#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pt1 s ILE 2 N 0.00 4.64 0.09 3.17 -1.09 -1.26 -1.42 121.20 125.33 1pt1 s ILE 2 Ca 0.00 -0.08 -0.00 0.00 -2.23 0.00 0.00 60.65 58.34 1pt1 s ILE 2 Cb 0.00 -3.11 -0.04 0.00 -1.58 0.00 0.00 42.46 37.72 1pt1 s ILE 2 CO 0.00 0.42 0.25 -0.13 -1.23 0.00 0.00 174.94 174.25 1pt1 s ARG 3 N 0.74 3.46 -0.25 2.79 1.81 0.09 -4.91 118.95 122.68 1pt1 s ARG 3 Ca 0.03 -0.43 -0.08 0.00 -1.72 0.00 0.00 55.73 53.53 1pt1 s ARG 3 Cb -0.13 -3.00 -0.03 0.00 -0.45 0.00 0.00 34.95 31.33 1pt1 s ARG 3 CO 0.02 0.57 0.09 0.99 -0.68 0.00 0.00 175.30 176.30 1pt1 s THR 4 N -1.58 4.59 0.05 0.02 2.01 -1.26 -1.95 115.64 117.52 1pt1 s THR 4 Ca 0.36 -0.08 0.07 0.00 0.31 0.00 0.00 61.69 62.34 1pt1 s THR 4 Cb -0.12 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.22 1pt1 s THR 4 CO 0.28 0.34 -0.19 -0.04 -0.69 0.00 0.00 174.62 174.32 1pt1 s MET 5 N 1.48 1.22 0.05 4.92 1.00 0.65 -4.97 119.30 123.64 1pt1 s MET 5 Ca 0.06 -0.91 -0.32 0.00 0.00 0.00 0.00 55.69 54.52 1pt1 s MET 5 Cb -0.15 -1.32 -0.11 0.00 0.00 0.00 0.00 34.83 33.25 1pt1 s MET 5 CO 0.05 0.33 1.85 -0.11 0.00 0.00 0.00 175.02 177.14 1pt1 n LEU 6 N 1.78 3.76 0.00 -0.03 7.94 -1.26 -1.15 117.00 128.05 1pt1 n LEU 6 Ca -0.18 0.98 -0.21 0.00 -1.11 0.00 0.00 56.01 55.49 1pt1 n LEU 6 Cb 0.54 -1.47 -0.14 0.00 0.53 0.00 0.00 43.42 42.88 1pt1 n LEU 6 CO 0.23 0.05 -0.30 -0.61 -1.11 0.00 0.00 177.39 175.65 1pt1 h GLN 7 N 8.83 0.22 -1.60 1.96 -0.00 -1.00 -3.38 115.11 120.14 1pt1 h GLN 7 Ca -0.48 -0.37 0.25 0.00 -0.00 0.00 0.00 58.65 58.05 1pt1 h GLN 7 Cb 1.25 0.14 -0.17 0.00 0.00 0.00 0.00 27.48 28.70 1pt1 h GLN 7 CO 0.94 1.18 0.76 0.20 0.00 0.00 0.00 178.83 181.91 1pt1 s GLY 8 N -4.81 -0.34 -0.04 2.39 0.00 -1.13 -0.84 107.32 102.55 1pt1 s GLY 8 Ca -0.19 1.28 -0.21 0.00 0.00 0.00 0.00 44.72 45.59 1pt1 s GLY 8 CO 0.76 0.40 0.47 -1.59 0.00 0.00 0.00 173.10 173.14 1pt1 s LYS 9 N -2.54 0.82 -0.32 2.90 -2.85 -0.24 -1.35 119.74 116.16 1pt1 s LYS 9 Ca 0.10 0.06 -0.06 0.00 -1.00 0.00 0.00 55.97 55.07 1pt1 s LYS 9 Cb 0.00 0.38 0.03 0.00 -2.06 0.00 0.00 37.83 36.18 1pt1 s LYS 9 CO -0.05 -0.23 0.08 -0.51 0.10 0.00 0.00 175.35 174.74 1pt1 s LEU 10 N -1.14 4.15 -0.31 2.77 1.43 0.77 -1.43 118.68 124.92 1pt1 s LEU 10 Ca -0.11 -1.06 -0.11 0.00 -1.03 0.00 0.00 54.13 51.81 1pt1 s LEU 10 Cb -0.03 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1pt1 s LEU 10 CO 0.06 -0.29 0.20 0.00 0.23 0.00 0.00 176.35 176.56 1pt1 s ALA 11 N 1.40 3.47 -0.69 4.21 0.00 -0.16 -1.35 121.76 128.65 1pt1 s ALA 11 Ca -0.01 -1.26 -0.03 0.00 0.00 0.00 0.00 51.96 50.66 1pt1 s ALA 11 Cb -0.19 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1pt1 s ALA 11 CO 0.02 -0.78 0.59 0.54 0.00 0.00 0.00 175.76 176.13 1pt1 n ARG 12 N 5.06 -3.95 -1.78 0.00 1.74 -0.64 -1.55 116.66 115.54 1pt1 n ARG 12 Ca -0.13 0.45 -0.31 0.00 -0.77 0.00 0.00 57.85 57.08 1pt1 n ARG 12 Cb 0.51 -4.30 0.02 0.00 -1.02 0.00 0.00 32.46 27.67 1pt1 n ARG 12 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1pt1 s VAL 13 N -3.18 4.38 -0.10 1.55 -7.23 -0.67 -4.51 120.40 110.65 1pt1 s VAL 13 Ca 0.18 0.81 -0.01 0.00 -1.81 0.00 0.00 61.98 61.15 1pt1 s VAL 13 Cb -0.08 -3.65 -0.03 0.00 0.56 0.00 0.00 36.38 33.18 1pt1 s VAL 13 CO 0.39 -0.98 -0.05 -0.54 -0.31 0.00 0.00 175.10 173.61 1pt1 s LYS 14 N -5.02 3.05 0.11 4.82 1.02 -1.26 -0.67 119.74 121.78 1pt1 s LYS 14 Ca 0.57 -0.51 -0.31 0.00 0.02 0.00 0.00 55.97 55.74 1pt1 s LYS 14 Cb -0.12 -2.72 -0.08 0.00 -0.52 0.00 0.00 37.83 34.38 1pt1 s LYS 14 CO 0.53 0.56 1.46 0.08 -0.92 0.00 0.00 175.35 177.05 1pt1 s VAL 15 N -0.51 3.16 -0.22 3.17 1.01 -0.44 -4.45 120.40 122.12 1pt1 s VAL 15 Ca 0.08 0.79 0.15 0.00 0.00 0.00 0.00 61.98 63.00 1pt1 s VAL 15 Cb -0.12 -3.51 -0.21 0.00 0.00 0.00 0.00 36.38 32.54 1pt1 s VAL 15 CO 0.02 0.05 0.42 0.35 0.00 0.00 0.00 175.10 175.94 1pt1 n THR 16 N 4.09 0.00 -3.67 3.92 -2.24 0.40 -0.85 114.28 115.93 1pt1 n THR 16 Ca 0.13 -0.29 -0.15 0.00 -2.27 0.00 0.00 64.05 61.47 1pt1 n THR 16 Cb 0.41 0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 68.96 1pt1 n THR 16 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1pt1 s HIS 17 N -2.87 -0.46 -0.28 4.78 2.46 -1.11 -4.92 115.29 112.88 1pt1 s HIS 17 Ca -0.02 0.94 0.02 0.00 0.47 0.00 0.00 55.06 56.46 1pt1 s HIS 17 Cb 0.10 0.22 0.18 0.00 -0.13 0.00 0.00 32.58 32.95 1pt1 s HIS 17 CO 0.63 -0.40 0.51 0.00 -2.47 0.00 0.00 174.74 173.00 1pt1 s ALA 18 N -0.66 -1.81 -0.04 1.58 0.00 -1.26 -1.12 121.76 118.45 1pt1 s ALA 18 Ca -0.08 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.84 1pt1 s ALA 18 Cb -0.03 -2.19 0.03 0.00 0.00 0.00 0.00 23.12 20.92 1pt1 s ALA 18 CO 0.04 -1.61 -0.00 0.34 0.00 0.00 0.00 175.76 174.53 1pt1 s ASP 19 N 2.71 0.80 0.49 0.00 -1.08 -1.15 -4.94 116.67 113.49 1pt1 s ASP 19 Ca 0.13 -0.05 0.15 0.00 -0.52 0.00 0.00 52.55 52.25 1pt1 s ASP 19 Cb -0.13 -0.30 1.18 0.00 -1.46 0.00 0.00 42.92 42.22 1pt1 s ASP 19 CO -0.25 -0.12 2.12 -0.07 0.52 0.00 0.00 175.17 177.37 1pt1 h LEU 20 N 7.54 0.11 0.00 -1.34 3.38 -1.88 -1.95 115.31 121.17 1pt1 h LEU 20 Ca -0.35 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1pt1 h LEU 20 Cb 1.13 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1pt1 h LEU 20 CO 0.41 0.08 -0.65 0.45 0.09 0.00 0.00 178.44 178.81 1pt1 h HIS 21 N 0.13 0.00 -4.44 1.13 3.86 -1.96 -3.28 115.15 110.60 1pt1 h HIS 21 Ca 0.05 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.77 1pt1 h HIS 21 Cb 0.06 0.00 0.08 0.00 1.06 0.00 0.00 27.41 28.61 1pt1 h HIS 21 CO -0.00 0.00 0.41 0.71 0.86 0.00 0.00 177.93 179.91 1pt1 s TYR 22 N -3.20 3.30 0.32 2.45 1.51 -1.11 -4.94 117.35 115.69 1pt1 s TYR 22 Ca 0.05 1.10 -0.27 0.00 -1.01 0.00 0.00 57.07 56.95 1pt1 s TYR 22 Cb 0.13 -3.03 -0.14 0.00 -0.11 0.00 0.00 41.96 38.81 1pt1 s TYR 22 CO 0.73 -1.19 0.86 -1.91 -1.11 0.00 0.00 175.55 172.93 1pt1 n GLU 23 N -3.03 1.04 -2.64 -0.62 2.13 -1.26 -2.13 120.64 114.13 1pt1 n GLU 23 Ca 0.07 0.37 -0.42 0.00 0.66 0.00 0.00 57.16 57.84 1pt1 n GLU 23 Cb 0.57 -1.70 -0.03 0.00 0.27 0.00 0.00 31.44 30.54 1pt1 n GLU 23 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1pt1 s GLY 24 N -0.71 1.15 -0.02 8.31 0.00 -1.26 -3.30 107.32 111.49 1pt1 s GLY 24 Ca 0.61 -1.78 -0.08 0.00 0.00 0.00 0.00 44.72 43.47 1pt1 s GLY 24 CO 0.59 2.49 0.34 -1.14 0.00 0.00 0.00 173.10 175.37 1pt1 n SER 25 N 8.71 -0.25 -3.94 1.64 3.41 -1.20 -4.84 113.62 117.15 1pt1 n SER 25 Ca 0.10 -1.01 -0.28 0.00 -0.26 0.00 0.00 58.87 57.42 1pt1 n SER 25 Cb 0.49 0.38 -0.17 0.00 -0.26 0.00 0.00 64.21 64.65 1pt1 n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pt1 s ALA 27 N 1.60 3.46 -0.05 0.00 0.00 -0.24 -1.33 121.76 125.20 1pt1 s ALA 27 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1pt1 s ALA 27 Cb -0.13 -2.69 0.02 0.00 0.00 0.00 0.00 23.12 20.32 1pt1 s ALA 27 CO -0.09 -0.02 -0.04 0.42 0.00 0.00 0.00 175.76 176.03 1pt1 s ILE 28 N 0.67 0.55 -0.36 0.00 1.01 -0.00 -1.16 121.20 121.92 1pt1 s ILE 28 Ca 0.27 -0.10 -0.40 0.00 0.00 0.00 0.00 60.65 60.43 1pt1 s ILE 28 Cb -0.15 -0.60 -0.17 0.00 0.01 0.00 0.00 42.46 41.54 1pt1 s ILE 28 CO 0.11 0.24 1.31 -0.67 0.00 0.00 0.00 174.94 175.94 1pt1 n ASP 29 N 4.30 0.87 -0.13 3.58 -0.08 -0.81 -0.23 116.55 124.06 1pt1 n ASP 29 Ca -0.21 1.03 0.20 0.00 -1.51 0.00 0.00 54.79 54.30 1pt1 n ASP 29 Cb 0.51 -0.77 0.60 0.00 2.34 0.00 0.00 41.12 43.80 1pt1 n ASP 29 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1pt1 h GLN 30 N 4.05 0.21 -0.99 -0.67 5.75 -1.54 0.18 115.11 122.10 1pt1 h GLN 30 Ca -0.39 -0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.16 1pt1 h GLN 30 Cb 1.20 -0.05 -0.07 0.00 1.07 0.00 0.00 27.48 29.64 1pt1 h GLN 30 CO 0.80 0.14 0.64 -0.44 -2.65 0.00 0.00 178.83 177.32 1pt1 h ASP 31 N 0.21 1.02 -0.14 -0.69 3.32 -1.87 0.59 116.42 118.87 1pt1 h ASP 31 Ca 0.36 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 1pt1 h ASP 31 Cb 1.09 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 1pt1 h ASP 31 CO -0.07 0.65 -0.17 -0.26 -1.72 0.00 0.00 179.24 177.67 1pt1 h PHE 32 N 1.16 0.43 -0.62 4.55 0.04 -0.99 -2.35 116.94 119.16 1pt1 h PHE 32 Ca 0.42 -0.14 0.05 0.00 2.80 0.00 0.00 57.97 61.11 1pt1 h PHE 32 Cb 0.16 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.17 1pt1 h PHE 32 CO -0.00 0.77 0.34 -0.07 -0.60 0.00 0.00 178.31 178.75 1pt1 h LEU 33 N -0.03 0.50 -0.40 1.54 3.38 -1.13 -1.90 115.31 117.28 1pt1 h LEU 33 Ca 0.02 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1pt1 h LEU 33 Cb 0.71 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 1pt1 h LEU 33 CO 0.04 0.33 0.04 0.44 0.09 0.00 0.00 178.44 179.38 1pt1 h ASP 34 N 0.64 -0.08 -0.54 -0.43 3.32 -0.82 0.49 116.42 119.00 1pt1 h ASP 34 Ca 0.27 0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.34 1pt1 h ASP 34 Cb 0.16 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1pt1 h ASP 34 CO -0.17 -0.00 0.11 0.00 -1.72 0.00 0.00 179.24 177.46 1pt1 h ALA 35 N 1.33 1.10 -0.02 3.45 0.00 -0.94 -3.08 119.26 121.10 1pt1 h ALA 35 Ca 0.20 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1pt1 h ALA 35 Cb 0.26 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1pt1 h ALA 35 CO -0.29 0.59 -0.20 0.00 0.00 0.00 0.00 179.25 179.35 1pt1 n ALA 36 N -2.46 2.95 -1.15 0.00 0.00 -0.76 -4.50 120.51 114.59 1pt1 n ALA 36 Ca 0.04 -0.54 -0.05 0.00 0.00 0.00 0.00 53.44 52.89 1pt1 n ALA 36 Cb 0.26 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1pt1 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pt1 n GLY 37 N 1.32 0.70 3.74 0.00 0.00 0.10 -4.13 105.19 106.92 1pt1 n GLY 37 Ca 0.13 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 1pt1 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pt1 s ILE 38 N -1.92 4.50 0.07 -0.61 1.01 -0.81 -4.99 121.20 118.45 1pt1 s ILE 38 Ca 0.00 1.88 0.02 0.00 0.00 0.00 0.00 60.65 62.55 1pt1 s ILE 38 Cb 0.00 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1pt1 s ILE 38 CO 0.00 0.39 0.12 -0.76 0.00 0.00 0.00 174.94 174.69 1pt1 s LEU 39 N -0.34 3.98 0.02 2.97 1.43 -1.26 -4.56 118.68 120.91 1pt1 s LEU 39 Ca 0.42 0.08 -0.37 0.00 -1.03 0.00 0.00 54.13 53.23 1pt1 s LEU 39 Cb -0.23 -2.63 -0.16 0.00 0.03 0.00 0.00 46.19 43.20 1pt1 s LEU 39 CO 0.27 0.17 1.42 1.21 0.23 0.00 0.00 176.35 179.66 1pt1 n GLU 40 N 0.42 1.18 -0.99 1.70 4.07 -1.26 -1.77 120.64 123.99 1pt1 n GLU 40 Ca -0.08 0.43 0.00 0.00 -0.06 0.00 0.00 57.16 57.45 1pt1 n GLU 40 Cb 0.51 -2.08 0.00 0.00 -0.06 0.00 0.00 31.44 29.81 1pt1 n GLU 40 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1pt1 n ASN 41 N 3.05 -3.35 -4.79 4.31 3.02 0.57 -5.00 115.26 113.08 1pt1 n ASN 41 Ca 0.20 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.36 1pt1 n ASN 41 Cb 0.18 -1.12 -0.06 0.00 -0.61 0.00 0.00 39.78 38.17 1pt1 n ASN 41 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1pt1 s GLU 42 N -0.43 4.49 0.28 3.52 2.12 -0.73 -4.76 118.70 123.20 1pt1 s GLU 42 Ca 0.00 1.09 -0.30 0.00 0.36 0.00 0.00 54.97 56.12 1pt1 s GLU 42 Cb 0.00 -3.14 -0.12 0.00 0.26 0.00 0.00 34.13 31.13 1pt1 s GLU 42 CO 0.00 0.51 1.59 0.00 -0.54 0.00 0.00 175.26 176.82 1pt1 n ALA 43 N 1.32 2.46 -2.85 6.30 0.00 -1.26 -1.20 120.51 125.27 1pt1 n ALA 43 Ca -0.04 0.38 -0.12 0.00 0.00 0.00 0.00 53.44 53.65 1pt1 n ALA 43 Cb 0.49 -2.45 -0.11 0.00 0.00 0.00 0.00 19.45 17.38 1pt1 n ALA 43 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1pt1 s ILE 44 N 0.06 0.47 -0.11 0.00 -4.36 -0.41 -4.61 121.20 112.24 1pt1 s ILE 44 Ca 0.65 -1.09 -0.06 0.00 -0.26 0.00 0.00 60.65 59.89 1pt1 s ILE 44 Cb -0.51 -0.60 -0.04 0.00 1.25 0.00 0.00 42.46 42.56 1pt1 s ILE 44 CO 0.48 -0.42 0.12 -1.81 0.24 0.00 0.00 174.94 173.54 1pt1 s ASP 45 N -1.63 6.21 -0.14 4.36 1.01 0.04 -0.97 116.67 125.55 1pt1 s ASP 45 Ca -0.10 0.42 0.02 0.00 0.71 0.00 0.00 52.55 53.60 1pt1 s ASP 45 Cb -0.09 -1.98 0.01 0.00 1.01 0.00 0.00 42.92 41.88 1pt1 s ASP 45 CO -0.00 0.40 -0.20 -0.63 0.21 0.00 0.00 175.17 174.96 1pt1 s ILE 46 N -1.01 1.92 -0.27 0.77 1.01 0.48 -1.16 121.20 122.94 1pt1 s ILE 46 Ca 0.15 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 59.90 1pt1 s ILE 46 Cb -0.12 -1.72 0.03 0.00 0.01 0.00 0.00 42.46 40.66 1pt1 s ILE 46 CO 0.04 0.52 -0.04 0.26 0.00 0.00 0.00 174.94 175.72 1pt1 s TRP 47 N 1.01 3.12 -0.47 3.97 0.51 -0.19 -1.53 118.94 125.37 1pt1 s TRP 47 Ca -0.03 -1.60 -0.21 0.00 -2.12 0.00 0.00 56.10 52.14 1pt1 s TRP 47 Cb -0.15 -2.08 0.03 0.00 -0.81 0.00 0.00 33.47 30.47 1pt1 s TRP 47 CO -0.05 -0.74 0.70 1.21 -0.51 0.00 0.00 176.95 177.56 1pt1 s ASN 48 N 1.32 6.31 0.27 2.95 3.84 0.22 -1.05 114.94 128.79 1pt1 s ASN 48 Ca -0.01 -0.46 -0.02 0.00 0.21 0.00 0.00 52.86 52.59 1pt1 s ASN 48 Cb -0.17 -2.34 0.37 0.00 -0.55 0.00 0.00 41.25 38.56 1pt1 s ASN 48 CO -0.03 -0.89 1.80 0.58 -2.79 0.00 0.00 177.10 175.77 1pt1 h VAL 49 N 5.91 1.23 -0.07 -5.21 2.07 -0.88 0.28 116.25 119.58 1pt1 h VAL 49 Ca -0.26 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 1pt1 h VAL 49 Cb 1.09 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1pt1 h VAL 49 CO 0.95 0.32 -0.04 0.74 0.02 0.00 0.00 177.57 179.56 1pt1 h THR 50 N 0.78 1.33 -0.02 2.57 2.02 -1.89 -3.36 112.91 114.34 1pt1 h THR 50 Ca 0.16 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1pt1 h THR 50 Cb 0.36 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 1pt1 h THR 50 CO 0.01 0.30 0.00 -0.46 0.37 0.00 0.00 175.52 175.74 1pt1 n ASN 51 N -4.75 1.58 0.00 4.18 0.23 -1.23 -5.01 115.26 110.25 1pt1 n ASN 51 Ca -0.07 -1.31 0.00 0.00 -0.53 0.00 0.00 54.58 52.67 1pt1 n ASN 51 Cb 0.27 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 1pt1 n ASN 51 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pt1 n GLY 52 N 0.32 2.24 3.76 4.83 0.00 0.97 -5.01 105.19 112.31 1pt1 n GLY 52 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1pt1 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pt1 s LYS 53 N -0.03 3.59 -0.05 1.61 1.02 -1.25 -4.70 119.74 119.93 1pt1 s LYS 53 Ca 0.00 1.94 0.01 0.00 0.02 0.00 0.00 55.97 57.94 1pt1 s LYS 53 Cb 0.00 -2.39 0.02 0.00 -0.52 0.00 0.00 37.83 34.94 1pt1 s LYS 53 CO 0.00 -0.74 -0.06 1.03 -0.92 0.00 0.00 175.35 174.66 1pt1 s ARG 54 N -2.72 1.01 0.19 1.68 0.52 -1.26 -0.61 118.95 117.75 1pt1 s ARG 54 Ca 0.65 -0.16 -0.15 0.00 -0.52 0.00 0.00 55.73 55.55 1pt1 s ARG 54 Cb -0.33 -0.98 0.02 0.00 0.52 0.00 0.00 34.95 34.18 1pt1 s ARG 54 CO 0.40 -0.07 0.46 -0.59 0.02 0.00 0.00 175.30 175.51 1pt1 s PHE 55 N 0.92 0.02 -0.03 -0.53 -0.71 -0.58 -5.02 117.98 112.05 1pt1 s PHE 55 Ca -0.11 -0.37 0.06 0.00 -1.04 0.00 0.00 56.93 55.47 1pt1 s PHE 55 Cb -0.14 0.27 -0.01 0.00 -1.21 0.00 0.00 43.02 41.93 1pt1 s PHE 55 CO 0.00 -0.86 -0.21 -1.54 -1.34 0.00 0.00 175.22 171.27 1pt1 s SER 56 N -2.90 2.51 0.00 1.98 1.04 -1.26 -0.39 113.70 114.68 1pt1 s SER 56 Ca 0.11 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1pt1 s SER 56 Cb 0.00 -0.44 0.00 0.00 0.10 0.00 0.00 66.02 65.68 1pt1 s SER 56 CO -0.02 0.23 0.00 1.07 0.98 0.00 0.00 173.24 175.50 1pt1 n THR 57 N 2.75 0.00 -4.10 2.02 5.66 -0.14 -5.00 114.28 115.47 1pt1 n THR 57 Ca -0.16 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.75 1pt1 n THR 57 Cb 0.53 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.20 1pt1 n THR 57 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1pt1 s TYR 58 N 0.26 0.60 0.11 1.09 1.13 -1.26 -1.28 117.35 118.00 1pt1 s TYR 58 Ca 0.00 -0.92 -0.14 0.00 -1.41 0.00 0.00 57.07 54.60 1pt1 s TYR 58 Cb 0.00 -0.40 -0.07 0.00 -1.10 0.00 0.00 41.96 40.39 1pt1 s TYR 58 CO 0.00 -0.27 0.51 0.00 -2.51 0.00 0.00 175.55 173.28 1pt1 s ALA 59 N -3.37 3.62 0.18 9.51 0.00 -0.34 -1.61 121.76 129.74 1pt1 s ALA 59 Ca 0.04 -0.16 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1pt1 s ALA 59 Cb 0.04 -2.48 -0.05 0.00 0.00 0.00 0.00 23.12 20.63 1pt1 s ALA 59 CO -0.07 0.47 -0.04 0.96 0.00 0.00 0.00 175.76 177.08 1pt1 s ILE 60 N -1.38 1.02 0.13 0.00 -4.36 -0.44 -0.31 121.20 115.86 1pt1 s ILE 60 Ca 0.35 -2.03 -0.26 0.00 -0.26 0.00 0.00 60.65 58.44 1pt1 s ILE 60 Cb -0.15 -2.09 -0.07 0.00 1.25 0.00 0.00 42.46 41.40 1pt1 s ILE 60 CO 0.18 -0.54 0.82 0.00 0.24 0.00 0.00 174.94 175.65 1pt1 s ALA 61 N -3.43 3.38 0.35 2.27 0.00 -1.26 -0.82 121.76 122.26 1pt1 s ALA 61 Ca 0.22 0.40 0.08 0.00 0.00 0.00 0.00 51.96 52.67 1pt1 s ALA 61 Cb 0.04 -3.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 1pt1 s ALA 61 CO 0.04 0.17 0.26 0.00 0.00 0.00 0.00 175.76 176.24 1pt1 s ALA 62 N -0.68 3.78 0.23 0.00 0.00 0.68 -4.61 121.76 121.16 1pt1 s ALA 62 Ca 0.39 -1.76 -0.31 0.00 0.00 0.00 0.00 51.96 50.27 1pt1 s ALA 62 Cb -0.23 -0.99 -0.14 0.00 0.00 0.00 0.00 23.12 21.76 1pt1 s ALA 62 CO 0.27 -0.04 1.35 -1.91 0.00 0.00 0.00 175.76 175.43 1pt1 n GLU 63 N -1.34 1.85 -1.69 0.00 2.13 -1.26 -1.85 120.64 118.48 1pt1 n GLU 63 Ca -0.01 0.66 -0.43 0.00 0.66 0.00 0.00 57.16 58.03 1pt1 n GLU 63 Cb 0.61 -2.28 -0.03 0.00 0.27 0.00 0.00 31.44 30.01 1pt1 n GLU 63 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1pt1 n ARG 64 N 1.90 2.65 -0.29 5.31 0.63 -1.26 -1.99 116.66 123.60 1pt1 n ARG 64 Ca 0.12 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 58.01 1pt1 n ARG 64 Cb 0.30 -2.83 0.00 0.00 0.45 0.00 0.00 32.46 30.38 1pt1 n ARG 64 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pt1 n GLY 65 N 4.11 1.43 0.21 5.14 0.00 -1.26 -4.91 105.19 109.90 1pt1 n GLY 65 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 1pt1 n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1pt1 h SER 66 N 0.00 0.00 -2.01 1.61 4.64 -1.76 -3.47 113.55 112.56 1pt1 h SER 66 Ca 0.00 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.92 1pt1 h SER 66 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 1pt1 h SER 66 CO 0.00 0.29 -0.44 0.54 -0.87 0.00 0.00 176.83 176.34 1pt1 n ARG 67 N -3.41 -1.48 -2.64 4.77 1.74 -1.26 -4.97 116.66 109.41 1pt1 n ARG 67 Ca 0.00 1.05 -0.40 0.00 -0.77 0.00 0.00 57.85 57.73 1pt1 n ARG 67 Cb 0.48 -5.53 -0.05 0.00 -1.02 0.00 0.00 32.46 26.34 1pt1 n ARG 67 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1pt1 s ILE 68 N -2.87 3.98 -0.25 0.55 1.01 -1.26 -4.88 121.20 117.48 1pt1 s ILE 68 Ca 0.00 1.86 -0.01 0.00 0.00 0.00 0.00 60.65 62.50 1pt1 s ILE 68 Cb 0.00 -4.19 0.07 0.00 0.01 0.00 0.00 42.46 38.36 1pt1 s ILE 68 CO 0.00 0.39 0.04 -0.63 0.00 0.00 0.00 174.94 174.74 1pt1 s ILE 69 N -0.77 0.92 -0.21 2.92 -1.09 -1.25 -1.92 121.20 119.80 1pt1 s ILE 69 Ca 0.45 -1.04 -0.01 0.00 -2.23 0.00 0.00 60.65 57.82 1pt1 s ILE 69 Cb -0.27 -1.47 0.02 0.00 -1.58 0.00 0.00 42.46 39.15 1pt1 s ILE 69 CO 0.34 -0.36 -0.13 -0.55 -1.23 0.00 0.00 174.94 173.01 1pt1 s SER 70 N 1.65 3.69 -0.36 3.58 0.15 -0.31 -0.45 113.70 121.64 1pt1 s SER 70 Ca 0.02 -0.66 -0.10 0.00 0.70 0.00 0.00 55.95 55.91 1pt1 s SER 70 Cb -0.18 -1.58 0.03 0.00 -1.71 0.00 0.00 66.02 62.58 1pt1 s SER 70 CO -0.14 -0.04 0.18 -0.69 1.20 0.00 0.00 173.24 173.76 1pt1 s VAL 71 N 1.33 4.43 0.42 4.45 1.01 -0.27 -1.08 120.40 130.69 1pt1 s VAL 71 Ca 0.04 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1pt1 s VAL 71 Cb -0.14 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.73 1pt1 s VAL 71 CO -0.09 -0.18 0.02 0.20 0.00 0.00 0.00 175.10 175.05 1pt1 s ASN 72 N 1.53 3.63 0.54 3.32 0.02 -0.55 -2.95 114.94 120.48 1pt1 s ASN 72 Ca 0.02 -1.46 0.00 0.00 -1.02 0.00 0.00 52.86 50.40 1pt1 s ASN 72 Cb -0.19 -0.07 0.00 0.00 0.02 0.00 0.00 41.25 41.01 1pt1 s ASN 72 CO 0.06 -0.60 0.00 0.61 0.02 0.00 0.00 177.10 177.19 1pt1 n GLY 73 N -0.99 0.81 0.37 0.66 0.00 -0.75 -2.99 105.19 102.31 1pt1 n GLY 73 Ca -0.08 -0.77 0.17 0.00 0.00 0.00 0.00 46.02 45.33 1pt1 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pt1 h ALA 74 N -0.54 2.25 0.00 4.61 0.00 -1.89 -1.80 119.26 121.88 1pt1 h ALA 74 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pt1 h ALA 74 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pt1 h ALA 74 CO 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.84 1pt1 h ALA 75 N 1.70 1.00 0.00 0.00 0.00 -1.88 -1.78 119.26 118.30 1pt1 h ALA 75 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1pt1 h ALA 75 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1pt1 h ALA 75 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1pt1 h ALA 76 N 2.12 1.00 0.00 0.00 0.00 -1.44 -0.38 119.26 120.55 1pt1 h ALA 76 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pt1 h ALA 76 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1pt1 h ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1pt1 n HIS 77 N -2.70 0.34 0.48 0.00 8.25 -0.67 -3.90 115.22 117.03 1pt1 n HIS 77 Ca -0.01 0.12 0.05 0.00 -0.26 0.00 0.00 57.72 57.62 1pt1 n HIS 77 Cb 0.15 -0.69 -0.06 0.00 1.12 0.00 0.00 29.99 30.51 1pt1 n HIS 77 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pt1 s ALA 79 N -2.00 -0.75 0.27 0.00 0.00 -1.18 -4.82 121.76 113.29 1pt1 s ALA 79 Ca 0.04 0.35 0.12 0.00 0.00 0.00 0.00 51.96 52.46 1pt1 s ALA 79 Cb 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 1pt1 s ALA 79 CO 0.43 -0.25 -0.20 -1.12 0.00 0.00 0.00 175.76 174.63 1pt1 s SER 80 N -1.18 3.51 0.18 0.00 0.01 -1.26 -4.70 113.70 110.26 1pt1 s SER 80 Ca -0.12 -1.03 -0.33 0.00 1.31 0.00 0.00 55.95 55.78 1pt1 s SER 80 Cb -0.05 -0.29 -0.13 0.00 0.21 0.00 0.00 66.02 65.76 1pt1 s SER 80 CO 0.04 0.03 1.61 0.52 0.41 0.00 0.00 173.24 175.84 1pt1 n VAL 81 N -0.60 0.06 0.00 3.43 0.31 -1.26 -1.63 118.33 118.65 1pt1 n VAL 81 Ca -0.05 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1pt1 n VAL 81 Cb 0.60 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 1pt1 n VAL 81 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pt1 n GLY 82 N 3.49 2.23 3.77 2.92 0.00 -0.03 -4.98 105.19 112.59 1pt1 n GLY 82 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1pt1 n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pt1 s ASP 83 N -1.38 6.26 -0.14 1.61 1.01 -0.64 -4.69 116.67 118.69 1pt1 s ASP 83 Ca 0.00 2.53 -0.17 0.00 0.71 0.00 0.00 52.55 55.62 1pt1 s ASP 83 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1pt1 s ASP 83 CO 0.00 -0.87 0.42 -0.63 0.21 0.00 0.00 175.17 174.30 1pt1 s ILE 84 N -1.35 5.22 0.14 0.77 1.01 -1.26 -1.32 121.20 124.41 1pt1 s ILE 84 Ca 0.59 0.82 0.02 0.00 0.00 0.00 0.00 60.65 62.08 1pt1 s ILE 84 Cb -0.35 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 1pt1 s ILE 84 CO 0.44 0.32 -0.04 0.68 0.00 0.00 0.00 174.94 176.35 1pt1 s VAL 85 N 0.73 0.73 -0.12 2.92 -7.23 0.15 -0.17 120.40 117.41 1pt1 s VAL 85 Ca 0.22 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.46 1pt1 s VAL 85 Cb -0.14 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 34.89 1pt1 s VAL 85 CO 0.08 -0.67 -0.23 -0.63 -0.31 0.00 0.00 175.10 173.35 1pt1 s ILE 86 N -3.61 2.08 -0.16 -0.62 1.01 -0.22 -1.62 121.20 118.06 1pt1 s ILE 86 Ca 0.18 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 1pt1 s ILE 86 Cb 0.05 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 1pt1 s ILE 86 CO -0.00 0.55 -0.11 -0.63 0.00 0.00 0.00 174.94 174.75 1pt1 s ILE 87 N 0.59 3.05 0.05 2.92 1.01 -0.46 -1.02 121.20 127.36 1pt1 s ILE 87 Ca -0.12 -0.63 0.04 0.00 0.00 0.00 0.00 60.65 59.94 1pt1 s ILE 87 Cb -0.17 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 1pt1 s ILE 87 CO 0.03 0.49 -0.13 0.00 0.00 0.00 0.00 174.94 175.34 1pt1 s ALA 88 N 0.82 1.06 0.14 9.38 0.00 -0.31 -0.16 121.76 132.69 1pt1 s ALA 88 Ca -0.04 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1pt1 s ALA 88 Cb -0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 1pt1 s ALA 88 CO 0.01 0.16 -0.18 -1.54 0.00 0.00 0.00 175.76 174.20 1pt1 s SER 89 N -1.41 2.53 0.05 0.00 1.04 -0.45 -0.78 113.70 114.69 1pt1 s SER 89 Ca -0.02 -0.81 0.06 0.00 0.48 0.00 0.00 55.95 55.67 1pt1 s SER 89 Cb -0.09 -0.14 -0.03 0.00 0.10 0.00 0.00 66.02 65.87 1pt1 s SER 89 CO 0.01 -0.03 -0.17 -0.36 0.98 0.00 0.00 173.24 173.67 1pt1 s PHE 90 N -1.82 1.51 0.19 5.02 0.40 -1.26 -0.34 117.98 121.68 1pt1 s PHE 90 Ca 0.12 -0.38 0.06 0.00 -0.60 0.00 0.00 56.93 56.13 1pt1 s PHE 90 Cb -0.07 -0.88 -0.05 0.00 0.51 0.00 0.00 43.02 42.53 1pt1 s PHE 90 CO 0.05 0.08 -0.11 0.14 0.70 0.00 0.00 175.22 176.09 1pt1 s VAL 91 N -0.93 1.48 0.16 -0.44 -7.23 -0.30 -4.81 120.40 108.33 1pt1 s VAL 91 Ca 0.04 -2.14 0.07 0.00 -1.81 0.00 0.00 61.98 58.14 1pt1 s VAL 91 Cb -0.09 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 1pt1 s VAL 91 CO 0.02 -0.61 -0.01 0.42 -0.31 0.00 0.00 175.10 174.61 1pt1 s THR 92 N -3.14 3.68 -0.01 5.32 -4.23 -1.26 -0.25 115.64 115.76 1pt1 s THR 92 Ca 0.21 -1.39 -0.29 0.00 -1.18 0.00 0.00 61.69 59.05 1pt1 s THR 92 Cb 0.01 -2.83 0.10 0.00 1.34 0.00 0.00 72.50 71.12 1pt1 s THR 92 CO 0.05 -0.07 0.95 0.00 -0.54 0.00 0.00 174.62 175.01 1pt1 s MET 93 N -2.82 0.79 0.75 3.99 0.23 -0.82 -4.98 119.30 116.44 1pt1 s MET 93 Ca 0.27 -0.32 -0.14 0.00 -1.03 0.00 0.00 55.69 54.46 1pt1 s MET 93 Cb -0.10 0.35 0.05 0.00 -1.53 0.00 0.00 34.83 33.60 1pt1 s MET 93 CO 0.18 -0.35 1.20 -2.14 -2.03 0.00 0.00 175.02 171.87 1pt1 s PRO 94 N -3.04 2.06 0.27 3.16 0.02 -1.26 -0.73 135.00 135.48 1pt1 s PRO 94 Ca 0.07 1.71 -0.00 0.00 0.02 0.00 0.00 61.00 62.80 1pt1 s PRO 94 Cb -0.01 -1.83 0.57 0.00 0.02 0.00 0.00 34.50 33.26 1pt1 s PRO 94 CO -0.07 -1.89 1.74 0.22 -0.33 0.00 0.00 177.00 176.68 1pt1 h ASP 95 N -0.45 0.44 -0.90 2.53 3.58 -1.61 -1.11 116.42 118.91 1pt1 h ASP 95 Ca -0.47 0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.12 1pt1 h ASP 95 Cb 1.29 0.05 -0.05 0.00 1.72 0.00 0.00 39.33 42.34 1pt1 h ASP 95 CO 0.49 0.15 0.59 -0.08 -2.88 0.00 0.00 179.24 177.51 1pt1 h GLU 96 N 0.54 1.11 0.15 0.28 4.22 -1.91 -1.91 114.58 117.06 1pt1 h GLU 96 Ca 0.48 -0.07 -0.30 0.00 0.08 0.00 0.00 59.36 59.56 1pt1 h GLU 96 Cb 0.75 -0.25 0.01 0.00 0.50 0.00 0.00 28.75 29.76 1pt1 h GLU 96 CO -0.41 0.73 -1.39 0.93 -2.18 0.00 0.00 179.01 176.69 1pt1 h GLU 97 N 1.14 0.32 0.00 1.92 5.08 -1.77 -3.31 114.58 117.95 1pt1 h GLU 97 Ca 0.35 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1pt1 h GLU 97 Cb -0.01 0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1pt1 h GLU 97 CO -0.10 1.23 -0.03 0.00 -1.00 0.00 0.00 179.01 179.10 1pt1 h ALA 98 N 0.47 1.94 0.00 3.43 0.00 -0.54 -2.46 119.26 122.09 1pt1 h ALA 98 Ca -0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1pt1 h ALA 98 Cb 2.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.81 1pt1 h ALA 98 CO 0.20 0.04 -0.06 0.00 0.00 0.00 0.00 179.25 179.44 1pt1 h ARG 99 N 0.00 0.00 -0.02 0.00 3.08 -1.46 -2.83 114.38 113.15 1pt1 h ARG 99 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pt1 h ARG 99 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1pt1 h ARG 99 CO 0.00 0.06 0.00 0.25 -1.07 0.00 0.00 179.97 179.21 1pt1 n THR 100 N -3.67 0.65 -1.75 2.04 -2.24 -1.00 -5.06 114.28 103.26 1pt1 n THR 100 Ca -0.02 -0.83 -0.42 0.00 -2.27 0.00 0.00 64.05 60.51 1pt1 n THR 100 Cb 0.16 0.68 -0.01 0.00 -2.10 0.00 0.00 70.33 69.06 1pt1 n THR 100 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1pt1 n TRP 101 N -0.23 2.77 -4.04 4.78 -0.00 -0.96 -5.02 117.44 114.75 1pt1 n TRP 101 Ca 0.01 0.42 -0.31 0.00 -0.00 0.00 0.00 57.50 57.62 1pt1 n TRP 101 Cb 0.19 -2.52 -0.16 0.00 -0.00 0.00 0.00 31.31 28.81 1pt1 n TRP 101 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 1pt1 s ARG 102 N -1.55 2.36 0.81 5.87 0.52 -1.26 -5.07 118.95 120.63 1pt1 s ARG 102 Ca 0.57 -0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 54.92 1pt1 s ARG 102 Cb -0.51 -2.35 0.08 0.00 0.52 0.00 0.00 34.95 32.69 1pt1 s ARG 102 CO 0.59 -0.31 1.10 -1.25 0.02 0.00 0.00 175.30 175.44 1pt1 s PRO 103 N 1.39 1.98 -0.43 3.54 0.04 -1.26 -5.02 135.00 135.24 1pt1 s PRO 103 Ca 0.02 0.68 -0.14 0.00 0.04 0.00 0.00 61.00 61.61 1pt1 s PRO 103 Cb -0.14 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.55 1pt1 s PRO 103 CO -0.10 -1.70 0.32 -0.80 0.04 0.00 0.00 177.00 174.76 1pt1 s ASN 104 N -3.82 5.99 -0.11 6.66 0.01 -0.02 -4.94 114.94 118.71 1pt1 s ASN 104 Ca 0.61 -1.20 0.04 0.00 -0.71 0.00 0.00 52.86 51.59 1pt1 s ASN 104 Cb -0.15 -2.12 0.00 0.00 0.41 0.00 0.00 41.25 39.39 1pt1 s ASN 104 CO 0.55 -0.54 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.68 1pt1 s VAL 105 N 1.60 2.03 -0.06 1.60 1.01 -1.26 -1.08 120.40 124.24 1pt1 s VAL 105 Ca 0.04 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.08 1pt1 s VAL 105 Cb -0.22 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 1pt1 s VAL 105 CO 0.07 0.55 -0.23 0.00 0.00 0.00 0.00 175.10 175.49 1pt1 s ALA 106 N 0.47 2.25 0.00 5.51 0.00 -0.51 -4.97 121.76 124.51 1pt1 s ALA 106 Ca -0.16 -1.04 0.03 0.00 0.00 0.00 0.00 51.96 50.79 1pt1 s ALA 106 Cb -0.17 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.18 1pt1 s ALA 106 CO 0.06 0.44 -0.05 0.71 0.00 0.00 0.00 175.76 176.92 1pt1 s TYR 107 N -0.25 2.94 0.14 0.00 2.02 -1.26 -0.99 117.35 119.95 1pt1 s TYR 107 Ca -0.01 -0.00 0.07 0.00 -0.37 0.00 0.00 57.07 56.76 1pt1 s TYR 107 Cb -0.13 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 39.76 1pt1 s TYR 107 CO 0.03 0.40 -0.16 -0.06 -1.57 0.00 0.00 175.55 174.19 1pt1 s PHE 108 N -1.02 1.54 0.20 2.71 0.40 -0.60 -0.97 117.98 120.25 1pt1 s PHE 108 Ca 0.18 -0.53 -0.05 0.00 -0.60 0.00 0.00 56.93 55.93 1pt1 s PHE 108 Cb -0.11 -0.79 -0.03 0.00 0.51 0.00 0.00 43.02 42.60 1pt1 s PHE 108 CO 0.08 0.20 0.24 -1.83 0.70 0.00 0.00 175.22 174.62 1pt1 s GLU 109 N -2.70 1.26 6.15 0.44 -1.05 -0.74 -4.77 118.70 117.30 1pt1 s GLU 109 Ca 0.11 -1.44 0.00 0.00 -0.15 0.00 0.00 54.97 53.49 1pt1 s GLU 109 Cb -0.05 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 33.98 1pt1 s GLU 109 CO 0.04 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.21 1pt1 n GLY 110 N -0.27 3.20 2.72 -3.83 0.00 -1.26 -1.74 105.19 104.00 1pt1 n GLY 110 Ca -0.01 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1pt1 n GLY 110 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pt1 n ASP 111 N 2.99 6.47 -3.89 1.61 2.03 -1.26 -4.61 116.55 119.88 1pt1 n ASP 111 Ca 0.00 -3.19 -0.28 0.00 0.52 0.00 0.00 54.79 51.84 1pt1 n ASP 111 Cb 0.00 -1.39 0.02 0.00 -0.72 0.00 0.00 41.12 39.02 1pt1 n ASP 111 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1pt1 n ASN 112 N 2.57 -3.43 -4.61 1.67 3.02 -1.18 -4.95 115.26 108.35 1pt1 n ASN 112 Ca 0.47 -0.83 -0.40 0.00 -0.03 0.00 0.00 54.58 53.79 1pt1 n ASN 112 Cb 0.31 -3.76 -0.07 0.00 -0.61 0.00 0.00 39.78 35.65 1pt1 n ASN 112 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1pt1 s GLU 113 N -6.49 3.98 0.03 3.52 0.41 -0.71 -4.94 118.70 114.50 1pt1 s GLU 113 Ca 0.46 0.29 -0.30 0.00 -0.41 0.00 0.00 54.97 55.00 1pt1 s GLU 113 Cb -0.23 -3.69 -0.06 0.00 -1.78 0.00 0.00 34.13 28.37 1pt1 s GLU 113 CO 0.84 -0.45 1.35 1.41 -0.49 0.00 0.00 175.26 177.92 1pt1 s MET 114 N 2.42 4.32 0.00 1.61 -2.45 -1.26 -1.79 119.30 122.15 1pt1 s MET 114 Ca 0.23 1.94 0.20 0.00 -1.25 0.00 0.00 55.69 56.81 1pt1 s MET 114 Cb -0.15 -3.46 0.16 0.00 1.25 0.00 0.00 34.83 32.62 1pt1 s MET 114 CO 0.10 -0.48 1.13 0.36 1.05 0.00 0.00 175.02 177.18