE 164 Cb -0.33 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.46 1x8n s ILE 164 CO 0.41 0.34 1.03 -0.55 0.00 0.00 0.00 174.94 176.17 1x8n s SER 165 N 0.82 6.84 0.09 3.58 0.15 -1.26 -0.95 113.70 122.98 1x8n s SER 165 Ca 0.13 2.00 0.22 0.00 0.70 0.00 0.00 55.95 59.00 1x8n s SER 165 Cb -0.13 -2.58 -0.15 0.00 -1.71 0.00 0.00 66.02 61.44 1x8n s SER 165 CO 0.04 -0.43 0.78 0.35 1.20 0.00 0.00 173.24 175.18 1x8n n THR 166 N -0.02 0.38 0.13 6.45 -2.24 -0.16 -4.66 114.28 114.16 1x8n n THR 166 Ca 0.05 -0.54 0.18 0.00 -2.27 0.00 0.00 64.05 61.48 1x8n n THR 166 Cb 0.50 -0.20 0.65 0.00 -2.10 0.00 0.00 70.33 69.17 1x8n n THR 166 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1x8n h LYS 167 N 0.00 0.00 -0.57 -0.78 2.10 -1.89 -2.74 116.57 112.69 1x8n h LYS 167 Ca -0.01 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.52 1x8n h LYS 167 Cb 1.03 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.29 1x8n h LYS 167 CO 0.00 0.00 0.13 0.39 -2.00 0.00 0.00 179.45 177.97 1x8n n GLU 168 N -3.29 3.62 -0.15 0.07 -0.58 -1.26 -4.49 120.64 114.56 1x8n n GLU 168 Ca 0.07 -3.07 0.11 0.00 -0.42 0.00 0.00 57.16 53.85 1x8n n GLU 168 Cb 0.74 -2.11 0.18 0.00 -0.57 0.00 0.00 31.44 29.68 1x8n n GLU 168 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1x8n n ASN 169 N -0.17 3.22 -2.10 1.62 3.02 -1.03 -4.97 115.26 114.84 1x8n n ASN 169 Ca 0.33 -1.94 -0.18 0.00 -0.03 0.00 0.00 54.58 52.76 1x8n n ASN 169 Cb 1.22 -0.20 -0.01 0.00 -0.61 0.00 0.00 39.78 40.18 1x8n n ASN 169 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1x8n n ASN 170 N 1.31 -5.36 -4.65 6.41 4.05 -1.26 -4.91 115.26 110.84 1x8n n ASN 170 Ca 0.17 -0.01 -0.46 0.00 0.45 0.00 0.00 54.58 54.73 1x8n n ASN 170 Cb 0.56 -4.42 -0.04 0.00 1.23 0.00 0.00 39.78 37.10 1x8n n ASN 170 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1x8n s ALA 172 N 5.00 2.26 -0.04 0.00 0.00 -1.26 -5.13 121.76 122.58 1x8n s ALA 172 Ca 0.94 -1.06 0.06 0.00 0.00 0.00 0.00 51.96 51.90 1x8n s ALA 172 Cb -0.56 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 21.86 1x8n s ALA 172 CO 0.46 0.48 -0.23 0.71 0.00 0.00 0.00 175.76 177.18 1x8n s TYR 173 N -0.43 2.44 -1.16 0.00 2.02 -1.26 -5.06 117.35 113.90 1x8n s TYR 173 Ca 0.05 -0.49 -0.13 0.00 -0.37 0.00 0.00 57.07 56.13 1x8n s TYR 173 Cb -0.12 -1.57 0.20 0.00 -0.40 0.00 0.00 41.96 40.07 1x8n s TYR 173 CO 0.01 -0.06 1.33 0.34 -1.57 0.00 0.00 175.55 175.60 1x8n s ASP 174 N -0.45 7.11 0.20 2.29 -1.08 -1.26 -4.83 116.67 118.65 1x8n s ASP 174 Ca 0.05 -3.10 -0.14 0.00 -0.52 0.00 0.00 52.55 48.84 1x8n s ASP 174 Cb -0.12 -2.35 0.22 0.00 -1.46 0.00 0.00 42.92 39.21 1x8n s ASP 174 CO 0.01 -0.64 1.63 0.78 0.52 0.00 0.00 175.17 177.47 1x8n h ASN 175 N 7.12 -0.60 -0.57 -0.34 4.21 -2.00 -2.24 115.58 121.15 1x8n h ASN 175 Ca 0.27 0.18 0.09 0.00 1.21 0.00 0.00 56.30 58.05 1x8n h ASN 175 Cb 0.88 0.39 -0.07 0.00 -1.12 0.00 0.00 38.32 38.40 1x8n h ASN 175 CO 1.17 -0.21 0.20 0.44 -1.29 0.00 0.00 177.43 177.74 1x8n h ASP 176 N -0.01 0.19 -0.74 5.81 3.32 -2.00 -0.46 116.42 122.52 1x8n h ASP 176 Ca 0.29 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.39 1x8n h ASP 176 Cb 0.45 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 1x8n h ASP 176 CO -0.63 0.12 0.37 0.28 -1.72 0.00 0.00 179.24 177.66 1x8n h SER 177 N 0.37 0.96 -0.58 6.45 0.02 -1.76 -1.46 113.55 117.55 1x8n h SER 177 Ca 0.29 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 61.15 1x8n h SER 177 Cb 0.35 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1x8n h SER 177 CO -0.30 0.81 0.33 -0.07 -1.14 0.00 0.00 176.83 176.46 1x8n h LEU 178 N 1.04 0.50 -0.59 5.07 3.38 -0.58 -0.44 115.31 123.68 1x8n h LEU 178 Ca 0.26 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.19 1x8n h LEU 178 Cb 0.09 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1x8n h LEU 178 CO -0.04 0.34 0.17 0.11 0.09 0.00 0.00 178.44 179.12 1x8n h LYS 179 N 0.63 0.93 -0.01 1.13 1.57 -0.91 -2.98 116.57 116.93 1x8n h LYS 179 Ca 0.25 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1x8n h LYS 179 Cb 0.10 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1x8n h LYS 179 CO -0.14 0.84 -0.53 0.66 -0.57 0.00 0.00 179.45 179.71 1x8n h SER 180 N 0.84 0.02 0.25 0.86 4.64 -0.86 -2.78 113.55 116.51 1x8n h SER 180 Ca 0.19 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1x8n h SER 180 Cb 0.31 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1x8n h SER 180 CO -0.00 0.55 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.39 1x8n h LEU 181 N 0.01 0.00 -2.20 5.97 3.38 -0.93 -2.21 115.31 119.34 1x8n h LEU 181 Ca -0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.02 1x8n h LEU 181 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1x8n h LEU 181 CO 0.07 0.04 0.21 -0.07 0.09 0.00 0.00 178.44 178.78 1x8n h LEU 182 N 0.00 0.00 -0.46 1.67 3.38 -1.49 -1.19 115.31 117.22 1x8n h LEU 182 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x8n h LEU 182 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1x8n h LEU 182 CO 0.01 0.00 -0.17 0.35 0.09 0.00 0.00 178.44 178.72 1x8n n THR 183 N -3.88 0.00 0.96 0.22 -2.24 -0.83 -4.71 114.28 103.81 1x8n n THR 183 Ca 0.02 -0.12 0.12 0.00 -2.27 0.00 0.00 64.05 61.80 1x8n n THR 183 Cb 0.33 0.22 0.10 0.00 -2.10 0.00 0.00 70.33 68.88 1x8n n THR 183 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79