#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tp8 s LYS 2 N 0.00 3.62 0.31 1.61 2.47 0.47 -4.77 119.74 123.44 1tp8 s LYS 2 Ca 0.00 -0.28 -0.27 0.00 -1.56 0.00 0.00 55.97 53.85 1tp8 s LYS 2 Cb 0.00 -3.80 -0.09 0.00 -1.46 0.00 0.00 37.83 32.48 1tp8 s LYS 2 CO 0.00 -0.56 1.02 0.00 0.16 0.00 0.00 175.35 175.97 1tp8 s ALA 3 N 2.17 3.26 0.16 3.13 0.00 -1.26 -2.16 121.76 127.05 1tp8 s ALA 3 Ca 0.15 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.82 1tp8 s ALA 3 Cb -0.16 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 1tp8 s ALA 3 CO 0.12 -0.02 -0.00 -0.59 0.00 0.00 0.00 175.76 175.27 1tp8 s PHE 4 N -1.41 1.15 -0.19 0.00 -0.12 -0.00 -4.95 117.98 112.47 1tp8 s PHE 4 Ca 0.49 -1.02 -0.05 0.00 -0.05 0.00 0.00 56.93 56.30 1tp8 s PHE 4 Cb -0.25 -0.65 0.09 0.00 -0.63 0.00 0.00 43.02 41.58 1tp8 s PHE 4 CO 0.31 -0.23 0.34 0.34 -0.05 0.00 0.00 175.22 175.94 1tp8 s ASP 5 N -3.15 0.21 -0.01 1.98 -1.08 -1.26 -1.94 116.67 111.42 1tp8 s ASP 5 Ca 0.23 0.58 0.13 0.00 -0.52 0.00 0.00 52.55 52.96 1tp8 s ASP 5 Cb 0.06 0.99 -0.21 0.00 -1.46 0.00 0.00 42.92 42.31 1tp8 s ASP 5 CO 0.03 -0.26 0.75 0.44 0.52 0.00 0.00 175.17 176.65 1tp8 h ASP 6 N 8.23 0.00 -4.63 -0.34 3.32 -1.70 -3.49 116.42 117.80 1tp8 h ASP 6 Ca -0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1tp8 h ASP 6 Cb 1.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1tp8 h ASP 6 CO 0.17 0.91 0.00 0.61 -1.72 0.00 0.00 179.24 179.22 1tp8 n GLY 7 N 1.51 -3.56 3.84 2.75 0.00 -1.26 -4.95 105.19 103.52 1tp8 n GLY 7 Ca -0.14 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.61 1tp8 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tp8 s ALA 8 N -1.02 3.78 0.00 4.61 0.00 -1.26 -4.22 121.76 123.65 1tp8 s ALA 8 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1tp8 s ALA 8 Cb 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1tp8 s ALA 8 CO 0.00 0.49 0.00 1.19 0.00 0.00 0.00 175.76 177.44 1tp8 n PHE 9 N 2.23 0.00 0.70 0.00 3.01 -0.38 -5.02 117.46 117.99 1tp8 n PHE 9 Ca -0.17 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.36 1tp8 n PHE 9 Cb 0.54 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.97 1tp8 n PHE 9 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1tp8 n THR 10 N 0.00 0.00 0.00 4.37 -2.24 -0.64 -4.89 114.28 110.88 1tp8 n THR 10 Ca 0.00 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1tp8 n THR 10 Cb 0.00 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 1tp8 n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tp8 n GLY 11 N 1.23 -0.53 3.27 3.38 0.00 -1.15 -4.94 105.19 106.45 1tp8 n GLY 11 Ca 0.05 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 1tp8 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tp8 s ILE 12 N -2.00 2.22 -0.09 -0.61 1.01 -1.26 -0.52 121.20 119.95 1tp8 s ILE 12 Ca 0.00 -0.98 0.07 0.00 0.00 0.00 0.00 60.65 59.73 1tp8 s ILE 12 Cb 0.00 -1.84 -0.10 0.00 0.01 0.00 0.00 42.46 40.53 1tp8 s ILE 12 CO 0.00 0.56 0.01 0.54 0.00 0.00 0.00 174.94 176.05 1tp8 n ARG 13 N 3.25 2.20 -3.69 2.79 1.74 0.18 -4.81 116.66 118.32 1tp8 n ARG 13 Ca -0.18 0.01 -0.13 0.00 -0.77 0.00 0.00 57.85 56.78 1tp8 n ARG 13 Cb 0.53 -1.22 -0.09 0.00 -1.02 0.00 0.00 32.46 30.65 1tp8 n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1tp8 s GLU 14 N -2.21 0.62 -0.09 5.56 2.12 -0.98 -2.59 118.70 121.12 1tp8 s GLU 14 Ca -0.06 0.79 0.02 0.00 0.36 0.00 0.00 54.97 56.08 1tp8 s GLU 14 Cb 0.03 0.27 -0.02 0.00 0.26 0.00 0.00 34.13 34.67 1tp8 s GLU 14 CO 0.34 -0.09 -0.15 0.42 -0.54 0.00 0.00 175.26 175.24 1tp8 s ILE 15 N 0.47 2.90 -0.19 -3.70 1.01 0.12 -1.18 121.20 120.63 1tp8 s ILE 15 Ca -0.01 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.90 1tp8 s ILE 15 Cb -0.04 -2.17 0.04 0.00 0.01 0.00 0.00 42.46 40.30 1tp8 s ILE 15 CO -0.02 0.56 -0.10 0.20 0.00 0.00 0.00 174.94 175.57 1tp8 s ASN 16 N -0.12 3.22 0.39 3.58 0.01 -0.31 0.63 114.94 122.34 1tp8 s ASN 16 Ca -0.02 -0.80 0.05 0.00 -0.71 0.00 0.00 52.86 51.38 1tp8 s ASN 16 Cb -0.14 -1.19 -0.02 0.00 0.41 0.00 0.00 41.25 40.31 1tp8 s ASN 16 CO 0.04 -0.13 0.19 0.00 -1.51 0.00 0.00 177.10 175.69 1tp8 n LEU 17 N 4.72 0.00 -3.96 0.60 -0.00 -0.65 -1.17 117.00 116.54 1tp8 n LEU 17 Ca -0.15 -3.21 -0.09 0.00 -0.00 0.00 0.00 56.01 52.56 1tp8 n LEU 17 Cb 0.47 1.27 -0.10 0.00 -0.00 0.00 0.00 43.42 45.05 1tp8 n LEU 17 CO 0.20 -0.51 -0.31 -0.94 -0.00 0.00 0.00 177.39 175.84 1tp8 s SER 18 N -3.50 0.21 0.24 1.45 1.04 -0.19 -1.10 113.70 111.86 1tp8 s SER 18 Ca 0.27 -0.49 -0.04 0.00 0.48 0.00 0.00 55.95 56.17 1tp8 s SER 18 Cb 0.01 0.14 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 1tp8 s SER 18 CO 0.19 -0.36 0.28 -0.72 0.98 0.00 0.00 173.24 173.61 1tp8 s TYR 19 N -1.80 0.98 -0.04 5.02 1.13 -0.39 -0.70 117.35 121.55 1tp8 s TYR 19 Ca -0.12 -1.21 0.05 0.00 -1.41 0.00 0.00 57.07 54.37 1tp8 s TYR 19 Cb -0.07 -0.31 -0.01 0.00 -1.10 0.00 0.00 41.96 40.47 1tp8 s TYR 19 CO -0.02 -0.81 -0.18 1.21 -2.51 0.00 0.00 175.55 173.24 1tp8 s ASN 20 N -3.15 2.24 0.55 -0.18 3.84 -0.98 -0.54 114.94 116.72 1tp8 s ASN 20 Ca 0.34 -0.36 0.35 0.00 0.21 0.00 0.00 52.86 53.40 1tp8 s ASN 20 Cb 0.04 -0.56 1.62 0.00 -0.55 0.00 0.00 41.25 41.79 1tp8 s ASN 20 CO 0.13 0.17 2.06 0.50 -2.79 0.00 0.00 177.10 177.17 1tp8 h LYS 21 N 6.14 0.00 0.00 0.43 3.64 -1.90 -2.98 116.57 121.90 1tp8 h LYS 21 Ca -0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1tp8 h LYS 21 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1tp8 h LYS 21 CO 0.48 0.00 -1.22 0.39 -2.27 0.00 0.00 179.45 176.83 1tp8 n GLU 22 N -2.99 1.08 0.00 1.90 1.02 -1.26 -4.65 120.64 115.74 1tp8 n GLU 22 Ca -0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1tp8 n GLU 22 Cb 0.23 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 1tp8 n GLU 22 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1tp8 n THR 23 N -1.70 0.00 -3.22 2.62 -2.24 -1.12 -5.03 114.28 103.59 1tp8 n THR 23 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1tp8 n THR 23 Cb 0.34 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1tp8 n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tp8 n ALA 24 N -1.86 0.00 -1.75 6.98 0.00 -1.25 -4.66 120.51 117.96 1tp8 n ALA 24 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1tp8 n ALA 24 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1tp8 n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1tp8 s ILE 25 N -2.64 3.82 0.00 0.00 -1.09 -1.03 -2.33 121.20 117.94 1tp8 s ILE 25 Ca 0.00 1.83 0.00 0.00 -2.23 0.00 0.00 60.65 60.25 1tp8 s ILE 25 Cb 0.00 -4.17 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 1tp8 s ILE 25 CO 0.00 0.44 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 1tp8 n GLY 26 N 1.36 0.56 3.81 6.18 0.00 0.13 -1.33 105.19 115.89 1tp8 n GLY 26 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1tp8 n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tp8 s ASP 27 N 0.25 6.58 -0.02 1.61 1.01 -1.25 -4.40 116.67 120.44 1tp8 s ASP 27 Ca 0.00 1.77 0.00 0.00 0.71 0.00 0.00 52.55 55.03 1tp8 s ASP 27 Cb 0.00 -2.54 0.03 0.00 1.01 0.00 0.00 42.92 41.42 1tp8 s ASP 27 CO 0.00 -0.62 0.02 0.12 0.21 0.00 0.00 175.17 174.91 1tp8 s PHE 28 N -2.19 0.06 -0.26 4.23 5.36 -0.66 -1.02 117.98 123.51 1tp8 s PHE 28 Ca 0.64 0.11 -0.15 0.00 -0.96 0.00 0.00 56.93 56.57 1tp8 s PHE 28 Cb -0.12 -0.25 0.07 0.00 -0.34 0.00 0.00 43.02 42.38 1tp8 s PHE 28 CO 0.20 -0.09 0.63 -1.14 -1.46 0.00 0.00 175.22 173.36 1tp8 s GLN 29 N 1.01 0.65 0.09 10.12 -0.44 -0.32 -1.30 119.66 129.47 1tp8 s GLN 29 Ca -0.09 1.13 0.07 0.00 -2.50 0.00 0.00 55.36 53.97 1tp8 s GLN 29 Cb -0.12 0.11 -0.03 0.00 -1.64 0.00 0.00 33.01 31.33 1tp8 s GLN 29 CO -0.03 -0.15 -0.19 0.54 0.50 0.00 0.00 175.29 175.97 1tp8 s VAL 30 N 1.54 1.52 -0.36 1.34 0.11 -1.26 -1.17 120.40 122.12 1tp8 s VAL 30 Ca -0.10 -1.44 -0.11 0.00 -2.93 0.00 0.00 61.98 57.41 1tp8 s VAL 30 Cb -0.06 -1.39 0.02 0.00 -1.53 0.00 0.00 36.38 33.42 1tp8 s VAL 30 CO -0.18 -0.09 0.20 -0.69 -3.33 0.00 0.00 175.10 171.01 1tp8 s VAL 31 N -1.16 4.56 0.45 2.04 1.01 -0.33 -1.62 120.40 125.36 1tp8 s VAL 31 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1tp8 s VAL 31 Cb -0.10 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 1tp8 s VAL 31 CO 0.03 -0.18 0.69 -0.31 0.00 0.00 0.00 175.10 175.33 1tp8 s TYR 32 N 1.56 3.27 -0.20 5.22 2.02 -0.19 -0.65 117.35 128.38 1tp8 s TYR 32 Ca 0.02 0.32 -0.13 0.00 -0.37 0.00 0.00 57.07 56.91 1tp8 s TYR 32 Cb -0.19 -2.31 -0.05 0.00 -0.40 0.00 0.00 41.96 39.02 1tp8 s TYR 32 CO 0.06 -0.35 0.27 0.34 -1.57 0.00 0.00 175.55 174.30 1tp8 s ASP 33 N -4.20 6.32 -0.38 2.29 2.15 0.32 0.11 116.67 123.28 1tp8 s ASP 33 Ca 0.48 0.37 0.02 0.00 0.43 0.00 0.00 52.55 53.85 1tp8 s ASP 33 Cb -0.10 -2.16 0.11 0.00 -0.30 0.00 0.00 42.92 40.46 1tp8 s ASP 33 CO 0.39 0.05 0.12 -0.22 -0.17 0.00 0.00 175.17 175.33 1tp8 s LEU 34 N 0.86 4.85 -1.46 -1.34 2.96 0.33 -1.62 118.68 123.27 1tp8 s LEU 34 Ca 0.14 -2.24 -0.06 0.00 -0.22 0.00 0.00 54.13 51.75 1tp8 s LEU 34 Cb -0.13 -1.68 0.04 0.00 0.50 0.00 0.00 46.19 44.92 1tp8 s LEU 34 CO 0.04 -0.40 0.65 0.59 -1.32 0.00 0.00 176.35 175.92 1tp8 n ASN 35 N 4.19 -1.87 0.00 3.68 3.02 -1.26 -2.24 115.26 120.78 1tp8 n ASN 35 Ca 0.03 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1tp8 n ASN 35 Cb 0.41 -3.39 0.00 0.00 -0.61 0.00 0.00 39.78 36.19 1tp8 n ASN 35 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tp8 n GLY 36 N -1.74 0.74 2.90 7.41 0.00 -1.26 -5.05 105.19 108.19 1tp8 n GLY 36 Ca -0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 1tp8 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tp8 s SER 37 N -2.31 0.12 0.40 1.61 0.01 -0.95 -5.13 113.70 107.44 1tp8 s SER 37 Ca 0.00 -0.12 -0.25 0.00 1.31 0.00 0.00 55.95 56.89 1tp8 s SER 37 Cb 0.00 0.01 -0.11 0.00 0.21 0.00 0.00 66.02 66.13 1tp8 s SER 37 CO 0.00 -0.06 0.95 -2.65 0.41 0.00 0.00 173.24 171.89 1tp8 n PRO 38 N 2.74 1.24 -3.61 12.44 -0.02 -1.26 -0.51 135.00 146.02 1tp8 n PRO 38 Ca -0.15 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.49 1tp8 n PRO 38 Cb 0.59 -1.93 -0.15 0.00 -0.02 0.00 0.00 33.50 31.98 1tp8 n PRO 38 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1tp8 s TYR 39 N -1.26 0.75 -0.28 6.00 5.04 0.12 -4.74 117.35 122.98 1tp8 s TYR 39 Ca 0.62 -1.08 -0.29 0.00 -2.44 0.00 0.00 57.07 53.88 1tp8 s TYR 39 Cb -0.59 -1.13 -0.01 0.00 0.35 0.00 0.00 41.96 40.58 1tp8 s TYR 39 CO 0.57 -0.81 1.48 0.08 -1.34 0.00 0.00 175.55 175.54 1tp8 s VAL 40 N 1.95 3.88 0.69 3.14 1.01 -1.26 -1.03 120.40 128.78 1tp8 s VAL 40 Ca 0.08 0.98 -0.11 0.00 0.00 0.00 0.00 61.98 62.93 1tp8 s VAL 40 Cb -0.16 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1tp8 s VAL 40 CO -0.30 -0.42 1.06 -0.83 0.00 0.00 0.00 175.10 174.61 1tp8 s GLY 41 N 3.72 1.65 0.59 4.51 0.00 -0.64 -4.98 107.32 112.16 1tp8 s GLY 41 Ca 0.65 -0.11 -0.20 0.00 0.00 0.00 0.00 44.72 45.05 1tp8 s GLY 41 CO 0.27 0.21 1.34 -0.18 0.00 0.00 0.00 173.10 174.75 1tp8 n GLN 42 N -3.02 1.48 -3.22 2.90 7.27 -1.26 -4.67 117.38 116.86 1tp8 n GLN 42 Ca 0.07 0.56 -0.40 0.00 0.07 0.00 0.00 57.00 57.29 1tp8 n GLN 42 Cb 0.55 -2.57 -0.07 0.00 2.41 0.00 0.00 30.24 30.56 1tp8 n GLN 42 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 1tp8 s ASN 43 N -1.09 6.44 -0.35 1.69 3.04 -1.26 -4.52 114.94 118.89 1tp8 s ASN 43 Ca 0.76 0.49 -0.19 0.00 0.04 0.00 0.00 52.86 53.97 1tp8 s ASN 43 Cb -0.40 -2.28 -0.00 0.00 -1.54 0.00 0.00 41.25 37.02 1tp8 s ASN 43 CO 0.46 -0.31 0.54 -1.00 -3.04 0.00 0.00 177.10 173.75 1tp8 s HIS 44 N 2.34 3.17 0.20 0.43 3.76 -0.42 -5.02 115.29 119.75 1tp8 s HIS 44 Ca 0.21 0.22 0.09 0.00 -0.15 0.00 0.00 55.06 55.43 1tp8 s HIS 44 Cb -0.16 -2.97 -0.04 0.00 1.11 0.00 0.00 32.58 30.52 1tp8 s HIS 44 CO 0.09 -0.56 -0.06 -1.54 -0.85 0.00 0.00 174.74 171.83 1tp8 s SER 45 N 1.76 4.39 0.49 1.40 1.04 -1.26 -1.65 113.70 119.88 1tp8 s SER 45 Ca 0.20 -0.58 -0.19 0.00 0.48 0.00 0.00 55.95 55.87 1tp8 s SER 45 Cb -0.15 -0.79 -0.08 0.00 0.10 0.00 0.00 66.02 65.10 1tp8 s SER 45 CO 0.14 0.07 1.00 -0.55 0.98 0.00 0.00 173.24 174.88 1tp8 s SER 46 N -3.07 6.50 0.42 7.02 0.15 -1.26 -4.91 113.70 118.55 1tp8 s SER 46 Ca 0.27 1.75 0.09 0.00 0.70 0.00 0.00 55.95 58.76 1tp8 s SER 46 Cb -0.08 -2.54 0.90 0.00 -1.71 0.00 0.00 66.02 62.59 1tp8 s SER 46 CO 0.17 -0.67 2.02 -0.26 1.20 0.00 0.00 173.24 175.70 1tp8 h PHE 47 N 1.31 0.33 -3.49 3.44 0.04 -1.15 -3.45 116.94 113.97 1tp8 h PHE 47 Ca -0.48 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.28 1tp8 h PHE 47 Cb 1.20 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 39.24 1tp8 h PHE 47 CO 0.60 0.29 0.00 0.44 -0.60 0.00 0.00 178.31 179.04 1tp8 n ILE 48 N -4.42 0.00 -4.43 -0.55 -5.35 -1.26 -5.04 119.36 98.31 1tp8 n ILE 48 Ca 0.01 0.00 -0.21 0.00 -0.27 0.00 0.00 62.75 62.28 1tp8 n ILE 48 Cb 0.14 -0.48 -0.10 0.00 -1.74 0.00 0.00 39.64 37.45 1tp8 n ILE 48 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1tp8 s SER 49 N -0.47 2.16 0.00 7.28 0.01 -1.26 -4.96 113.70 116.45 1tp8 s SER 49 Ca 0.00 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 55.84 1tp8 s SER 49 Cb 0.00 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1tp8 s SER 49 CO 0.00 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 173.58 1tp8 n GLY 50 N -0.67 1.62 3.90 3.44 0.00 -1.26 -5.12 105.19 107.10 1tp8 n GLY 50 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1tp8 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tp8 s PHE 51 N -2.00 3.31 -0.23 1.61 0.08 -1.26 -4.84 117.98 114.65 1tp8 s PHE 51 Ca 0.00 -0.04 -0.09 0.00 0.12 0.00 0.00 56.93 56.92 1tp8 s PHE 51 Cb 0.00 -1.51 -0.04 0.00 -0.57 0.00 0.00 43.02 40.90 1tp8 s PHE 51 CO 0.00 0.48 0.12 0.99 -0.10 0.00 0.00 175.22 176.71 1tp8 s THR 52 N -2.00 4.98 0.57 0.64 2.01 0.29 -4.86 115.64 117.28 1tp8 s THR 52 Ca 0.33 0.05 -0.13 0.00 0.31 0.00 0.00 61.69 62.25 1tp8 s THR 52 Cb -0.09 -3.31 -0.06 0.00 0.01 0.00 0.00 72.50 69.06 1tp8 s THR 52 CO 0.27 0.37 1.00 -2.16 -0.69 0.00 0.00 174.62 173.41 1tp8 s PRO 53 N 1.02 3.73 -0.10 4.92 0.04 -1.26 -1.27 135.00 142.09 1tp8 s PRO 53 Ca 0.06 0.81 -0.08 0.00 0.04 0.00 0.00 61.00 61.83 1tp8 s PRO 53 Cb -0.14 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 32.32 1tp8 s PRO 53 CO 0.04 -0.44 0.25 0.08 0.04 0.00 0.00 177.00 176.97 1tp8 s VAL 54 N -2.95 -0.00 -0.16 -0.36 1.01 -0.26 -4.95 120.40 112.73 1tp8 s VAL 54 Ca 0.56 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.57 1tp8 s VAL 54 Cb -0.11 -0.36 0.01 0.00 0.00 0.00 0.00 36.38 35.92 1tp8 s VAL 54 CO 0.45 0.01 -0.17 -0.75 0.00 0.00 0.00 175.10 174.63 1tp8 s LYS 55 N 0.27 3.13 -0.35 2.72 2.20 -1.26 -1.63 119.74 124.81 1tp8 s LYS 55 Ca -0.01 -0.78 -0.06 0.00 -0.36 0.00 0.00 55.97 54.76 1tp8 s LYS 55 Cb -0.03 -2.59 0.06 0.00 -1.51 0.00 0.00 37.83 33.75 1tp8 s LYS 55 CO -0.01 -0.05 0.12 0.42 -0.36 0.00 0.00 175.35 175.47 1tp8 s ILE 56 N 0.96 3.65 -0.74 5.43 1.01 0.21 -4.97 121.20 126.74 1tp8 s ILE 56 Ca -0.03 -1.32 -0.06 0.00 0.00 0.00 0.00 60.65 59.24 1tp8 s ILE 56 Cb -0.15 -3.15 0.19 0.00 0.01 0.00 0.00 42.46 39.37 1tp8 s ILE 56 CO -0.03 -0.27 0.61 -0.44 0.00 0.00 0.00 174.94 174.81 1tp8 s SER 57 N 1.54 5.87 0.72 3.58 0.01 -1.26 0.15 113.70 124.29 1tp8 s SER 57 Ca -0.00 -2.97 -0.15 0.00 1.31 0.00 0.00 55.95 54.13 1tp8 s SER 57 Cb -0.20 -1.98 0.03 0.00 0.21 0.00 0.00 66.02 64.08 1tp8 s SER 57 CO 0.01 -0.40 1.21 -0.76 0.41 0.00 0.00 173.24 173.72 1tp8 s LEU 58 N -0.25 3.36 -1.24 2.44 2.01 -1.07 -4.90 118.68 119.03 1tp8 s LEU 58 Ca 0.19 2.37 -0.09 0.00 0.01 0.00 0.00 54.13 56.62 1tp8 s LEU 58 Cb -0.15 -4.59 0.19 0.00 0.01 0.00 0.00 46.19 41.65 1tp8 s LEU 58 CO -0.06 -2.20 1.78 -0.67 1.01 0.00 0.00 176.35 176.22 1tp8 n ASP 59 N -2.59 5.33 -4.76 2.29 2.03 -1.26 -4.82 116.55 112.77 1tp8 n ASP 59 Ca 0.14 -3.16 -0.39 0.00 0.52 0.00 0.00 54.79 51.90 1tp8 n ASP 59 Cb 0.50 -1.44 0.01 0.00 -0.72 0.00 0.00 41.12 39.46 1tp8 n ASP 59 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1tp8 s PHE 60 N -0.14 2.68 -2.03 -0.67 2.19 -1.26 -1.87 117.98 116.89 1tp8 s PHE 60 Ca 0.38 1.40 0.23 0.00 0.33 0.00 0.00 56.93 59.27 1tp8 s PHE 60 Cb 0.08 -3.69 0.63 0.00 -1.31 0.00 0.00 43.02 38.73 1tp8 s PHE 60 CO 0.02 -2.29 1.53 -0.35 1.83 0.00 0.00 175.22 175.97 1tp8 n PRO 61 N -0.21 2.71 0.00 10.12 -0.04 -1.26 -4.86 135.00 141.46 1tp8 n PRO 61 Ca 0.06 -2.64 0.14 0.00 -0.04 0.00 0.00 63.50 61.01 1tp8 n PRO 61 Cb 0.44 -1.57 0.56 0.00 -0.04 0.00 0.00 33.50 32.90 1tp8 n PRO 61 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1tp8 n SER 62 N 1.65 0.31 -4.16 3.54 3.41 -0.96 -4.70 113.62 112.70 1tp8 n SER 62 Ca 0.24 -0.20 -0.31 0.00 -0.26 0.00 0.00 58.87 58.35 1tp8 n SER 62 Cb 0.62 -0.14 -0.17 0.00 -0.26 0.00 0.00 64.21 64.26 1tp8 n SER 62 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1tp8 s GLU 63 N -2.71 2.75 -0.08 4.33 2.12 -0.78 -4.98 118.70 119.35 1tp8 s GLU 63 Ca 0.22 -0.77 -0.14 0.00 0.36 0.00 0.00 54.97 54.64 1tp8 s GLU 63 Cb 0.19 -2.15 0.03 0.00 0.26 0.00 0.00 34.13 32.46 1tp8 s GLU 63 CO 0.53 0.08 0.35 1.52 -0.54 0.00 0.00 175.26 177.20 1tp8 s TYR 64 N 0.58 -0.31 0.26 5.30 -0.85 -1.26 -4.14 117.35 116.93 1tp8 s TYR 64 Ca -0.14 0.67 -0.31 0.00 -0.52 0.00 0.00 57.07 56.78 1tp8 s TYR 64 Cb -0.17 0.13 -0.13 0.00 0.38 0.00 0.00 41.96 42.17 1tp8 s TYR 64 CO 0.04 -0.29 1.45 -0.89 -1.52 0.00 0.00 175.55 174.33 1tp8 n ILE 65 N 2.11 1.08 0.00 -3.49 5.41 -1.26 -2.99 119.36 120.22 1tp8 n ILE 65 Ca -0.17 -0.27 0.00 0.00 1.00 0.00 0.00 62.75 63.31 1tp8 n ILE 65 Cb 0.57 -1.62 0.00 0.00 -0.71 0.00 0.00 39.64 37.88 1tp8 n ILE 65 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1tp8 n THR 66 N 1.80 0.00 -3.70 1.39 -2.24 -0.01 -4.78 114.28 106.73 1tp8 n THR 66 Ca 0.10 -0.31 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 1tp8 n THR 66 Cb 0.33 0.84 -0.09 0.00 -2.10 0.00 0.00 70.33 69.31 1tp8 n THR 66 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1tp8 s GLU 67 N -1.16 0.61 -0.07 -0.78 2.12 -0.69 -1.85 118.70 116.88 1tp8 s GLU 67 Ca 0.00 0.55 0.02 0.00 0.36 0.00 0.00 54.97 55.90 1tp8 s GLU 67 Cb 0.00 0.29 0.01 0.00 0.26 0.00 0.00 34.13 34.70 1tp8 s GLU 67 CO 0.00 -0.10 -0.12 0.08 -0.54 0.00 0.00 175.26 174.58 1tp8 s VAL 68 N -0.03 1.13 0.14 3.70 1.01 -1.08 -1.14 120.40 124.13 1tp8 s VAL 68 Ca -0.02 -0.47 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 1tp8 s VAL 68 Cb -0.03 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1tp8 s VAL 68 CO 0.02 0.36 0.30 -0.94 0.00 0.00 0.00 175.10 174.84 1tp8 s SER 69 N 0.75 -0.01 0.00 3.32 1.04 -0.99 -0.72 113.70 117.09 1tp8 s SER 69 Ca -0.13 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1tp8 s SER 69 Cb -0.16 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1tp8 s SER 69 CO 0.03 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1tp8 n GLY 70 N -0.19 1.21 3.17 7.32 0.00 -0.34 -0.62 105.19 115.75 1tp8 n GLY 70 Ca -0.11 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.97 1tp8 n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tp8 s TYR 71 N -3.29 1.24 0.04 1.61 2.02 -1.11 -1.17 117.35 116.68 1tp8 s TYR 71 Ca 0.00 -0.44 0.07 0.00 -0.37 0.00 0.00 57.07 56.33 1tp8 s TYR 71 Cb 0.00 -0.70 -0.02 0.00 -0.40 0.00 0.00 41.96 40.84 1tp8 s TYR 71 CO 0.00 0.06 -0.21 0.95 -1.57 0.00 0.00 175.55 174.78 1tp8 s THR 72 N -1.22 1.71 0.30 -0.71 -4.23 -0.60 -0.50 115.64 110.39 1tp8 s THR 72 Ca -0.01 -1.19 -0.11 0.00 -1.18 0.00 0.00 61.69 59.20 1tp8 s THR 72 Cb -0.10 -1.48 0.04 0.00 1.34 0.00 0.00 72.50 72.31 1tp8 s THR 72 CO 0.02 0.24 0.59 0.61 -0.54 0.00 0.00 174.62 175.54 1tp8 n GLY 73 N 1.91 1.29 3.65 3.99 0.00 -0.50 -1.21 105.19 114.31 1tp8 n GLY 73 Ca -0.17 -1.22 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 1tp8 n GLY 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1tp8 s ASN 74 N -2.57 6.52 -0.17 1.61 3.84 -1.26 0.24 114.94 123.14 1tp8 s ASN 74 Ca 0.13 0.63 -0.01 0.00 0.21 0.00 0.00 52.86 53.81 1tp8 s ASN 74 Cb -0.04 -2.29 0.05 0.00 -0.55 0.00 0.00 41.25 38.42 1tp8 s ASN 74 CO 0.09 -0.22 -0.03 -0.69 -2.79 0.00 0.00 177.10 173.47 1tp8 s VAL 75 N 1.85 0.97 -1.45 -5.21 1.01 0.65 -4.80 120.40 113.43 1tp8 s VAL 75 Ca 0.23 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.47 1tp8 s VAL 75 Cb -0.15 -1.23 0.08 0.00 0.00 0.00 0.00 36.38 35.07 1tp8 s VAL 75 CO 0.09 0.04 0.70 -0.24 0.00 0.00 0.00 175.10 175.70 1tp8 n SER 76 N 4.91 -4.31 0.00 3.32 2.88 -1.26 -0.62 113.62 118.54 1tp8 n SER 76 Ca -0.11 -0.58 0.00 0.00 -1.33 0.00 0.00 58.87 56.85 1tp8 n SER 76 Cb 0.47 -3.50 0.00 0.00 -0.75 0.00 0.00 64.21 60.43 1tp8 n SER 76 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1tp8 n GLY 77 N -1.41 1.10 3.85 0.46 0.00 -1.26 -5.05 105.19 102.88 1tp8 n GLY 77 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1tp8 n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tp8 s TYR 78 N -2.79 3.35 -0.32 1.61 2.02 0.21 -5.06 117.35 116.36 1tp8 s TYR 78 Ca 0.00 0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 56.69 1tp8 s TYR 78 Cb 0.00 -1.67 -0.02 0.00 -0.40 0.00 0.00 41.96 39.87 1tp8 s TYR 78 CO 0.00 0.55 0.41 0.08 -1.57 0.00 0.00 175.55 175.02 1tp8 s VAL 79 N -1.49 5.12 0.37 0.71 1.01 -1.26 -0.25 120.40 124.61 1tp8 s VAL 79 Ca 0.32 0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.63 1tp8 s VAL 79 Cb -0.12 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 1tp8 s VAL 79 CO 0.25 -0.06 0.13 1.33 0.00 0.00 0.00 175.10 176.75 1tp8 n VAL 80 N 5.26 0.00 -3.32 2.92 0.24 0.14 -4.77 118.33 118.80 1tp8 n VAL 80 Ca -0.07 -2.15 -0.43 0.00 -2.04 0.00 0.00 64.34 59.65 1tp8 n VAL 80 Cb 0.50 0.77 -0.08 0.00 -1.47 0.00 0.00 33.84 33.55 1tp8 n VAL 80 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1tp8 s VAL 81 N -2.93 5.10 -0.26 3.34 1.01 -0.55 -1.41 120.40 124.69 1tp8 s VAL 81 Ca 0.19 -0.54 0.21 0.00 0.00 0.00 0.00 61.98 61.83 1tp8 s VAL 81 Cb 0.01 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.37 1tp8 s VAL 81 CO 0.13 -0.50 1.19 0.03 0.00 0.00 0.00 175.10 175.95 1tp8 h ARG 82 N 8.77 0.00 -3.87 2.72 3.08 -1.07 -2.72 114.38 121.29 1tp8 h ARG 82 Ca -0.27 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.68 1tp8 h ARG 82 Cb 1.11 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.01 1tp8 h ARG 82 CO 0.83 0.10 -0.45 0.45 -1.07 0.00 0.00 179.97 179.83 1tp8 s SER 83 N -5.76 0.19 -0.08 7.04 0.15 -1.15 0.14 113.70 114.24 1tp8 s SER 83 Ca 0.01 -0.68 -0.19 0.00 0.70 0.00 0.00 55.95 55.79 1tp8 s SER 83 Cb 0.08 0.29 0.04 0.00 -1.71 0.00 0.00 66.02 64.73 1tp8 s SER 83 CO 0.76 -0.66 0.46 -0.22 1.20 0.00 0.00 173.24 174.78 1tp8 s LEU 84 N -2.72 0.24 -0.03 3.45 2.96 -0.79 -2.76 118.68 119.03 1tp8 s LEU 84 Ca 0.03 0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 54.47 1tp8 s LEU 84 Cb 0.04 1.71 0.01 0.00 0.50 0.00 0.00 46.19 48.46 1tp8 s LEU 84 CO -0.09 -0.39 0.08 -0.89 -1.32 0.00 0.00 176.35 173.74 1tp8 s THR 85 N -0.73 -0.01 -0.17 3.68 2.01 0.21 -1.89 115.64 118.74 1tp8 s THR 85 Ca -0.08 0.04 0.01 0.00 0.31 0.00 0.00 61.69 61.96 1tp8 s THR 85 Cb -0.03 -0.12 0.01 0.00 0.01 0.00 0.00 72.50 72.36 1tp8 s THR 85 CO 0.04 0.02 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.45 1tp8 s PHE 86 N 0.26 2.78 -0.25 4.92 0.08 0.82 -2.35 117.98 124.24 1tp8 s PHE 86 Ca -0.02 -1.38 -0.06 0.00 0.12 0.00 0.00 56.93 55.59 1tp8 s PHE 86 Cb -0.03 -1.91 -0.01 0.00 -0.57 0.00 0.00 43.02 40.50 1tp8 s PHE 86 CO -0.01 -0.67 0.04 0.21 -0.10 0.00 0.00 175.22 174.69 1tp8 s LYS 87 N 1.11 3.43 0.19 0.44 2.20 -0.29 0.14 119.74 126.96 1tp8 s LYS 87 Ca 0.00 -0.61 0.03 0.00 -0.36 0.00 0.00 55.97 55.03 1tp8 s LYS 87 Cb -0.14 -3.24 0.03 0.00 -1.51 0.00 0.00 37.83 32.97 1tp8 s LYS 87 CO -0.07 -0.25 0.23 0.25 -0.36 0.00 0.00 175.35 175.15 1tp8 n THR 88 N 4.87 0.00 0.69 3.43 -2.24 0.07 -0.83 114.28 120.27 1tp8 n THR 88 Ca -0.16 -0.65 0.11 0.00 -2.27 0.00 0.00 64.05 61.07 1tp8 n THR 88 Cb 0.50 -0.73 0.46 0.00 -2.10 0.00 0.00 70.33 68.46 1tp8 n THR 88 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1tp8 n ASN 89 N -2.59 0.16 -0.00 3.42 6.94 -1.16 -3.64 115.26 118.39 1tp8 n ASN 89 Ca 0.04 0.53 0.01 0.00 -0.02 0.00 0.00 54.58 55.13 1tp8 n ASN 89 Cb 0.20 -0.56 -0.02 0.00 -2.36 0.00 0.00 39.78 37.04 1tp8 n ASN 89 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1tp8 n LYS 90 N -1.66 0.97 -3.87 -3.83 5.02 -1.26 -5.07 118.16 108.46 1tp8 n LYS 90 Ca 0.05 -0.01 -0.08 0.00 -2.02 0.00 0.00 58.31 56.25 1tp8 n LYS 90 Cb 0.27 -1.05 -0.03 0.00 -0.02 0.00 0.00 35.03 34.20 1tp8 n LYS 90 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1tp8 s LYS 91 N -2.12 1.69 -0.07 1.97 2.20 -1.24 -5.17 119.74 117.01 1tp8 s LYS 91 Ca -0.01 -1.03 0.03 0.00 -0.36 0.00 0.00 55.97 54.60 1tp8 s LYS 91 Cb 0.01 0.57 -0.02 0.00 -1.51 0.00 0.00 37.83 36.88 1tp8 s LYS 91 CO 0.08 -0.75 -0.16 0.99 -0.36 0.00 0.00 175.35 175.15 1tp8 s THR 92 N -3.94 2.91 -0.25 3.43 2.01 -1.26 -0.75 115.64 117.79 1tp8 s THR 92 Ca 0.13 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.40 1tp8 s THR 92 Cb -0.04 -2.15 0.06 0.00 0.01 0.00 0.00 72.50 70.38 1tp8 s THR 92 CO 0.06 0.57 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.15 1tp8 s TYR 93 N -0.39 3.05 -0.81 4.92 1.51 0.12 -5.00 117.35 120.76 1tp8 s TYR 93 Ca 0.04 -2.17 0.00 0.00 -1.01 0.00 0.00 57.07 53.93 1tp8 s TYR 93 Cb -0.12 -1.85 0.00 0.00 -0.11 0.00 0.00 41.96 39.88 1tp8 s TYR 93 CO 0.02 -0.85 0.00 0.41 -1.11 0.00 0.00 175.55 174.02 1tp8 n GLY 94 N 4.49 0.74 3.80 0.71 0.00 -1.26 -0.12 105.19 113.55 1tp8 n GLY 94 Ca -0.14 -2.26 -0.31 0.00 0.00 0.00 0.00 46.02 43.31 1tp8 n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1tp8 s PRO 95 N -0.80 2.55 -0.04 1.61 0.04 -1.26 -5.00 135.00 132.10 1tp8 s PRO 95 Ca 0.00 0.91 0.05 0.00 0.04 0.00 0.00 61.00 61.99 1tp8 s PRO 95 Cb 0.00 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 1tp8 s PRO 95 CO 0.00 -1.36 -0.18 0.71 0.04 0.00 0.00 177.00 176.21 1tp8 s TYR 96 N -3.04 1.78 0.00 0.56 2.02 -0.79 -4.96 117.35 112.91 1tp8 s TYR 96 Ca 0.59 -0.48 0.00 0.00 -0.37 0.00 0.00 57.07 56.81 1tp8 s TYR 96 Cb -0.15 -1.19 0.00 0.00 -0.40 0.00 0.00 41.96 40.22 1tp8 s TYR 96 CO 0.55 -0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.79 1tp8 n GLY 97 N 3.03 -0.07 3.59 0.71 0.00 -1.26 -1.89 105.19 109.30 1tp8 n GLY 97 Ca -0.17 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 1tp8 n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tp8 s VAL 98 N 0.00 4.91 -1.30 1.61 1.01 0.12 -4.88 120.40 121.87 1tp8 s VAL 98 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.91 1tp8 s VAL 98 Cb 0.00 -3.27 0.15 0.00 0.00 0.00 0.00 36.38 33.26 1tp8 s VAL 98 CO 0.00 0.37 1.97 0.35 0.00 0.00 0.00 175.10 177.79 1tp8 n THR 99 N 4.30 4.38 -3.81 3.92 -2.24 -1.26 -3.62 114.28 115.94 1tp8 n THR 99 Ca -0.16 -4.27 -0.12 0.00 -2.27 0.00 0.00 64.05 57.23 1tp8 n THR 99 Cb 0.52 -2.35 -0.10 0.00 -2.10 0.00 0.00 70.33 66.30 1tp8 n THR 99 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1tp8 s SER 100 N 0.96 -0.15 0.00 3.42 0.15 -1.26 -5.07 113.70 111.75 1tp8 s SER 100 Ca 0.42 0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.24 1tp8 s SER 100 Cb 0.11 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 1tp8 s SER 100 CO -0.01 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1tp8 n GLY 101 N 2.07 0.13 3.38 9.45 0.00 -1.26 -4.54 105.19 114.42 1tp8 n GLY 101 Ca -0.18 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 1tp8 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tp8 s THR 102 N 0.00 3.50 0.63 2.61 2.01 -0.35 -4.92 115.64 119.12 1tp8 s THR 102 Ca 0.00 -0.47 -0.12 0.00 0.31 0.00 0.00 61.69 61.41 1tp8 s THR 102 Cb 0.00 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 1tp8 s THR 102 CO 0.00 0.46 1.04 -2.16 -0.69 0.00 0.00 174.62 173.27 1tp8 s PRO 103 N 0.93 3.41 -0.02 4.92 0.04 -1.26 -1.56 135.00 141.47 1tp8 s PRO 103 Ca -0.01 0.89 -0.08 0.00 0.04 0.00 0.00 61.00 61.85 1tp8 s PRO 103 Cb -0.15 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.35 1tp8 s PRO 103 CO 0.01 -0.72 0.16 -0.59 0.04 0.00 0.00 177.00 175.90 1tp8 s PHE 104 N -2.99 -0.04 -0.02 0.56 -0.12 -0.32 -4.92 117.98 110.14 1tp8 s PHE 104 Ca 0.57 0.06 -0.10 0.00 -0.05 0.00 0.00 56.93 57.41 1tp8 s PHE 104 Cb -0.12 -0.01 0.01 0.00 -0.63 0.00 0.00 43.02 42.27 1tp8 s PHE 104 CO 0.49 -0.25 0.21 0.54 -0.05 0.00 0.00 175.22 176.17 1tp8 s ASN 105 N -1.00 -0.10 -0.42 1.98 4.22 -1.26 -1.20 114.94 117.15 1tp8 s ASN 105 Ca -0.11 0.02 0.02 0.00 -2.14 0.00 0.00 52.86 50.66 1tp8 s ASN 105 Cb -0.06 0.30 0.15 0.00 1.28 0.00 0.00 41.25 42.92 1tp8 s ASN 105 CO 0.01 -0.34 0.28 -0.22 -2.04 0.00 0.00 177.10 174.80 1tp8 s LEU 106 N -1.07 1.87 0.06 3.54 1.98 0.11 -5.00 118.68 120.16 1tp8 s LEU 106 Ca -0.11 -2.71 -0.29 0.00 -2.89 0.00 0.00 54.13 48.12 1tp8 s LEU 106 Cb -0.06 -0.68 -0.05 0.00 0.66 0.00 0.00 46.19 46.07 1tp8 s LEU 106 CO 0.02 -0.24 0.94 -2.16 -1.89 0.00 0.00 176.35 173.03 1tp8 s PRO 107 N 0.36 4.62 -0.32 0.98 0.04 -1.26 -2.65 135.00 136.77 1tp8 s PRO 107 Ca 0.23 1.38 -0.09 0.00 0.04 0.00 0.00 61.00 62.56 1tp8 s PRO 107 Cb -0.13 -3.41 0.01 0.00 0.04 0.00 0.00 34.50 31.00 1tp8 s PRO 107 CO -0.07 0.12 0.14 0.42 0.04 0.00 0.00 177.00 177.65 1tp8 s ILE 108 N 0.38 4.40 0.11 0.56 1.01 -0.77 -4.96 121.20 121.92 1tp8 s ILE 108 Ca 0.48 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 60.47 1tp8 s ILE 108 Cb -0.22 -3.30 -0.23 0.00 0.01 0.00 0.00 42.46 38.72 1tp8 s ILE 108 CO 0.28 -0.00 1.23 -0.08 0.00 0.00 0.00 174.94 176.37 1tp8 h GLU 109 N 8.33 0.37 -2.12 2.79 4.81 -1.97 -3.45 114.58 123.35 1tp8 h GLU 109 Ca -0.30 -0.48 -0.04 0.00 -0.13 0.00 0.00 59.36 58.41 1tp8 h GLU 109 Cb 1.13 0.15 -0.25 0.00 0.63 0.00 0.00 28.75 30.41 1tp8 h GLU 109 CO 0.62 1.16 -0.32 1.21 -0.73 0.00 0.00 179.01 180.96 1tp8 s ASN 110 N -7.13 -0.52 0.00 1.04 3.84 -1.26 -5.15 114.94 105.75 1tp8 s ASN 110 Ca -0.05 1.01 0.00 0.00 0.21 0.00 0.00 52.86 54.02 1tp8 s ASN 110 Cb 0.08 1.64 0.00 0.00 -0.55 0.00 0.00 41.25 42.42 1tp8 s ASN 110 CO 0.88 -0.24 0.00 0.61 -2.79 0.00 0.00 177.10 175.55 1tp8 n GLY 111 N 5.41 1.43 3.15 1.21 0.00 -1.26 -4.97 105.19 110.15 1tp8 n GLY 111 Ca -0.08 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 43.86 1tp8 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tp8 s LEU 112 N 0.00 2.40 -0.25 0.99 1.43 0.34 -4.94 118.68 118.64 1tp8 s LEU 112 Ca 0.00 -0.80 -0.20 0.00 -1.03 0.00 0.00 54.13 52.11 1tp8 s LEU 112 Cb 0.00 -0.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.97 1tp8 s LEU 112 CO 0.00 -0.29 0.59 -0.63 0.23 0.00 0.00 176.35 176.25 1tp8 s ILE 113 N -2.47 5.02 -0.01 -0.59 1.01 -1.26 -1.15 121.20 121.75 1tp8 s ILE 113 Ca 0.04 1.06 0.01 0.00 0.00 0.00 0.00 60.65 61.76 1tp8 s ILE 113 Cb -0.03 -3.90 0.02 0.00 0.01 0.00 0.00 42.46 38.56 1tp8 s ILE 113 CO -0.01 0.06 0.86 1.33 0.00 0.00 0.00 174.94 177.18 1tp8 n VAL 114 N 5.13 0.74 -3.61 2.92 0.24 0.61 -4.53 118.33 119.82 1tp8 n VAL 114 Ca -0.02 -0.76 -0.04 0.00 -2.04 0.00 0.00 64.34 61.48 1tp8 n VAL 114 Cb 0.49 0.59 -0.02 0.00 -1.47 0.00 0.00 33.84 33.43 1tp8 n VAL 114 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1tp8 s GLY 115 N -0.84 -0.26 0.11 7.63 0.00 -1.23 -1.25 107.32 111.47 1tp8 s GLY 115 Ca 0.02 1.71 0.03 0.00 0.00 0.00 0.00 44.72 46.49 1tp8 s GLY 115 CO 0.00 0.57 -0.08 -1.36 0.00 0.00 0.00 173.10 172.23 1tp8 s PHE 116 N -2.28 1.03 -0.03 1.90 0.08 -1.26 -1.35 117.98 116.07 1tp8 s PHE 116 Ca 0.10 -0.79 -0.30 0.00 0.12 0.00 0.00 56.93 56.06 1tp8 s PHE 116 Cb -0.01 -0.56 0.07 0.00 -0.57 0.00 0.00 43.02 41.95 1tp8 s PHE 116 CO -0.04 -0.05 0.68 -1.59 -0.10 0.00 0.00 175.22 174.12 1tp8 s LYS 117 N -3.46 1.07 0.00 0.44 -2.85 -0.94 -1.58 119.74 112.43 1tp8 s LYS 117 Ca 0.11 0.17 0.00 0.00 -1.00 0.00 0.00 55.97 55.24 1tp8 s LYS 117 Cb 0.02 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 36.29 1tp8 s LYS 117 CO -0.02 -0.35 0.00 0.41 0.10 0.00 0.00 175.35 175.49 1tp8 n GLY 118 N 0.75 1.00 3.63 0.59 0.00 -0.82 0.78 105.19 111.13 1tp8 n GLY 118 Ca -0.19 0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1tp8 n GLY 118 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tp8 s SER 119 N 2.00 -0.69 -0.07 1.61 0.15 -0.94 -0.82 113.70 114.93 1tp8 s SER 119 Ca 0.00 1.32 0.01 0.00 0.70 0.00 0.00 55.95 57.99 1tp8 s SER 119 Cb 0.00 1.34 0.02 0.00 -1.71 0.00 0.00 66.02 65.66 1tp8 s SER 119 CO 0.00 -0.23 -0.10 -0.63 1.20 0.00 0.00 173.24 173.48 1tp8 s ILE 120 N 0.43 1.02 0.00 6.45 1.01 -0.92 0.24 121.20 129.43 1tp8 s ILE 120 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.27 1tp8 s ILE 120 Cb -0.05 -0.96 0.00 0.00 0.01 0.00 0.00 42.46 41.46 1tp8 s ILE 120 CO -0.02 0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.87 1tp8 n GLY 121 N 4.09 0.94 0.08 6.18 0.00 -1.26 -0.40 105.19 114.82 1tp8 n GLY 121 Ca -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 1tp8 n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1tp8 h TYR 122 N 0.00 -0.06 -4.93 1.61 -1.99 -1.96 0.09 116.97 109.74 1tp8 h TYR 122 Ca 0.00 -0.00 -0.53 0.00 2.00 0.00 0.00 58.73 60.20 1tp8 h TYR 122 Cb 0.00 0.02 -0.10 0.00 2.00 0.00 0.00 36.73 38.65 1tp8 h TYR 122 CO 0.00 0.38 -0.37 0.91 -0.00 0.00 0.00 178.16 179.08 1tp8 n TRP 123 N -4.90 0.80 -2.55 4.88 8.01 -1.26 -4.28 117.44 118.14 1tp8 n TRP 123 Ca -0.08 -2.02 -0.43 0.00 -1.31 0.00 0.00 57.50 53.65 1tp8 n TRP 123 Cb 0.24 -0.28 -0.02 0.00 -2.01 0.00 0.00 31.31 29.24 1tp8 n TRP 123 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.69 178.09 1tp8 s MET 124 N -3.52 4.26 -0.06 -0.99 -2.45 -0.44 -4.45 119.30 111.65 1tp8 s MET 124 Ca 0.02 1.51 -0.24 0.00 -1.25 0.00 0.00 55.69 55.73 1tp8 s MET 124 Cb -0.00 -3.68 -0.25 0.00 1.25 0.00 0.00 34.83 32.14 1tp8 s MET 124 CO 0.01 -0.64 0.98 -0.44 1.05 0.00 0.00 175.02 175.99 1tp8 h ASP 125 N 7.76 0.27 -5.27 1.11 3.32 -0.51 -1.47 116.42 121.62 1tp8 h ASP 125 Ca -0.24 -0.83 0.16 0.00 0.02 0.00 0.00 57.03 56.14 1tp8 h ASP 125 Cb 1.09 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.48 1tp8 h ASP 125 CO 0.96 1.07 0.44 -0.72 -1.72 0.00 0.00 179.24 179.27 1tp8 s TYR 126 N -2.90 -0.13 0.21 4.55 -0.85 -1.23 -4.33 117.35 112.66 1tp8 s TYR 126 Ca -0.16 -0.20 -0.21 0.00 -0.52 0.00 0.00 57.07 55.98 1tp8 s TYR 126 Cb 0.01 0.66 0.04 0.00 0.38 0.00 0.00 41.96 43.05 1tp8 s TYR 126 CO 0.76 -0.91 0.63 -0.59 -1.52 0.00 0.00 175.55 173.92 1tp8 s PHE 127 N -3.38 -0.34 0.05 -3.49 -0.71 -1.26 -2.22 117.98 106.62 1tp8 s PHE 127 Ca 0.12 0.02 -0.01 0.00 -1.04 0.00 0.00 56.93 56.03 1tp8 s PHE 127 Cb -0.02 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 1tp8 s PHE 127 CO 0.03 -1.01 -0.03 -1.12 -1.34 0.00 0.00 175.22 171.75 1tp8 s SER 128 N -2.83 0.50 0.08 1.98 0.01 0.23 -4.94 113.70 108.73 1tp8 s SER 128 Ca 0.06 -0.90 0.09 0.00 1.31 0.00 0.00 55.95 56.51 1tp8 s SER 128 Cb -0.03 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.34 1tp8 s SER 128 CO -0.04 -0.52 -0.23 -0.04 0.41 0.00 0.00 173.24 172.82 1tp8 s MET 129 N -3.39 1.35 -0.23 12.44 -1.94 -1.26 -2.22 119.30 124.05 1tp8 s MET 129 Ca 0.03 -1.13 -0.12 0.00 -1.71 0.00 0.00 55.69 52.76 1tp8 s MET 129 Cb 0.04 -1.61 -0.05 0.00 2.01 0.00 0.00 34.83 35.22 1tp8 s MET 129 CO -0.08 0.39 0.22 0.71 -0.01 0.00 0.00 175.02 176.25 1tp8 s TYR 130 N -0.99 3.33 0.20 -0.03 1.51 -0.45 -4.98 117.35 115.93 1tp8 s TYR 130 Ca 0.09 0.32 0.08 0.00 -1.01 0.00 0.00 57.07 56.55 1tp8 s TYR 130 Cb -0.10 -2.33 -0.04 0.00 -0.11 0.00 0.00 41.96 39.38 1tp8 s TYR 130 CO 0.04 0.05 -0.00 -0.51 -1.11 0.00 0.00 175.55 174.01 1tp8 s LEU 131 N 1.12 3.28 -0.01 -1.29 1.02 -1.26 -0.28 118.68 121.26 1tp8 s LEU 131 Ca 0.10 -0.45 -0.30 0.00 0.02 0.00 0.00 54.13 53.50 1tp8 s LEU 131 Cb -0.14 -1.91 0.11 0.00 0.02 0.00 0.00 46.19 44.28 1tp8 s LEU 131 CO 0.05 0.07 1.18 -0.55 0.02 0.00 0.00 176.35 177.12 1tp8 s SER 132 N -3.11 -0.12 0.00 2.29 0.15 -0.30 -4.91 113.70 107.70 1tp8 s SER 132 Ca 0.28 -0.16 0.28 0.00 0.70 0.00 0.00 55.95 57.06 1tp8 s SER 132 Cb -0.09 0.24 1.12 0.00 -1.71 0.00 0.00 66.02 65.58 1tp8 s SER 132 CO 0.19 -0.44 1.78 0.18 1.20 0.00 0.00 173.24 176.15