#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g2n n ILE 5 N 0.00 0.00 -3.84 -1.44 -5.35 -1.26 -4.79 119.36 102.68 2g2n n ILE 5 Ca 0.00 -0.10 -0.20 0.00 -0.27 0.00 0.00 62.75 62.19 2g2n n ILE 5 Cb 0.00 -0.01 -0.17 0.00 -1.74 0.00 0.00 39.64 37.72 2g2n n ILE 5 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2g2n s LEU 6 N -2.24 0.78 0.01 7.28 2.96 -1.25 0.07 118.68 126.28 2g2n s LEU 6 Ca 0.35 -0.03 0.06 0.00 -0.22 0.00 0.00 54.13 54.30 2g2n s LEU 6 Cb 0.21 -0.28 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 2g2n s LEU 6 CO 0.42 -0.16 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.65 2g2n s SER 7 N 1.55 2.31 0.11 3.68 0.01 -0.31 -1.11 113.70 119.94 2g2n s SER 7 Ca -0.02 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.87 2g2n s SER 7 Cb -0.13 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 2g2n s SER 7 CO -0.03 0.20 -0.10 0.68 0.41 0.00 0.00 173.24 174.40 2g2n s VAL 8 N -0.58 1.01 0.10 3.43 -7.23 -0.59 -1.31 120.40 115.22 2g2n s VAL 8 Ca 0.07 -1.72 -0.13 0.00 -1.81 0.00 0.00 61.98 58.38 2g2n s VAL 8 Cb -0.08 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.42 2g2n s VAL 8 CO 0.00 -0.58 0.32 -1.38 -0.31 0.00 0.00 175.10 173.15 2g2n s HIS 9 N -2.59 -0.08 -0.11 2.82 -3.43 -1.23 -0.86 115.29 109.80 2g2n s HIS 9 Ca 0.08 -0.23 0.02 0.00 -0.80 0.00 0.00 55.06 54.12 2g2n s HIS 9 Cb -0.02 0.13 0.02 0.00 -1.43 0.00 0.00 32.58 31.27 2g2n s HIS 9 CO 0.00 -0.61 -0.16 0.42 -2.00 0.00 0.00 174.74 172.40 2g2n s ILE 10 N -3.54 1.54 -0.22 -5.38 1.01 -0.42 -0.59 121.20 113.60 2g2n s ILE 10 Ca 0.02 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 59.96 2g2n s ILE 10 Cb 0.02 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.07 2g2n s ILE 10 CO -0.10 0.45 -0.03 -0.22 0.00 0.00 0.00 174.94 175.04 2g2n s LEU 11 N 1.02 2.99 -0.42 2.97 2.96 -0.35 -1.39 118.68 126.46 2g2n s LEU 11 Ca -0.05 -0.34 -0.29 0.00 -0.22 0.00 0.00 54.13 53.22 2g2n s LEU 11 Cb -0.15 -1.76 0.02 0.00 0.50 0.00 0.00 46.19 44.80 2g2n s LEU 11 CO -0.02 -0.00 1.24 0.21 -1.32 0.00 0.00 176.35 176.45 2g2n s ASN 12 N 1.37 6.58 0.00 3.68 3.84 -0.07 -1.13 114.94 129.20 2g2n s ASN 12 Ca 0.04 0.74 0.22 0.00 0.21 0.00 0.00 52.86 54.07 2g2n s ASN 12 Cb -0.14 -2.54 0.96 0.00 -0.55 0.00 0.00 41.25 38.97 2g2n s ASN 12 CO -0.01 -1.25 1.70 0.00 -2.79 0.00 0.00 177.10 174.75 2g2n n GLN 13 N 7.74 0.06 0.08 0.43 6.02 0.03 -0.38 117.38 131.36 2g2n n GLN 13 Ca 0.14 0.12 0.02 0.00 -0.01 0.00 0.00 57.00 57.27 2g2n n GLN 13 Cb 0.48 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.21 2g2n n GLN 13 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 2g2n h GLN 14 N 0.00 0.00 0.00 -1.09 4.20 -1.91 -3.36 115.11 112.94 2g2n h GLN 14 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2g2n h GLN 14 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2g2n h GLN 14 CO 0.00 0.34 -1.18 0.25 -0.67 0.00 0.00 178.83 177.57 2g2n n THR 15 N -3.00 0.00 -1.90 -0.54 -2.24 -1.11 -5.00 114.28 100.49 2g2n n THR 15 Ca -0.04 -0.24 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 2g2n n THR 15 Cb 0.77 0.47 -0.04 0.00 -2.10 0.00 0.00 70.33 69.43 2g2n n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g2n n GLY 16 N 1.74 0.66 3.25 3.38 0.00 0.49 -5.01 105.19 109.70 2g2n n GLY 16 Ca -0.01 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 2g2n n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g2n s LYS 17 N -4.10 1.07 0.68 1.61 1.02 -1.14 -4.95 119.74 113.92 2g2n s LYS 17 Ca 0.00 -1.46 -0.16 0.00 0.02 0.00 0.00 55.97 54.37 2g2n s LYS 17 Cb 0.00 -0.64 0.01 0.00 -0.52 0.00 0.00 37.83 36.68 2g2n s LYS 17 CO 0.00 0.08 1.20 -2.14 -0.92 0.00 0.00 175.35 173.57 2g2n s PRO 18 N -3.74 2.44 -0.51 -1.68 0.02 -1.26 -0.89 135.00 129.37 2g2n s PRO 18 Ca 0.17 1.75 -0.18 0.00 0.02 0.00 0.00 61.00 62.76 2g2n s PRO 18 Cb 0.02 -1.87 0.07 0.00 0.02 0.00 0.00 34.50 32.74 2g2n s PRO 18 CO 0.01 -1.60 0.59 0.00 -0.33 0.00 0.00 177.00 175.67 2g2n s ALA 19 N -1.90 3.43 0.21 -1.55 0.00 -0.49 -4.67 121.76 116.80 2g2n s ALA 19 Ca 0.75 -1.91 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 2g2n s ALA 19 Cb -0.29 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.44 2g2n s ALA 19 CO 0.41 -2.01 0.53 0.00 0.00 0.00 0.00 175.76 174.69 2g2n s ALA 20 N 2.43 3.60 -1.19 0.00 0.00 -1.26 -4.29 121.76 121.04 2g2n s ALA 20 Ca 0.12 -0.30 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 2g2n s ALA 20 Cb -0.21 -2.40 0.01 0.00 0.00 0.00 0.00 23.12 20.51 2g2n s ALA 20 CO 0.10 0.53 0.65 -3.47 0.00 0.00 0.00 175.76 173.57 2g2n n ASP 21 N -0.01 -5.33 -4.63 0.00 2.03 -0.01 -4.95 116.55 103.64 2g2n n ASP 21 Ca -0.00 -0.30 -0.37 0.00 0.52 0.00 0.00 54.79 54.63 2g2n n ASP 21 Cb 0.52 -4.08 -0.10 0.00 -0.72 0.00 0.00 41.12 36.74 2g2n n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2g2n s VAL 22 N -3.12 5.33 0.22 5.18 1.01 -1.26 -4.78 120.40 122.98 2g2n s VAL 22 Ca 0.32 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.20 2g2n s VAL 22 Cb -0.14 -3.52 -0.10 0.00 0.00 0.00 0.00 36.38 32.61 2g2n s VAL 22 CO 0.40 0.30 1.48 -0.89 0.00 0.00 0.00 175.10 176.39 2g2n s THR 23 N 1.38 2.64 -0.06 3.92 2.01 -1.26 -1.19 115.64 123.09 2g2n s THR 23 Ca 0.08 0.52 0.02 0.00 0.31 0.00 0.00 61.69 62.61 2g2n s THR 23 Cb -0.15 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 69.05 2g2n s THR 23 CO 0.07 0.07 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.30 2g2n s VAL 24 N 0.34 0.88 0.20 3.82 1.01 0.44 -0.99 120.40 126.10 2g2n s VAL 24 Ca 0.63 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.34 2g2n s VAL 24 Cb -0.42 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 2g2n s VAL 24 CO 0.40 0.30 0.25 0.42 0.00 0.00 0.00 175.10 176.47 2g2n s THR 25 N 0.84 4.90 -0.07 3.92 -4.23 -0.69 -1.91 115.64 118.40 2g2n s THR 25 Ca -0.12 -1.03 0.02 0.00 -1.18 0.00 0.00 61.69 59.39 2g2n s THR 25 Cb -0.15 -3.58 0.01 0.00 1.34 0.00 0.00 72.50 70.12 2g2n s THR 25 CO 0.02 -0.22 -0.13 -0.22 -0.54 0.00 0.00 174.62 173.53 2g2n s LEU 26 N -3.53 1.69 0.11 4.79 2.96 -0.56 -1.53 118.68 122.61 2g2n s LEU 26 Ca 0.33 -0.31 0.05 0.00 -0.22 0.00 0.00 54.13 53.98 2g2n s LEU 26 Cb -0.10 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.70 2g2n s LEU 26 CO 0.27 0.05 -0.13 -1.61 -1.32 0.00 0.00 176.35 173.61 2g2n s GLU 27 N 0.60 0.94 -0.11 1.98 2.02 -0.02 -0.27 118.70 123.83 2g2n s GLU 27 Ca -0.14 -1.18 -0.01 0.00 0.02 0.00 0.00 54.97 53.65 2g2n s GLU 27 Cb -0.16 -0.76 -0.03 0.00 0.10 0.00 0.00 34.13 33.29 2g2n s GLU 27 CO 0.04 0.14 -0.06 0.21 0.02 0.00 0.00 175.26 175.61 2g2n s LYS 28 N -2.63 3.21 0.11 1.61 2.20 0.55 -1.27 119.74 123.51 2g2n s LYS 28 Ca 0.07 -0.55 -0.31 0.00 -0.36 0.00 0.00 55.97 54.82 2g2n s LYS 28 Cb -0.05 -2.73 -0.09 0.00 -1.51 0.00 0.00 37.83 33.46 2g2n s LYS 28 CO 0.02 0.44 1.54 0.21 -0.36 0.00 0.00 175.35 177.20 2g2n s LYS 29 N -0.21 4.24 0.55 4.03 2.47 -0.51 -1.16 119.74 129.16 2g2n s LYS 29 Ca 0.03 2.26 0.05 0.00 -1.56 0.00 0.00 55.97 56.75 2g2n s LYS 29 Cb -0.13 -3.34 0.04 0.00 -1.46 0.00 0.00 37.83 32.95 2g2n s LYS 29 CO 0.03 -0.60 0.40 0.00 0.16 0.00 0.00 175.35 175.34 2g2n s ALA 30 N 1.67 4.46 0.23 3.13 0.00 -0.76 -4.82 121.76 125.67 2g2n s ALA 30 Ca 0.69 -1.19 -0.06 0.00 0.00 0.00 0.00 51.96 51.40 2g2n s ALA 30 Cb -0.40 -0.72 0.39 0.00 0.00 0.00 0.00 23.12 22.39 2g2n s ALA 30 CO 0.31 -0.45 1.75 -0.44 0.00 0.00 0.00 175.76 176.93 2g2n h ASP 31 N 0.73 0.37 -3.24 0.00 3.32 -2.00 -3.39 116.42 112.22 2g2n h ASP 31 Ca -0.37 0.08 -0.57 0.00 0.02 0.00 0.00 57.03 56.20 2g2n h ASP 31 Cb 1.31 0.03 -0.35 0.00 0.22 0.00 0.00 39.33 40.54 2g2n h ASP 31 CO 0.57 0.18 -0.83 0.20 -1.72 0.00 0.00 179.24 177.65 2g2n s ASN 32 N -5.42 2.39 0.88 6.45 -0.87 -1.26 -5.07 114.94 112.03 2g2n s ASN 32 Ca -0.12 -0.41 0.00 0.00 -1.57 0.00 0.00 52.86 50.76 2g2n s ASN 32 Cb 0.19 -1.04 0.00 0.00 -0.02 0.00 0.00 41.25 40.38 2g2n s ASN 32 CO 0.76 -0.02 0.00 0.61 -2.57 0.00 0.00 177.10 175.88 2g2n n GLY 33 N 4.40 0.85 3.39 0.66 0.00 -1.26 -4.90 105.19 108.32 2g2n n GLY 33 Ca -0.18 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.97 2g2n n GLY 33 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2g2n s TRP 34 N 0.00 1.78 -0.07 1.61 0.52 -1.26 -1.84 118.94 119.68 2g2n s TRP 34 Ca 0.00 -0.81 0.01 0.00 0.02 0.00 0.00 56.10 55.31 2g2n s TRP 34 Cb 0.00 -1.04 0.02 0.00 -1.15 0.00 0.00 33.47 31.31 2g2n s TRP 34 CO 0.00 0.12 -0.07 -1.17 0.02 0.00 0.00 176.95 175.85 2g2n s LEU 35 N -3.39 1.29 0.09 2.99 2.96 -0.31 -4.87 118.68 117.45 2g2n s LEU 35 Ca 0.29 -0.22 -0.30 0.00 -0.22 0.00 0.00 54.13 53.68 2g2n s LEU 35 Cb 0.05 -0.67 -0.06 0.00 0.50 0.00 0.00 46.19 46.01 2g2n s LEU 35 CO 0.11 -0.06 1.07 -1.58 -1.32 0.00 0.00 176.35 174.57 2g2n s GLN 36 N 1.20 4.56 -0.20 1.98 0.74 -1.26 -0.33 119.66 126.34 2g2n s GLN 36 Ca -0.06 1.61 0.15 0.00 0.05 0.00 0.00 55.36 57.11 2g2n s GLN 36 Cb -0.14 -3.36 -0.23 0.00 1.10 0.00 0.00 33.01 30.38 2g2n s GLN 36 CO -0.02 -0.03 0.02 1.28 -0.55 0.00 0.00 175.29 175.99 2g2n n LEU 37 N 3.26 0.52 -3.56 3.68 4.77 0.62 -4.91 117.00 121.38 2g2n n LEU 37 Ca 0.05 -0.02 -0.07 0.00 -0.03 0.00 0.00 56.01 55.94 2g2n n LEU 37 Cb 0.48 0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.79 2g2n n LEU 37 CO 0.53 0.56 0.68 0.21 -1.33 0.00 0.00 177.39 178.04 2g2n s ASN 38 N -5.57 -0.33 -0.07 -1.43 2.47 -1.09 -4.63 114.94 104.30 2g2n s ASN 38 Ca -0.14 -0.10 -0.10 0.00 0.42 0.00 0.00 52.86 52.93 2g2n s ASN 38 Cb 0.06 0.42 0.02 0.00 -1.45 0.00 0.00 41.25 40.31 2g2n s ASN 38 CO 0.76 -0.71 0.26 0.28 -3.72 0.00 0.00 177.10 173.97 2g2n s THR 39 N -3.20 0.02 0.31 -5.21 -1.32 -1.26 -1.50 115.64 103.48 2g2n s THR 39 Ca 0.07 -0.20 -0.16 0.00 -1.21 0.00 0.00 61.69 60.19 2g2n s THR 39 Cb -0.01 -0.44 0.02 0.00 -1.51 0.00 0.00 72.50 70.56 2g2n s THR 39 CO -0.06 -0.11 0.67 0.00 -2.21 0.00 0.00 174.62 172.91 2g2n s ALA 40 N -0.39 -0.69 0.04 11.08 0.00 -0.80 -5.01 121.76 125.99 2g2n s ALA 40 Ca -0.05 -0.67 0.09 0.00 0.00 0.00 0.00 51.96 51.33 2g2n s ALA 40 Cb -0.03 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.93 2g2n s ALA 40 CO 0.01 -0.96 -0.26 0.15 0.00 0.00 0.00 175.76 174.70 2g2n s LYS 41 N -3.37 1.83 0.46 0.00 1.02 -1.26 -0.42 119.74 118.00 2g2n s LYS 41 Ca 0.17 -1.08 -0.24 0.00 0.02 0.00 0.00 55.97 54.83 2g2n s LYS 41 Cb -0.04 -1.97 -0.07 0.00 -0.52 0.00 0.00 37.83 35.22 2g2n s LYS 41 CO 0.10 0.51 1.36 0.95 -0.92 0.00 0.00 175.35 177.35 2g2n s THR 42 N -0.78 2.30 0.04 2.17 -4.23 -0.33 -4.78 115.64 110.05 2g2n s THR 42 Ca 0.11 0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.87 2g2n s THR 42 Cb -0.10 -3.14 0.01 0.00 1.34 0.00 0.00 72.50 70.61 2g2n s THR 42 CO 0.02 0.02 0.06 -0.90 -0.54 0.00 0.00 174.62 173.28 2g2n n ASP 43 N -0.33 0.02 0.21 3.99 5.68 0.28 -0.83 116.55 125.57 2g2n n ASP 43 Ca 0.06 -1.03 0.15 0.00 -0.50 0.00 0.00 54.79 53.47 2g2n n ASP 43 Cb 0.44 -0.05 0.70 0.00 -1.14 0.00 0.00 41.12 41.07 2g2n n ASP 43 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2g2n h LYS 44 N 0.00 0.00 -0.65 0.11 2.10 -1.95 0.58 116.57 116.77 2g2n h LYS 44 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2g2n h LYS 44 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2g2n h LYS 44 CO 0.02 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.22 2g2n n ASP 45 N -2.62 4.52 -1.19 7.07 8.00 -1.26 -4.79 116.55 126.28 2g2n n ASP 45 Ca -0.00 -2.45 -0.15 0.00 0.71 0.00 0.00 54.79 52.90 2g2n n ASP 45 Cb 0.17 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 40.64 2g2n n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g2n n GLY 46 N 1.03 1.38 3.62 0.44 0.00 0.20 -4.75 105.19 107.11 2g2n n GLY 46 Ca 0.24 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 2g2n n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2g2n s ARG 47 N -3.39 2.44 -0.31 1.61 0.52 -1.26 -1.30 118.95 117.27 2g2n s ARG 47 Ca 0.00 -0.83 0.03 0.00 -0.52 0.00 0.00 55.73 54.40 2g2n s ARG 47 Cb 0.00 -2.46 0.09 0.00 0.52 0.00 0.00 34.95 33.10 2g2n s ARG 47 CO 0.00 0.56 0.02 0.42 0.02 0.00 0.00 175.30 176.32 2g2n s ILE 48 N -1.14 1.96 0.31 1.52 1.01 -0.04 -0.56 121.20 124.26 2g2n s ILE 48 Ca 0.21 -1.96 0.12 0.00 0.00 0.00 0.00 60.65 59.02 2g2n s ILE 48 Cb -0.11 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 40.02 2g2n s ILE 48 CO 0.12 -0.46 1.70 0.11 0.00 0.00 0.00 174.94 176.42 2g2n h LYS 49 N 7.75 0.00 -2.47 2.79 1.57 -1.86 -1.58 116.57 122.78 2g2n h LYS 49 Ca -0.10 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.09 2g2n h LYS 49 Cb 1.03 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.95 2g2n h LYS 49 CO 0.49 0.51 -0.92 0.00 -0.57 0.00 0.00 179.45 178.96 2g2n s ALA 50 N -3.85 1.53 -0.26 3.86 0.00 -1.25 -4.08 121.76 117.71 2g2n s ALA 50 Ca -0.02 -2.48 0.22 0.00 0.00 0.00 0.00 51.96 49.68 2g2n s ALA 50 Cb 0.13 -1.65 0.05 0.00 0.00 0.00 0.00 23.12 21.66 2g2n s ALA 50 CO 0.75 -2.00 1.14 1.25 0.00 0.00 0.00 175.76 176.89 2g2n h LEU 51 N 5.84 0.00 -9.77 0.00 5.85 -1.31 -3.46 115.31 112.45 2g2n h LEU 51 Ca 0.22 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.42 2g2n h LEU 51 Cb 0.91 0.00 0.04 0.00 0.37 0.00 0.00 40.66 41.98 2g2n h LEU 51 CO 0.38 0.06 0.61 0.86 -0.34 0.00 0.00 178.44 180.01 2g2n s TRP 52 N -3.29 3.25 0.94 1.25 -0.11 -1.26 -4.78 118.94 114.94 2g2n s TRP 52 Ca 0.01 1.39 -0.16 0.00 1.22 0.00 0.00 56.10 58.56 2g2n s TRP 52 Cb 0.09 -3.56 0.24 0.00 -1.50 0.00 0.00 33.47 28.73 2g2n s TRP 52 CO 0.77 -1.60 0.80 -0.35 -4.62 0.00 0.00 176.95 171.95 2g2n n PRO 53 N 1.70 -2.81 -2.06 5.86 -0.04 -1.26 -4.89 135.00 131.49 2g2n n PRO 53 Ca 0.02 -1.28 -0.42 0.00 -0.04 0.00 0.00 63.50 61.79 2g2n n PRO 53 Cb 0.43 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 2g2n n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2g2n n GLU 54 N -4.11 3.46 -3.66 0.54 -0.58 -1.26 -4.85 120.64 110.17 2g2n n GLU 54 Ca 0.11 -3.16 -0.15 0.00 -0.42 0.00 0.00 57.16 53.55 2g2n n GLU 54 Cb 0.44 -3.01 -0.08 0.00 -0.57 0.00 0.00 31.44 28.22 2g2n n GLU 54 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2g2n s GLN 55 N 1.25 0.75 0.29 3.49 -0.21 -1.26 -5.15 119.66 118.82 2g2n s GLN 55 Ca 0.45 0.33 -0.29 0.00 0.02 0.00 0.00 55.36 55.87 2g2n s GLN 55 Cb 0.12 0.35 -0.10 0.00 1.00 0.00 0.00 33.01 34.39 2g2n s GLN 55 CO -0.04 -0.18 1.17 0.95 -2.12 0.00 0.00 175.29 175.08 2g2n s THR 56 N -0.60 3.23 0.40 -0.19 -4.23 -1.26 -5.02 115.64 107.97 2g2n s THR 56 Ca -0.07 1.23 -0.12 0.00 -1.18 0.00 0.00 61.69 61.55 2g2n s THR 56 Cb -0.03 -3.78 -0.07 0.00 1.34 0.00 0.00 72.50 69.96 2g2n s THR 56 CO 0.04 0.29 0.78 0.00 -0.54 0.00 0.00 174.62 175.19 2g2n s ALA 57 N -1.09 3.32 0.18 3.99 0.00 -1.26 -5.10 121.76 121.80 2g2n s ALA 57 Ca 0.46 -0.12 0.07 0.00 0.00 0.00 0.00 51.96 52.38 2g2n s ALA 57 Cb -0.35 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2g2n s ALA 57 CO 0.45 0.04 0.01 0.95 0.00 0.00 0.00 175.76 177.20 2g2n s THR 58 N -2.32 3.73 0.59 0.00 -4.23 -1.26 -4.85 115.64 107.31 2g2n s THR 58 Ca 0.53 -1.46 -0.20 0.00 -1.18 0.00 0.00 61.69 59.38 2g2n s THR 58 Cb -0.10 -2.89 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 2g2n s THR 58 CO 0.28 -0.14 1.33 0.42 -0.54 0.00 0.00 174.62 175.98 2g2n s THR 59 N -1.79 2.03 -5.00 3.99 -4.23 -1.26 -4.87 115.64 104.51 2g2n s THR 59 Ca 0.28 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2g2n s THR 59 Cb -0.09 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.74 2g2n s THR 59 CO 0.19 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 2g2n n GLY 60 N 0.81 0.84 3.87 3.99 0.00 -0.23 -4.98 105.19 109.49 2g2n n GLY 60 Ca 0.13 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 2g2n n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2g2n s ASP 61 N -3.10 6.67 0.14 1.61 1.01 -1.26 -1.28 116.67 120.45 2g2n s ASP 61 Ca 0.00 0.87 -0.01 0.00 0.71 0.00 0.00 52.55 54.11 2g2n s ASP 61 Cb 0.00 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 2g2n s ASP 61 CO 0.00 0.09 0.07 -0.31 0.21 0.00 0.00 175.17 175.23 2g2n s TYR 62 N -1.53 0.89 -0.08 4.23 2.02 0.35 -1.42 117.35 121.82 2g2n s TYR 62 Ca 0.38 -1.25 -0.03 0.00 -0.37 0.00 0.00 57.07 55.80 2g2n s TYR 62 Cb -0.13 -0.49 0.04 0.00 -0.40 0.00 0.00 41.96 40.98 2g2n s TYR 62 CO 0.20 -0.53 0.15 0.50 -1.57 0.00 0.00 175.55 174.30 2g2n s ARG 63 N -4.06 0.05 -0.08 -0.62 3.52 -0.40 -1.05 118.95 116.32 2g2n s ARG 63 Ca 0.26 0.49 -0.05 0.00 -0.13 0.00 0.00 55.73 56.29 2g2n s ARG 63 Cb 0.07 -0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.19 2g2n s ARG 63 CO 0.03 -0.25 0.16 0.14 -0.81 0.00 0.00 175.30 174.56 2g2n s VAL 64 N 1.87 5.48 -0.21 7.11 -7.23 -0.41 -0.84 120.40 126.17 2g2n s VAL 64 Ca -0.02 0.08 0.01 0.00 -1.81 0.00 0.00 61.98 60.24 2g2n s VAL 64 Cb -0.12 -3.45 0.05 0.00 0.56 0.00 0.00 36.38 33.41 2g2n s VAL 64 CO -0.06 0.51 -0.09 -0.69 -0.31 0.00 0.00 175.10 174.46 2g2n s VAL 65 N -1.14 1.62 -0.24 1.32 1.01 -0.58 -0.02 120.40 122.37 2g2n s VAL 65 Ca 0.20 -1.06 -0.23 0.00 0.00 0.00 0.00 61.98 60.89 2g2n s VAL 65 Cb -0.12 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2g2n s VAL 65 CO 0.10 0.11 0.75 -0.36 0.00 0.00 0.00 175.10 175.69 2g2n s PHE 66 N 1.39 3.30 -1.37 5.22 0.08 -0.16 -1.70 117.98 124.74 2g2n s PHE 66 Ca -0.02 1.02 -0.14 0.00 0.12 0.00 0.00 56.93 57.90 2g2n s PHE 66 Cb -0.17 -2.96 0.08 0.00 -0.57 0.00 0.00 43.02 39.40 2g2n s PHE 66 CO -0.08 -0.36 2.00 1.63 -0.10 0.00 0.00 175.22 178.31 2g2n n LYS 67 N 5.85 3.12 0.07 0.44 4.76 -0.16 -0.84 118.16 131.40 2g2n n LYS 67 Ca 0.03 -3.03 -0.02 0.00 -2.87 0.00 0.00 58.31 52.42 2g2n n LYS 67 Cb 0.48 -3.24 -0.06 0.00 -1.84 0.00 0.00 35.03 30.37 2g2n n LYS 67 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2g2n h THR 68 N 4.31 0.98 -0.40 -0.18 1.35 -1.86 -3.23 112.91 113.87 2g2n h THR 68 Ca 0.49 -2.54 0.08 0.00 -0.55 0.00 0.00 66.41 63.90 2g2n h THR 68 Cb 0.70 2.43 -0.08 0.00 -1.73 0.00 0.00 68.15 69.47 2g2n h THR 68 CO 1.70 0.56 -0.11 1.23 -0.25 0.00 0.00 175.52 178.65 2g2n h GLY 69 N 3.43 0.27 1.06 5.82 0.00 -1.54 -1.54 103.07 110.56 2g2n h GLY 69 Ca -0.09 0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 2g2n h GLY 69 CO 0.08 -0.16 0.35 -0.55 0.00 0.00 0.00 176.54 176.26 2g2n h ASP 70 N -0.02 1.10 -0.28 0.19 3.32 -1.75 -0.33 116.42 118.65 2g2n h ASP 70 Ca 0.20 -0.16 0.01 0.00 0.02 0.00 0.00 57.03 57.10 2g2n h ASP 70 Cb 0.31 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2g2n h ASP 70 CO -0.43 0.96 0.17 0.22 -1.72 0.00 0.00 179.24 178.44 2g2n h TYR 71 N 1.18 0.32 -0.36 4.55 3.20 -1.45 -1.58 116.97 122.84 2g2n h TYR 71 Ca 0.28 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 62.00 2g2n h TYR 71 Cb 0.18 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 2g2n h TYR 71 CO 0.02 0.19 -0.38 0.74 -1.64 0.00 0.00 178.16 177.09 2g2n h PHE 72 N 0.35 1.03 -0.77 -3.82 0.04 -1.12 -3.12 116.94 109.52 2g2n h PHE 72 Ca 0.11 -0.30 0.08 0.00 2.80 0.00 0.00 57.97 60.66 2g2n h PHE 72 Cb -0.01 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 37.87 2g2n h PHE 72 CO -0.07 1.10 0.50 -0.22 -0.60 0.00 0.00 178.31 179.03 2g2n h LYS 73 N 0.71 0.72 -0.01 1.51 3.64 -0.76 0.28 116.57 122.65 2g2n h LYS 73 Ca 0.06 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 2g2n h LYS 73 Cb 0.96 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2g2n h LYS 73 CO 0.09 0.47 -0.47 0.87 -2.27 0.00 0.00 179.45 178.15 2g2n h LYS 74 N 0.74 0.02 -0.01 1.90 1.57 -1.23 -1.31 116.57 118.24 2g2n h LYS 74 Ca 0.35 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 2g2n h LYS 74 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2g2n h LYS 74 CO -0.13 0.48 0.00 1.04 -0.57 0.00 0.00 179.45 180.27 2g2n n GLN 75 N -3.98 1.08 -2.85 3.15 6.02 -0.05 -4.92 117.38 115.82 2g2n n GLN 75 Ca -0.02 -0.11 -0.20 0.00 -0.01 0.00 0.00 57.00 56.66 2g2n n GLN 75 Cb 0.49 -1.40 0.03 0.00 1.02 0.00 0.00 30.24 30.37 2g2n n GLN 75 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2g2n n ASN 76 N -0.77 -5.76 -4.46 1.08 4.13 -0.49 -5.02 115.26 103.96 2g2n n ASN 76 Ca 0.19 -0.22 -0.31 0.00 1.68 0.00 0.00 54.58 55.92 2g2n n ASN 76 Cb 0.12 -4.62 -0.13 0.00 -1.54 0.00 0.00 39.78 33.61 2g2n n ASN 76 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2g2n s LEU 77 N -6.08 2.65 0.38 3.41 1.43 -0.41 -5.00 118.68 115.06 2g2n s LEU 77 Ca 0.23 -0.37 -0.03 0.00 -1.03 0.00 0.00 54.13 52.93 2g2n s LEU 77 Cb -0.10 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 2g2n s LEU 77 CO 0.29 0.28 0.64 -1.61 0.23 0.00 0.00 176.35 176.17 2g2n s GLU 78 N -1.28 3.56 -0.01 1.70 2.02 -1.26 -3.23 118.70 120.19 2g2n s GLU 78 Ca 0.14 -0.03 -0.15 0.00 0.02 0.00 0.00 54.97 54.95 2g2n s GLU 78 Cb -0.11 -2.55 0.02 0.00 0.10 0.00 0.00 34.13 31.60 2g2n s GLU 78 CO 0.04 0.05 0.32 0.45 0.02 0.00 0.00 175.26 176.14 2g2n s SER 79 N -3.76 -0.20 0.42 -0.19 0.15 -1.26 -4.84 113.70 104.01 2g2n s SER 79 Ca 0.44 0.08 0.17 0.00 0.70 0.00 0.00 55.95 57.34 2g2n s SER 79 Cb -0.10 0.32 0.91 0.00 -1.71 0.00 0.00 66.02 65.44 2g2n s SER 79 CO 0.37 -0.47 1.90 0.15 1.20 0.00 0.00 173.24 176.39 2g2n h PHE 80 N 3.78 0.00 -3.46 3.44 3.57 -1.63 -3.43 116.94 119.21 2g2n h PHE 80 Ca -0.30 0.00 -0.64 0.00 3.53 0.00 0.00 57.97 60.56 2g2n h PHE 80 Cb 1.18 0.00 -0.23 0.00 2.79 0.00 0.00 35.95 39.69 2g2n h PHE 80 CO 0.52 0.29 -0.65 -0.06 -2.23 0.00 0.00 178.31 176.17 2g2n s PHE 81 N -4.21 3.06 0.37 0.41 0.08 -1.26 -4.98 117.98 111.45 2g2n s PHE 81 Ca -0.03 -0.44 0.07 0.00 0.12 0.00 0.00 56.93 56.66 2g2n s PHE 81 Cb 0.14 -2.11 0.71 0.00 -0.57 0.00 0.00 43.02 41.20 2g2n s PHE 81 CO 0.69 -0.24 1.91 -1.00 -0.10 0.00 0.00 175.22 176.47 2g2n h PRO 82 N 7.58 0.37 -2.53 0.24 0.13 -1.98 -3.32 132.00 132.49 2g2n h PRO 82 Ca -0.36 -0.08 0.14 0.00 -0.87 0.00 0.00 66.00 64.83 2g2n h PRO 82 Cb 1.18 -0.05 -0.07 0.00 0.13 0.00 0.00 31.00 32.18 2g2n h PRO 82 CO 0.61 0.45 0.42 -1.83 -0.23 0.00 0.00 178.00 177.42 2g2n s GLU 83 N -4.87 1.39 -0.30 0.86 -1.05 -1.26 -2.18 118.70 111.28 2g2n s GLU 83 Ca -0.06 -0.78 0.01 0.00 -0.15 0.00 0.00 54.97 53.99 2g2n s GLU 83 Cb 0.16 0.46 0.09 0.00 -0.44 0.00 0.00 34.13 34.40 2g2n s GLU 83 CO 0.75 -0.64 0.04 0.42 0.95 0.00 0.00 175.26 176.78 2g2n s ILE 84 N -3.34 1.53 0.20 1.83 1.01 -0.02 -4.91 121.20 117.50 2g2n s ILE 84 Ca 0.13 -1.67 -0.27 0.00 0.00 0.00 0.00 60.65 58.83 2g2n s ILE 84 Cb -0.03 -2.05 -0.08 0.00 0.01 0.00 0.00 42.46 40.31 2g2n s ILE 84 CO 0.04 -0.50 0.84 -2.16 0.00 0.00 0.00 174.94 173.16 2g2n s PRO 85 N 1.31 4.66 -0.11 2.79 0.04 -1.26 -0.99 135.00 141.45 2g2n s PRO 85 Ca 0.06 1.28 -0.01 0.00 0.04 0.00 0.00 61.00 62.37 2g2n s PRO 85 Cb -0.18 -3.24 0.03 0.00 0.04 0.00 0.00 34.50 31.14 2g2n s PRO 85 CO -0.14 0.54 -0.06 0.08 0.04 0.00 0.00 177.00 177.46 2g2n s VAL 86 N -1.19 0.88 -0.13 -0.36 1.01 0.97 -4.99 120.40 116.59 2g2n s VAL 86 Ca 0.38 -0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 2g2n s VAL 86 Cb -0.24 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 2g2n s VAL 86 CO 0.28 0.33 0.25 -1.61 0.00 0.00 0.00 175.10 174.35 2g2n s GLU 87 N 1.77 3.96 0.13 2.72 2.02 -1.26 -1.29 118.70 126.75 2g2n s GLU 87 Ca 0.05 0.04 -0.06 0.00 0.02 0.00 0.00 54.97 55.02 2g2n s GLU 87 Cb -0.13 -3.32 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 2g2n s GLU 87 CO -0.08 0.48 0.17 -0.59 0.02 0.00 0.00 175.26 175.27 2g2n s PHE 88 N -0.24 0.50 -0.11 1.61 -0.12 -0.21 -4.99 117.98 114.41 2g2n s PHE 88 Ca 0.16 -0.89 0.01 0.00 -0.05 0.00 0.00 56.93 56.16 2g2n s PHE 88 Cb -0.13 -0.21 -0.02 0.00 -0.63 0.00 0.00 43.02 42.03 2g2n s PHE 88 CO 0.05 -0.60 -0.14 -1.58 -0.05 0.00 0.00 175.22 172.90 2g2n s HIS 89 N -3.97 2.77 -0.25 3.49 5.65 -1.26 -0.49 115.29 121.23 2g2n s HIS 89 Ca 0.16 -0.58 -0.09 0.00 0.25 0.00 0.00 55.06 54.80 2g2n s HIS 89 Cb 0.05 -1.79 -0.04 0.00 -1.18 0.00 0.00 32.58 29.62 2g2n s HIS 89 CO -0.02 -0.15 0.11 0.42 -0.65 0.00 0.00 174.74 174.45 2g2n s ILE 90 N 0.15 4.80 -0.01 0.89 1.01 -0.40 -4.96 121.20 122.67 2g2n s ILE 90 Ca -0.07 -0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2g2n s ILE 90 Cb -0.15 -3.25 -0.08 0.00 0.01 0.00 0.00 42.46 38.99 2g2n s ILE 90 CO 0.05 0.33 0.10 -0.46 0.00 0.00 0.00 174.94 174.96 2g2n n ASN 91 N 4.68 3.77 -4.08 3.58 0.23 -1.26 -1.07 115.26 121.12 2g2n n ASN 91 Ca -0.15 0.00 -0.32 0.00 -0.53 0.00 0.00 54.58 53.57 2g2n n ASN 91 Cb 0.52 1.16 -0.16 0.00 -2.08 0.00 0.00 39.78 39.22 2g2n n ASN 91 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2g2n s LYS 92 N -2.34 2.58 0.28 -3.83 1.02 -1.26 -4.87 119.74 111.32 2g2n s LYS 92 Ca -0.02 -0.98 0.25 0.00 0.02 0.00 0.00 55.97 55.25 2g2n s LYS 92 Cb 0.03 -2.62 0.91 0.00 -0.52 0.00 0.00 37.83 35.64 2g2n s LYS 92 CO 0.22 -0.35 1.76 -0.39 -0.92 0.00 0.00 175.35 175.66 2g2n h VAL 93 N 6.27 0.00 -0.14 3.17 -1.51 -1.91 -3.01 116.25 119.12 2g2n h VAL 93 Ca -0.35 -0.40 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 2g2n h VAL 93 Cb 1.10 1.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.54 2g2n h VAL 93 CO 0.55 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.48 2g2n n ASN 94 N -2.38 2.82 -4.89 4.19 3.02 -1.26 -4.55 115.26 112.21 2g2n n ASN 94 Ca 0.03 -2.61 -0.29 0.00 -0.03 0.00 0.00 54.58 51.68 2g2n n ASN 94 Cb 0.33 -0.33 0.03 0.00 -0.61 0.00 0.00 39.78 39.20 2g2n n ASN 94 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2g2n s GLU 95 N -2.07 3.21 -0.20 3.52 2.12 -1.14 -5.02 118.70 119.13 2g2n s GLU 95 Ca 0.26 0.45 -0.18 0.00 0.36 0.00 0.00 54.97 55.86 2g2n s GLU 95 Cb 0.20 -2.13 -0.03 0.00 0.26 0.00 0.00 34.13 32.43 2g2n s GLU 95 CO 0.07 -0.71 0.51 -1.58 -0.54 0.00 0.00 175.26 173.01 2g2n s HIS 96 N -3.16 3.38 -0.13 5.30 5.65 -1.26 -4.68 115.29 120.38 2g2n s HIS 96 Ca 0.55 0.77 -0.01 0.00 0.25 0.00 0.00 55.06 56.62 2g2n s HIS 96 Cb -0.11 -2.66 -0.02 0.00 -1.18 0.00 0.00 32.58 28.61 2g2n s HIS 96 CO 0.51 -0.09 -0.08 0.71 -0.65 0.00 0.00 174.74 175.13 2g2n s TYR 97 N 1.60 2.91 -0.14 3.88 2.02 0.11 -5.01 117.35 122.72 2g2n s TYR 97 Ca 0.24 -0.41 -0.00 0.00 -0.37 0.00 0.00 57.07 56.53 2g2n s TYR 97 Cb -0.15 -1.87 0.03 0.00 -0.40 0.00 0.00 41.96 39.57 2g2n s TYR 97 CO 0.10 -0.06 -0.07 -1.58 -1.57 0.00 0.00 175.55 172.37 2g2n s HIS 98 N 0.19 1.64 -0.50 2.71 2.46 -1.26 -1.16 115.29 119.37 2g2n s HIS 98 Ca -0.05 -0.95 0.03 0.00 0.47 0.00 0.00 55.06 54.57 2g2n s HIS 98 Cb -0.14 -1.30 0.13 0.00 -0.13 0.00 0.00 32.58 31.14 2g2n s HIS 98 CO 0.04 -0.58 0.27 0.08 -2.47 0.00 0.00 174.74 172.08 2g2n s VAL 99 N 1.66 2.14 0.66 0.89 1.01 -0.42 -0.64 120.40 125.69 2g2n s VAL 99 Ca 0.03 -3.09 -0.12 0.00 0.00 0.00 0.00 61.98 58.80 2g2n s VAL 99 Cb -0.14 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 2g2n s VAL 99 CO -0.08 -0.85 1.05 -2.84 0.00 0.00 0.00 175.10 172.38 2g2n s PRO 100 N -0.11 3.18 -0.10 2.72 0.02 -1.25 -3.57 135.00 135.88 2g2n s PRO 100 Ca 0.18 0.96 0.01 0.00 0.02 0.00 0.00 61.00 62.16 2g2n s PRO 100 Cb -0.24 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.28 2g2n s PRO 100 CO -0.01 -0.91 -0.10 -1.17 -0.33 0.00 0.00 177.00 174.48 2g2n s LEU 101 N -5.23 1.41 -0.34 -5.54 2.96 0.24 -3.71 118.68 108.47 2g2n s LEU 101 Ca 0.58 -0.33 -0.12 0.00 -0.22 0.00 0.00 54.13 54.05 2g2n s LEU 101 Cb -0.13 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 2g2n s LEU 101 CO 0.51 -0.06 0.22 -0.76 -1.32 0.00 0.00 176.35 174.94 2g2n s LEU 102 N 1.33 4.45 -0.11 -0.68 1.43 -0.11 -1.22 118.68 123.77 2g2n s LEU 102 Ca -0.02 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.62 2g2n s LEU 102 Cb -0.14 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 2g2n s LEU 102 CO -0.04 -0.24 -0.20 -0.22 0.23 0.00 0.00 176.35 175.87 2g2n s LEU 103 N 1.69 2.30 0.31 1.79 2.96 -0.29 -1.17 118.68 126.27 2g2n s LEU 103 Ca 0.05 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 2g2n s LEU 103 Cb -0.17 -1.48 -0.06 0.00 0.50 0.00 0.00 46.19 44.98 2g2n s LEU 103 CO 0.09 0.16 0.07 -0.44 -1.32 0.00 0.00 176.35 174.92 2g2n s SER 104 N 0.33 2.04 0.32 3.68 0.01 -0.00 -0.79 113.70 119.29 2g2n s SER 104 Ca -0.16 -1.39 0.02 0.00 1.31 0.00 0.00 55.95 55.73 2g2n s SER 104 Cb -0.17 0.00 0.55 0.00 0.21 0.00 0.00 66.02 66.62 2g2n s SER 104 CO 0.08 -0.65 1.89 1.56 0.41 0.00 0.00 173.24 176.53 2g2n h GLN 105 N 2.18 0.69 0.00 12.44 4.20 -2.00 -3.22 115.11 129.41 2g2n h GLN 105 Ca -0.40 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.20 2g2n h GLN 105 Cb 1.25 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.91 2g2n h GLN 105 CO 0.67 0.61 -0.15 0.66 -0.67 0.00 0.00 178.83 179.94 2g2n n TYR 106 N -4.32 0.00 -3.51 2.96 4.01 -1.26 -1.49 117.16 113.55 2g2n n TYR 106 Ca 0.03 -0.63 -0.11 0.00 -0.16 0.00 0.00 57.90 57.03 2g2n n TYR 106 Cb 0.19 -0.11 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 2g2n n TYR 106 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2g2n s GLY 107 N -2.10 -0.47 0.18 2.72 0.00 -1.22 -4.95 107.32 101.49 2g2n s GLY 107 Ca 0.19 1.22 -0.15 0.00 0.00 0.00 0.00 44.72 45.98 2g2n s GLY 107 CO 0.02 0.58 0.45 -2.52 0.00 0.00 0.00 173.10 171.63 2g2n s TYR 108 N -2.40 0.01 0.05 1.90 -0.85 -1.26 -0.82 117.35 113.99 2g2n s TYR 108 Ca -0.00 -0.36 0.05 0.00 -0.52 0.00 0.00 57.07 56.23 2g2n s TYR 108 Cb -0.01 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.57 2g2n s TYR 108 CO -0.04 -0.85 -0.13 -1.12 -1.52 0.00 0.00 175.55 171.89 2g2n s SER 109 N -2.89 1.55 0.06 -0.18 0.01 -0.31 -4.99 113.70 106.94 2g2n s SER 109 Ca 0.11 -0.54 -0.04 0.00 1.31 0.00 0.00 55.95 56.79 2g2n s SER 109 Cb 0.00 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 2g2n s SER 109 CO -0.03 -0.05 0.07 0.28 0.41 0.00 0.00 173.24 173.92 2g2n s THR 110 N -1.10 0.17 0.18 1.44 -1.32 -1.26 -0.93 115.64 112.82 2g2n s THR 110 Ca -0.02 -1.40 -0.24 0.00 -1.21 0.00 0.00 61.69 58.82 2g2n s THR 110 Cb -0.09 -1.26 0.05 0.00 -1.51 0.00 0.00 72.50 69.70 2g2n s THR 110 CO 0.02 -0.77 0.81 -0.72 -2.21 0.00 0.00 174.62 171.74 2g2n s TYR 111 N -3.46 -0.24 -0.38 9.09 -0.85 -1.24 -5.06 117.35 115.20 2g2n s TYR 111 Ca 0.02 -0.09 -0.27 0.00 -0.52 0.00 0.00 57.07 56.21 2g2n s TYR 111 Cb 0.04 0.64 0.02 0.00 0.38 0.00 0.00 41.96 43.04 2g2n s TYR 111 CO -0.09 -0.95 1.01 0.50 -1.52 0.00 0.00 175.55 174.51 2g2n s ARG 112 N -3.57 3.87 0.88 -3.49 3.52 -1.26 -3.83 118.95 115.08 2g2n s ARG 112 Ca 0.09 0.70 -0.11 0.00 -0.13 0.00 0.00 55.73 56.28 2g2n s ARG 112 Cb -0.03 -3.81 0.17 0.00 -1.56 0.00 0.00 34.95 29.72 2g2n s ARG 112 CO 0.00 -1.03 1.22 0.20 -0.81 0.00 0.00 175.30 174.88 2g2n s GLY 113 N 1.94 1.76 0.00 8.12 0.00 0.18 -5.02 107.32 114.32 2g2n s GLY 113 Ca 0.42 -1.31 0.28 0.00 0.00 0.00 0.00 44.72 44.11 2g2n s GLY 113 CO 0.21 -0.62 2.00 1.44 0.00 0.00 0.00 173.10 176.13