#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 0.02 -3.74 -1.44 -5.35 -1.26 -4.75 119.36 102.83 2g2n n ILE 5 Ca 0.00 -0.15 -0.21 0.00 -0.27 0.00 0.00 62.75 62.12 2g2n n ILE 5 Cb 0.00 0.08 -0.18 0.00 -1.74 0.00 0.00 39.64 37.80 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 -1.94 0.45 0.02 7.28 2.96 -1.26 -0.05 118.68 126.14 2g2n s LEU 6 Ca 0.41 0.01 0.07 0.00 -0.22 0.00 0.00 54.13 54.40 2g2n s LEU 6 Cb 0.21 -0.25 -0.02 0.00 0.50 0.00 0.00 46.19 46.62 2g2n s LEU 6 CO 0.34 -0.21 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.50 2g2n s SER 7 N 1.92 2.58 0.09 3.68 0.01 -0.21 -1.30 113.70 120.48 2g2n s SER 7 Ca 0.03 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 56.84 2g2n s SER 7 Cb -0.12 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.82 2g2n s SER 7 CO -0.04 0.22 -0.09 0.68 0.41 0.00 0.00 173.24 174.42 2g2n s VAL 8 N -0.68 0.85 0.14 3.43 -7.23 -0.80 -1.30 120.40 114.81 2g2n s VAL 8 Ca 0.08 -1.69 -0.13 0.00 -1.81 0.00 0.00 61.98 58.43 2g2n s VAL 8 Cb -0.09 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.47 2g2n s VAL 8 CO 0.01 -0.64 0.36 -1.38 -0.31 0.00 0.00 175.10 173.14 2g2n s HIS 9 N -2.71 0.02 -0.07 2.82 -3.43 -1.24 -0.34 115.29 110.34 2g2n s HIS 9 Ca 0.06 -0.37 0.01 0.00 -0.80 0.00 0.00 55.06 53.96 2g2n s HIS 9 Cb -0.01 0.15 0.02 0.00 -1.43 0.00 0.00 32.58 31.31 2g2n s HIS 9 CO -0.01 -0.72 -0.06 0.42 -2.00 0.00 0.00 174.74 172.36 2g2n s ILE 10 N -3.87 0.76 -0.18 -5.38 1.01 -0.46 -0.94 121.20 112.15 2g2n s ILE 10 Ca 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 60.65 60.48 2g2n s ILE 10 Cb 0.02 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 2g2n s ILE 10 CO -0.07 0.29 -0.06 -0.22 0.00 0.00 0.00 174.94 174.88 2g2n s LEU 11 N 1.12 3.00 -0.49 2.97 2.96 -0.37 -1.47 118.68 126.39 2g2n s LEU 11 Ca -0.07 -0.28 -0.27 0.00 -0.22 0.00 0.00 54.13 53.29 2g2n s LEU 11 Cb -0.14 -1.73 0.03 0.00 0.50 0.00 0.00 46.19 44.85 2g2n s LEU 11 CO -0.01 0.09 1.04 0.21 -1.32 0.00 0.00 176.35 176.35 2g2n s ASN 12 N 0.85 6.52 0.07 3.68 3.84 -0.22 -0.89 114.94 128.78 2g2n s ASN 12 Ca -0.01 0.18 0.21 0.00 0.21 0.00 0.00 52.86 53.44 2g2n s ASN 12 Cb -0.15 -2.50 0.86 0.00 -0.55 0.00 0.00 41.25 38.92 2g2n s ASN 12 CO 0.01 -1.20 1.66 0.00 -2.79 0.00 0.00 177.10 174.78 2g2n n GLN 13 N 7.61 0.06 0.09 0.43 6.02 0.15 -0.58 117.38 131.16 2g2n n GLN 13 Ca 0.08 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 2g2n n GLN 13 Cb 0.49 -1.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.12 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 -3.37 115.11 112.94 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 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2g2n h GLN 14 CO 0.00 0.48 -1.20 0.25 -0.67 0.00 0.00 178.83 177.68 2g2n n THR 15 N -3.11 0.00 -1.58 -0.54 -2.24 -1.05 -4.99 114.28 100.76 2g2n n THR 15 Ca -0.03 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.36 2g2n n THR 15 Cb 0.80 0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 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 1.69 1.17 3.27 3.38 0.00 0.25 -5.01 105.19 109.94 2g2n n GLY 16 Ca -0.01 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.51 1.13 0.67 1.61 1.02 -1.16 -4.96 119.74 114.54 2g2n s LYS 17 Ca 0.00 -1.49 -0.17 0.00 0.02 0.00 0.00 55.97 54.33 2g2n s LYS 17 Cb 0.00 -0.72 0.00 0.00 -0.52 0.00 0.00 37.83 36.59 2g2n s LYS 17 CO 0.00 0.09 1.25 -2.14 -0.92 0.00 0.00 175.35 173.63 2g2n s PRO 18 N -3.73 2.45 -0.49 -1.68 0.02 -1.26 -1.06 135.00 129.25 2g2n s PRO 18 Ca 0.19 1.93 -0.20 0.00 0.02 0.00 0.00 61.00 62.93 2g2n s PRO 18 Cb 0.02 -1.85 0.04 0.00 0.02 0.00 0.00 34.50 32.73 2g2n s PRO 18 CO 0.02 -1.64 0.66 0.00 -0.33 0.00 0.00 177.00 175.72 2g2n s ALA 19 N -1.62 3.34 0.24 -1.55 0.00 -0.54 -4.65 121.76 116.98 2g2n s ALA 19 Ca 0.79 -1.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 2g2n s ALA 19 Cb -0.34 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.36 2g2n s ALA 19 CO 0.41 -1.98 0.48 0.00 0.00 0.00 0.00 175.76 174.67 2g2n s ALA 20 N 2.84 3.71 -1.54 0.00 0.00 -1.26 -4.27 121.76 121.25 2g2n s ALA 20 Ca 0.19 -0.65 -0.14 0.00 0.00 0.00 0.00 51.96 51.36 2g2n s ALA 20 Cb -0.17 -2.17 0.09 0.00 0.00 0.00 0.00 23.12 20.87 2g2n s ALA 20 CO 0.15 0.36 0.98 -3.47 0.00 0.00 0.00 175.76 173.78 2g2n n ASP 21 N -0.72 -4.72 -4.72 0.00 2.03 0.17 -4.93 116.55 103.65 2g2n n ASP 21 Ca -0.03 -0.79 -0.36 0.00 0.52 0.00 0.00 54.79 54.13 2g2n n ASP 21 Cb 0.54 -3.84 -0.08 0.00 -0.72 0.00 0.00 41.12 37.02 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 -3.30 5.33 0.22 5.18 1.01 -1.26 -4.79 120.40 122.80 2g2n s VAL 22 Ca 0.66 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 62.77 2g2n s VAL 22 Cb -0.33 -3.58 -0.08 0.00 0.00 0.00 0.00 36.38 32.38 2g2n s VAL 22 CO 0.83 0.39 1.11 -0.89 0.00 0.00 0.00 175.10 176.55 2g2n s THR 23 N 0.55 3.66 -0.06 3.92 2.01 -1.26 -0.77 115.64 123.69 2g2n s THR 23 Ca 0.13 1.52 -0.01 0.00 0.31 0.00 0.00 61.69 63.65 2g2n s THR 23 Cb -0.13 -3.97 0.03 0.00 0.01 0.00 0.00 72.50 68.44 2g2n s THR 23 CO 0.02 0.30 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.56 2g2n s VAL 24 N -0.60 0.36 0.21 3.82 1.01 0.44 -0.73 120.40 124.91 2g2n s VAL 24 Ca 0.48 0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.58 2g2n s VAL 24 Cb -0.31 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2g2n s VAL 24 CO 0.38 0.23 0.34 0.42 0.00 0.00 0.00 175.10 176.47 2g2n s THR 25 N 1.61 5.27 -0.09 3.92 -4.23 -0.62 -1.86 115.64 119.64 2g2n s THR 25 Ca -0.01 -0.91 0.02 0.00 -1.18 0.00 0.00 61.69 59.62 2g2n s THR 25 Cb -0.13 -3.82 0.01 0.00 1.34 0.00 0.00 72.50 69.90 2g2n s THR 25 CO -0.03 -0.26 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.40 2g2n s LEU 26 N -3.76 1.78 0.15 4.79 2.96 -0.46 -1.35 118.68 122.79 2g2n s LEU 26 Ca 0.34 -0.42 0.09 0.00 -0.22 0.00 0.00 54.13 53.92 2g2n s LEU 26 Cb -0.10 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2g2n s LEU 26 CO 0.29 0.05 -0.20 -1.61 -1.32 0.00 0.00 176.35 173.56 2g2n s GLU 27 N 0.75 1.27 -0.09 1.98 2.02 0.78 -0.58 118.70 124.83 2g2n s GLU 27 Ca -0.12 -1.35 -0.01 0.00 0.02 0.00 0.00 54.97 53.52 2g2n s GLU 27 Cb -0.16 -1.43 -0.03 0.00 0.10 0.00 0.00 34.13 32.61 2g2n s GLU 27 CO 0.02 0.31 -0.05 0.21 0.02 0.00 0.00 175.26 175.77 2g2n s LYS 28 N -2.50 2.99 0.19 1.61 2.20 0.73 -1.17 119.74 123.79 2g2n s LYS 28 Ca 0.14 -0.51 -0.30 0.00 -0.36 0.00 0.00 55.97 54.93 2g2n s LYS 28 Cb -0.07 -2.70 -0.08 0.00 -1.51 0.00 0.00 37.83 33.47 2g2n s LYS 28 CO 0.06 0.58 1.15 0.21 -0.36 0.00 0.00 175.35 176.99 2g2n s LYS 29 N -0.57 4.54 -0.24 4.03 2.20 -0.43 -0.69 119.74 128.57 2g2n s LYS 29 Ca 0.09 1.81 -0.11 0.00 -0.36 0.00 0.00 55.97 57.39 2g2n s LYS 29 Cb -0.12 -3.25 0.09 0.00 -1.51 0.00 0.00 37.83 33.04 2g2n s LYS 29 CO 0.02 0.00 0.57 0.00 -0.36 0.00 0.00 175.35 175.58 2g2n s ALA 30 N -0.23 -1.60 -1.27 3.13 0.00 -0.26 -4.81 121.76 116.73 2g2n s ALA 30 Ca 0.51 2.03 -0.16 0.00 0.00 0.00 0.00 51.96 54.34 2g2n s ALA 30 Cb -0.31 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.43 2g2n s ALA 30 CO 0.36 -0.56 0.59 -0.25 0.00 0.00 0.00 175.76 175.91 2g2n n ASP 31 N 4.78 -3.04 -0.15 0.00 8.00 -1.26 -1.00 116.55 123.88 2g2n n ASP 31 Ca -0.17 -1.10 -0.02 0.00 0.71 0.00 0.00 54.79 54.22 2g2n n ASP 31 Cb 0.54 -2.78 -0.01 0.00 -0.02 0.00 0.00 41.12 38.85 2g2n n ASP 31 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2g2n n ASN 32 N -2.68 -5.20 -1.81 -2.24 3.02 -1.26 -4.92 115.26 100.17 2g2n n ASN 32 Ca -0.18 0.05 -0.01 0.00 -0.03 0.00 0.00 54.58 54.40 2g2n n ASN 32 Cb 0.62 -3.24 -0.00 0.00 -0.61 0.00 0.00 39.78 36.55 2g2n n ASN 32 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g2n n GLY 33 N 0.75 4.12 3.11 7.41 0.00 -0.17 -5.18 105.19 115.23 2g2n n GLY 33 Ca -0.02 -2.05 -0.20 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.37 1.11 -0.10 1.61 0.52 -1.26 -1.10 118.94 118.34 2g2n s TRP 34 Ca 0.00 -0.31 0.03 0.00 0.02 0.00 0.00 56.10 55.85 2g2n s TRP 34 Cb 0.00 -0.67 0.01 0.00 -1.15 0.00 0.00 33.47 31.65 2g2n s TRP 34 CO 0.00 0.01 -0.21 -1.17 0.02 0.00 0.00 176.95 175.61 2g2n s LEU 35 N -0.86 1.97 0.13 2.99 2.96 0.13 -4.93 118.68 121.07 2g2n s LEU 35 Ca 0.02 -0.51 -0.30 0.00 -0.22 0.00 0.00 54.13 53.12 2g2n s LEU 35 Cb -0.07 -1.28 -0.07 0.00 0.50 0.00 0.00 46.19 45.27 2g2n s LEU 35 CO 0.01 0.11 1.18 -1.58 -1.32 0.00 0.00 176.35 174.75 2g2n s GLN 36 N 0.57 4.48 -0.13 1.98 0.74 -1.26 -0.19 119.66 125.85 2g2n s GLN 36 Ca -0.14 1.81 0.07 0.00 0.05 0.00 0.00 55.36 57.15 2g2n s GLN 36 Cb -0.17 -3.29 -0.13 0.00 1.10 0.00 0.00 33.01 30.52 2g2n s GLN 36 CO 0.05 -0.13 -0.02 1.28 -0.55 0.00 0.00 175.29 175.92 2g2n n LEU 37 N 3.07 1.01 -3.45 3.68 4.77 0.25 -4.91 117.00 121.42 2g2n n LEU 37 Ca 0.06 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 2g2n n LEU 37 Cb 0.46 0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 2g2n n LEU 37 CO 0.55 0.45 0.47 0.21 -1.33 0.00 0.00 177.39 177.75 2g2n s ASN 38 N -4.81 -0.53 -0.00 -1.43 2.47 -1.17 -4.67 114.94 104.81 2g2n s ASN 38 Ca -0.11 0.06 -0.05 0.00 0.42 0.00 0.00 52.86 53.18 2g2n s ASN 38 Cb 0.04 0.54 -0.00 0.00 -1.45 0.00 0.00 41.25 40.38 2g2n s ASN 38 CO 0.44 -0.86 0.09 0.28 -3.72 0.00 0.00 177.10 173.34 2g2n s THR 39 N -3.38 0.07 0.29 -5.21 -1.32 -1.26 -1.35 115.64 103.48 2g2n s THR 39 Ca 0.01 -0.57 -0.19 0.00 -1.21 0.00 0.00 61.69 59.74 2g2n s THR 39 Cb -0.01 -0.33 0.02 0.00 -1.51 0.00 0.00 72.50 70.68 2g2n s THR 39 CO -0.10 -0.31 0.69 0.00 -2.21 0.00 0.00 174.62 172.69 2g2n s ALA 40 N -1.04 -0.96 -0.02 11.08 0.00 -0.78 -5.01 121.76 125.03 2g2n s ALA 40 Ca -0.11 -0.48 0.07 0.00 0.00 0.00 0.00 51.96 51.44 2g2n s ALA 40 Cb -0.06 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 2g2n s ALA 40 CO 0.01 -1.00 -0.25 0.15 0.00 0.00 0.00 175.76 174.67 2g2n s LYS 41 N -3.67 2.08 0.43 0.00 1.02 -1.26 -0.42 119.74 117.92 2g2n s LYS 41 Ca 0.14 -0.89 -0.26 0.00 0.02 0.00 0.00 55.97 54.98 2g2n s LYS 41 Cb -0.05 -1.97 -0.08 0.00 -0.52 0.00 0.00 37.83 35.20 2g2n s LYS 41 CO 0.08 0.51 1.38 0.95 -0.92 0.00 0.00 175.35 177.36 2g2n s THR 42 N -0.52 2.27 0.16 2.17 -4.23 0.05 -4.77 115.64 110.78 2g2n s THR 42 Ca 0.08 0.25 -0.03 0.00 -1.18 0.00 0.00 61.69 60.81 2g2n s THR 42 Cb -0.10 -3.14 0.04 0.00 1.34 0.00 0.00 72.50 70.63 2g2n s THR 42 CO -0.00 0.04 0.21 -0.90 -0.54 0.00 0.00 174.62 173.43 2g2n n ASP 43 N -0.05 -0.01 0.32 3.99 5.68 0.13 -0.66 116.55 125.95 2g2n n ASP 43 Ca 0.04 -1.07 0.22 0.00 -0.50 0.00 0.00 54.79 53.48 2g2n n ASP 43 Cb 0.42 -0.16 1.10 0.00 -1.14 0.00 0.00 41.12 41.34 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 -0.53 0.11 2.10 -1.95 0.03 116.57 116.33 2g2n h LYS 44 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 2g2n h LYS 44 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2g2n h LYS 44 CO 0.05 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.25 2g2n n ASP 45 N -3.06 2.87 -0.56 7.07 8.00 -1.26 -4.80 116.55 124.80 2g2n n ASP 45 Ca -0.02 -2.07 -0.07 0.00 0.71 0.00 0.00 54.79 53.34 2g2n n ASP 45 Cb 0.12 -0.37 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 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 1.22 0.91 3.59 0.44 0.00 -0.00 -4.73 105.19 106.61 2g2n n GLY 46 Ca 0.17 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.32 2.24 -0.32 1.61 0.52 -1.26 -1.35 118.95 118.07 2g2n s ARG 47 Ca 0.00 -0.96 0.03 0.00 -0.52 0.00 0.00 55.73 54.28 2g2n s ARG 47 Cb 0.00 -2.36 0.09 0.00 0.52 0.00 0.00 34.95 33.20 2g2n s ARG 47 CO 0.00 0.52 0.02 0.42 0.02 0.00 0.00 175.30 176.29 2g2n s ILE 48 N -1.20 2.07 0.33 1.52 1.01 0.54 -0.69 121.20 124.77 2g2n s ILE 48 Ca 0.22 -2.07 0.15 0.00 0.00 0.00 0.00 60.65 58.95 2g2n s ILE 48 Cb -0.11 -2.46 0.11 0.00 0.01 0.00 0.00 42.46 40.00 2g2n s ILE 48 CO 0.14 -0.49 1.81 0.11 0.00 0.00 0.00 174.94 176.51 2g2n h LYS 49 N 7.71 0.00 -2.21 2.79 1.57 -1.87 -2.14 116.57 122.42 2g2n h LYS 49 Ca -0.08 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.15 2g2n h LYS 49 Cb 1.03 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.97 2g2n h LYS 49 CO 0.50 0.38 -0.95 0.00 -0.57 0.00 0.00 179.45 178.81 2g2n n ALA 50 N -2.41 2.44 0.09 3.86 0.00 -1.25 -4.21 120.51 119.03 2g2n n ALA 50 Ca -0.01 -2.95 0.03 0.00 0.00 0.00 0.00 53.44 50.51 2g2n n ALA 50 Cb 0.43 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 19.05 2g2n n ALA 50 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2g2n h LEU 51 N 5.45 0.00 -9.83 0.00 5.85 -1.39 -3.46 115.31 111.93 2g2n h LEU 51 Ca 0.24 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.43 2g2n h LEU 51 Cb 0.92 0.00 0.08 0.00 0.37 0.00 0.00 40.66 42.03 2g2n h LEU 51 CO 0.35 0.43 0.77 0.86 -0.34 0.00 0.00 178.44 180.51 2g2n s TRP 52 N -3.02 2.86 1.22 1.25 -0.11 -1.26 -4.78 118.94 115.10 2g2n s TRP 52 Ca 0.00 1.07 -0.18 0.00 1.22 0.00 0.00 56.10 58.21 2g2n s TRP 52 Cb 0.08 -3.90 0.29 0.00 -1.50 0.00 0.00 33.47 28.45 2g2n s TRP 52 CO 0.78 -2.81 1.05 -1.25 -4.62 0.00 0.00 176.95 170.10 2g2n s PRO 53 N -1.05 -1.35 -1.25 5.86 0.04 -1.26 -4.90 135.00 131.08 2g2n s PRO 53 Ca 0.57 0.21 -0.13 0.00 0.04 0.00 0.00 61.00 61.69 2g2n s PRO 53 Cb -0.44 -1.56 0.15 0.00 0.04 0.00 0.00 34.50 32.70 2g2n s PRO 53 CO 0.51 -3.86 1.61 0.39 0.04 0.00 0.00 177.00 175.69 2g2n n GLU 54 N -4.91 3.39 -3.59 4.56 4.71 -1.26 -4.83 120.64 118.69 2g2n n GLU 54 Ca 0.10 -3.66 -0.12 0.00 -0.01 0.00 0.00 57.16 53.47 2g2n n GLU 54 Cb 0.58 -3.08 -0.06 0.00 -1.01 0.00 0.00 31.44 27.87 2g2n n GLU 54 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 2g2n s GLN 55 N 1.69 0.72 0.33 3.49 -2.07 -1.26 -5.14 119.66 117.42 2g2n s GLN 55 Ca 0.44 0.48 -0.29 0.00 -1.82 0.00 0.00 55.36 54.17 2g2n s GLN 55 Cb 0.02 0.34 -0.11 0.00 -1.09 0.00 0.00 33.01 32.17 2g2n s GLN 55 CO 0.01 -0.16 1.51 0.95 -1.32 0.00 0.00 175.29 176.28 2g2n s THR 56 N -0.41 2.15 0.44 3.63 -4.23 -1.26 -4.96 115.64 110.99 2g2n s THR 56 Ca -0.02 0.14 -0.22 0.00 -1.18 0.00 0.00 61.69 60.41 2g2n s THR 56 Cb -0.03 -3.09 -0.09 0.00 1.34 0.00 0.00 72.50 70.64 2g2n s THR 56 CO 0.01 0.03 1.04 0.00 -0.54 0.00 0.00 174.62 175.16 2g2n s ALA 57 N -0.63 2.99 0.14 3.99 0.00 -1.26 -5.07 121.76 121.92 2g2n s ALA 57 Ca 0.57 0.65 0.09 0.00 0.00 0.00 0.00 51.96 53.27 2g2n s ALA 57 Cb -0.46 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 2g2n s ALA 57 CO 0.55 -0.25 -0.14 0.95 0.00 0.00 0.00 175.76 176.88 2g2n s THR 58 N -1.81 3.06 0.71 0.00 -4.23 -1.26 -4.84 115.64 107.27 2g2n s THR 58 Ca 0.62 -1.52 -0.14 0.00 -1.18 0.00 0.00 61.69 59.48 2g2n s THR 58 Cb -0.19 -2.45 0.03 0.00 1.34 0.00 0.00 72.50 71.22 2g2n s THR 58 CO 0.24 0.03 1.12 0.42 -0.54 0.00 0.00 174.62 175.88 2g2n s THR 59 N -1.36 3.08 -4.01 3.99 -4.23 -1.26 -4.91 115.64 106.93 2g2n s THR 59 Ca 0.21 0.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.18 2g2n s THR 59 Cb -0.10 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 70.79 2g2n s THR 59 CO 0.13 -0.35 0.00 0.61 -0.54 0.00 0.00 174.62 174.46 2g2n n GLY 60 N -0.53 0.85 3.90 3.99 0.00 -0.70 -5.00 105.19 107.70 2g2n n GLY 60 Ca 0.11 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.80 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 -4.00 6.41 0.21 1.61 1.01 -1.26 -0.88 116.67 119.76 2g2n s ASP 61 Ca 0.00 0.41 0.01 0.00 0.71 0.00 0.00 52.55 53.68 2g2n s ASP 61 Cb 0.00 -2.03 -0.05 0.00 1.01 0.00 0.00 42.92 41.85 2g2n s ASP 61 CO 0.00 0.25 0.06 -0.31 0.21 0.00 0.00 175.17 175.38 2g2n s TYR 62 N -1.33 1.30 -0.08 4.23 2.02 -0.42 -1.31 117.35 121.76 2g2n s TYR 62 Ca 0.28 -1.15 -0.03 0.00 -0.37 0.00 0.00 57.07 55.80 2g2n s TYR 62 Cb -0.13 -0.74 0.05 0.00 -0.40 0.00 0.00 41.96 40.74 2g2n s TYR 62 CO 0.18 -0.34 0.16 0.50 -1.57 0.00 0.00 175.55 174.48 2g2n s ARG 63 N -4.00 0.04 -0.13 -0.62 3.52 -0.32 -1.42 118.95 116.03 2g2n s ARG 63 Ca 0.31 0.55 -0.07 0.00 -0.13 0.00 0.00 55.73 56.39 2g2n s ARG 63 Cb 0.07 -0.25 -0.04 0.00 -1.56 0.00 0.00 34.95 33.17 2g2n s ARG 63 CO 0.08 -0.29 0.13 0.14 -0.81 0.00 0.00 175.30 174.55 2g2n s VAL 64 N 2.18 5.41 -0.20 7.11 -7.23 -0.51 -0.15 120.40 127.01 2g2n s VAL 64 Ca 0.02 0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.37 2g2n s VAL 64 Cb -0.12 -3.37 0.04 0.00 0.56 0.00 0.00 36.38 33.50 2g2n s VAL 64 CO -0.06 0.60 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.53 2g2n s VAL 65 N -0.85 1.66 -0.24 1.32 1.01 -0.46 -0.44 120.40 122.40 2g2n s VAL 65 Ca 0.14 -1.01 -0.23 0.00 0.00 0.00 0.00 61.98 60.88 2g2n s VAL 65 Cb -0.12 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 2g2n s VAL 65 CO 0.03 0.18 0.75 -0.36 0.00 0.00 0.00 175.10 175.70 2g2n s PHE 66 N 1.39 3.31 -1.43 5.22 0.08 0.02 -1.59 117.98 124.98 2g2n s PHE 66 Ca -0.01 1.02 -0.10 0.00 0.12 0.00 0.00 56.93 57.96 2g2n s PHE 66 Cb -0.16 -2.96 0.05 0.00 -0.57 0.00 0.00 43.02 39.38 2g2n s PHE 66 CO -0.08 -0.36 2.35 1.63 -0.10 0.00 0.00 175.22 178.66 2g2n n LYS 67 N 5.83 3.56 0.12 0.44 4.76 0.09 -0.96 118.16 131.99 2g2n n LYS 67 Ca 0.03 -2.89 0.05 0.00 -2.87 0.00 0.00 58.31 52.63 2g2n n LYS 67 Cb 0.48 -2.96 0.02 0.00 -1.84 0.00 0.00 35.03 30.73 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 3.45 0.48 -0.44 -0.18 1.35 -1.85 -2.93 112.91 112.79 2g2n h THR 68 Ca 0.62 -1.76 0.02 0.00 -0.55 0.00 0.00 66.41 64.74 2g2n h THR 68 Cb 0.49 2.10 -0.03 0.00 -1.73 0.00 0.00 68.15 68.99 2g2n h THR 68 CO 1.73 0.27 0.27 1.23 -0.25 0.00 0.00 175.52 178.78 2g2n h GLY 69 N 3.72 0.62 1.21 5.82 0.00 -1.57 -1.22 103.07 111.65 2g2n h GLY 69 Ca -0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 2g2n h GLY 69 CO 0.04 0.19 0.06 -0.55 0.00 0.00 0.00 176.54 176.28 2g2n h ASP 70 N 0.55 0.93 -0.19 0.19 3.32 -1.72 -0.97 116.42 118.53 2g2n h ASP 70 Ca 0.17 -0.22 0.02 0.00 0.02 0.00 0.00 57.03 57.02 2g2n h ASP 70 Cb -0.01 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 2g2n h ASP 70 CO -0.07 0.95 0.05 0.22 -1.72 0.00 0.00 179.24 178.67 2g2n h TYR 71 N 0.91 0.08 -0.37 4.55 3.20 -1.27 -2.11 116.97 121.96 2g2n h TYR 71 Ca 0.18 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.93 2g2n h TYR 71 Cb 0.44 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 2g2n h TYR 71 CO 0.03 0.04 -0.30 0.74 -1.64 0.00 0.00 178.16 177.03 2g2n h PHE 72 N 0.13 0.92 -0.08 -3.82 0.04 -1.08 -3.16 116.94 109.89 2g2n h PHE 72 Ca 0.08 -0.24 -0.08 0.00 2.80 0.00 0.00 57.97 60.54 2g2n h PHE 72 Cb 0.07 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.00 2g2n h PHE 72 CO -0.13 0.99 -0.29 -0.22 -0.60 0.00 0.00 178.31 178.06 2g2n h LYS 73 N 0.67 0.15 -0.02 1.51 3.64 -0.95 -0.50 116.57 121.07 2g2n h LYS 73 Ca 0.08 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 2g2n h LYS 73 Cb 0.83 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 2g2n h LYS 73 CO 0.07 0.44 -0.20 0.87 -2.27 0.00 0.00 179.45 178.36 2g2n h LYS 74 N 0.14 0.03 -0.48 1.90 1.57 -1.35 -1.63 116.57 116.75 2g2n h LYS 74 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2g2n h LYS 74 Cb 0.60 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 2g2n h LYS 74 CO 0.04 0.24 0.00 1.04 -0.57 0.00 0.00 179.45 180.20 2g2n n GLN 75 N -4.28 2.16 -3.57 3.15 6.02 -0.33 -4.94 117.38 115.58 2g2n n GLN 75 Ca -0.02 -1.66 -0.26 0.00 -0.01 0.00 0.00 57.00 55.05 2g2n n GLN 75 Cb 0.27 -1.40 0.05 0.00 1.02 0.00 0.00 30.24 30.18 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 0.80 -5.77 -4.33 1.08 3.02 -0.61 -4.99 115.26 104.45 2g2n n ASN 76 Ca 0.15 -0.55 -0.33 0.00 -0.03 0.00 0.00 54.58 53.82 2g2n n ASN 76 Cb 0.42 -4.58 -0.15 0.00 -0.61 0.00 0.00 39.78 34.86 2g2n n ASN 76 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2g2n s LEU 77 N -7.15 2.57 0.36 3.41 1.43 -0.42 -5.01 118.68 113.86 2g2n s LEU 77 Ca 0.55 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 53.00 2g2n s LEU 77 Cb -0.26 -1.56 -0.09 0.00 0.03 0.00 0.00 46.19 44.31 2g2n s LEU 77 CO 0.68 0.16 1.13 -1.61 0.23 0.00 0.00 176.35 176.95 2g2n s GLU 78 N 0.35 4.28 0.03 1.70 2.02 -1.26 -3.63 118.70 122.20 2g2n s GLU 78 Ca -0.13 1.79 0.04 0.00 0.02 0.00 0.00 54.97 56.69 2g2n s GLU 78 Cb -0.16 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.21 2g2n s GLU 78 CO 0.06 -0.11 -0.13 0.45 0.02 0.00 0.00 175.26 175.56 2g2n s SER 79 N -1.10 1.51 0.38 -0.19 0.15 -1.26 -4.83 113.70 108.36 2g2n s SER 79 Ca 0.53 -0.43 0.14 0.00 0.70 0.00 0.00 55.95 56.89 2g2n s SER 79 Cb -0.30 -0.09 0.75 0.00 -1.71 0.00 0.00 66.02 64.67 2g2n s SER 79 CO 0.38 0.02 1.82 0.15 1.20 0.00 0.00 173.24 176.81 2g2n h PHE 80 N 5.02 0.00 -3.54 3.44 3.57 -1.75 -3.42 116.94 120.25 2g2n h PHE 80 Ca -0.37 0.00 -0.65 0.00 3.53 0.00 0.00 57.97 60.48 2g2n h PHE 80 Cb 1.18 0.00 -0.24 0.00 2.79 0.00 0.00 35.95 39.68 2g2n h PHE 80 CO 0.53 0.37 -0.66 -0.06 -2.23 0.00 0.00 178.31 176.25 2g2n s PHE 81 N -4.08 3.03 0.36 0.41 0.08 -1.26 -4.98 117.98 111.54 2g2n s PHE 81 Ca -0.02 -0.62 0.07 0.00 0.12 0.00 0.00 56.93 56.48 2g2n s PHE 81 Cb 0.14 -2.18 0.70 0.00 -0.57 0.00 0.00 43.02 41.11 2g2n s PHE 81 CO 0.71 -0.42 1.90 -1.00 -0.10 0.00 0.00 175.22 176.31 2g2n h PRO 82 N 8.15 0.39 -2.94 0.24 0.13 -1.97 -3.32 132.00 132.67 2g2n h PRO 82 Ca -0.39 -0.08 0.07 0.00 -0.87 0.00 0.00 66.00 64.72 2g2n h PRO 82 Cb 1.17 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2g2n h PRO 82 CO 0.59 0.46 0.26 -1.83 -0.23 0.00 0.00 178.00 177.25 2g2n s GLU 83 N -4.88 1.81 -0.33 0.86 -1.05 -1.26 -2.32 118.70 111.52 2g2n s GLU 83 Ca -0.07 -1.03 0.03 0.00 -0.15 0.00 0.00 54.97 53.75 2g2n s GLU 83 Cb 0.16 0.59 0.10 0.00 -0.44 0.00 0.00 34.13 34.54 2g2n s GLU 83 CO 0.75 -0.83 0.06 0.42 0.95 0.00 0.00 175.26 176.61 2g2n s ILE 84 N -3.58 1.88 0.22 1.83 1.01 -0.14 -4.94 121.20 117.48 2g2n s ILE 84 Ca 0.12 -2.06 -0.30 0.00 0.00 0.00 0.00 60.65 58.41 2g2n s ILE 84 Cb -0.05 -2.39 -0.08 0.00 0.01 0.00 0.00 42.46 39.94 2g2n s ILE 84 CO 0.07 -0.61 0.95 -2.16 0.00 0.00 0.00 174.94 173.19 2g2n s PRO 85 N 1.11 4.82 -0.11 2.79 0.04 -1.26 -0.80 135.00 141.59 2g2n s PRO 85 Ca 0.10 1.49 -0.01 0.00 0.04 0.00 0.00 61.00 62.63 2g2n s PRO 85 Cb -0.19 -3.30 0.03 0.00 0.04 0.00 0.00 34.50 31.09 2g2n s PRO 85 CO -0.13 0.45 -0.04 0.08 0.04 0.00 0.00 177.00 177.40 2g2n s VAL 86 N -0.94 0.75 -0.08 -0.36 1.01 0.42 -4.99 120.40 116.21 2g2n s VAL 86 Ca 0.42 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2g2n s VAL 86 Cb -0.26 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 2g2n s VAL 86 CO 0.32 0.25 0.27 -1.61 0.00 0.00 0.00 175.10 174.33 2g2n s GLU 87 N 1.81 3.74 0.05 2.72 2.02 -1.26 -1.43 118.70 126.35 2g2n s GLU 87 Ca 0.04 0.11 -0.11 0.00 0.02 0.00 0.00 54.97 55.04 2g2n s GLU 87 Cb -0.13 -3.23 0.01 0.00 0.10 0.00 0.00 34.13 30.87 2g2n s GLU 87 CO -0.07 0.68 0.23 -0.59 0.02 0.00 0.00 175.26 175.52 2g2n s PHE 88 N -0.86 0.02 0.04 1.61 -0.12 -0.51 -5.00 117.98 113.16 2g2n s PHE 88 Ca 0.19 -0.24 -0.23 0.00 -0.05 0.00 0.00 56.93 56.59 2g2n s PHE 88 Cb -0.14 0.01 -0.06 0.00 -0.63 0.00 0.00 43.02 42.20 2g2n s PHE 88 CO 0.08 -0.47 0.69 -1.01 -0.05 0.00 0.00 175.22 174.46 2g2n s HIS 89 N -2.75 3.74 -0.41 3.49 3.76 -1.26 -1.30 115.29 120.56 2g2n s HIS 89 Ca -0.04 1.38 -0.04 0.00 -0.15 0.00 0.00 55.06 56.21 2g2n s HIS 89 Cb -0.00 -2.71 0.11 0.00 1.11 0.00 0.00 32.58 31.08 2g2n s HIS 89 CO -0.05 0.36 0.22 0.42 -0.85 0.00 0.00 174.74 174.84 2g2n s ILE 90 N -0.32 3.49 0.01 0.60 1.01 -0.06 -4.94 121.20 120.99 2g2n s ILE 90 Ca 0.35 -1.94 0.11 0.00 0.00 0.00 0.00 60.65 59.17 2g2n s ILE 90 Cb -0.20 -3.34 -0.20 0.00 0.01 0.00 0.00 42.46 38.73 2g2n s ILE 90 CO 0.21 -0.67 0.96 0.78 0.00 0.00 0.00 174.94 176.22 2g2n h ASN 91 N 8.14 0.00 -3.43 3.58 -0.26 -1.94 -1.87 115.58 119.80 2g2n h ASN 91 Ca -0.15 0.00 -0.58 0.00 -0.56 0.00 0.00 56.30 55.00 2g2n h ASN 91 Cb 1.05 0.00 -0.38 0.00 -1.06 0.00 0.00 38.32 37.94 2g2n h ASN 91 CO 0.72 0.95 -0.79 -0.54 -1.06 0.00 0.00 177.43 176.70 2g2n s LYS 92 N -2.68 1.62 0.52 0.81 3.01 -1.26 -4.88 119.74 116.87 2g2n s LYS 92 Ca -0.02 -0.73 0.32 0.00 -1.01 0.00 0.00 55.97 54.54 2g2n s LYS 92 Cb 0.09 -2.28 1.26 0.00 -1.01 0.00 0.00 37.83 35.88 2g2n s LYS 92 CO 0.82 -0.48 1.94 -0.39 0.51 0.00 0.00 175.35 177.74 2g2n h VAL 93 N 6.46 0.00 -0.01 3.17 -1.51 -1.88 -3.19 116.25 119.29 2g2n h VAL 93 Ca -0.23 -0.53 0.00 0.00 -1.23 0.00 0.00 66.70 64.70 2g2n h VAL 93 Cb 1.10 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.78 2g2n h VAL 93 CO 0.42 0.00 -0.40 0.59 -1.23 0.00 0.00 177.57 176.95 2g2n n ASN 94 N -3.03 1.68 -4.95 4.19 4.13 -1.26 -4.67 115.26 111.35 2g2n n ASN 94 Ca 0.01 -1.34 -0.24 0.00 1.68 0.00 0.00 54.58 54.69 2g2n n ASN 94 Cb 0.32 0.51 0.05 0.00 -1.54 0.00 0.00 39.78 39.12 2g2n n ASN 94 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 2g2n s GLU 95 N -2.09 2.38 -0.00 3.52 -1.05 -1.21 -4.98 118.70 115.26 2g2n s GLU 95 Ca 0.14 -0.50 -0.16 0.00 -0.15 0.00 0.00 54.97 54.30 2g2n s GLU 95 Cb 0.14 -2.32 -0.06 0.00 -0.44 0.00 0.00 34.13 31.45 2g2n s GLU 95 CO 0.47 -0.97 0.46 -1.58 0.95 0.00 0.00 175.26 174.58 2g2n s HIS 96 N -3.01 3.71 -0.10 4.83 5.65 -1.26 -4.73 115.29 120.38 2g2n s HIS 96 Ca 0.59 1.05 0.03 0.00 0.25 0.00 0.00 55.06 56.97 2g2n s HIS 96 Cb -0.11 -2.39 0.01 0.00 -1.18 0.00 0.00 32.58 28.92 2g2n s HIS 96 CO 0.42 0.55 -0.20 0.71 -0.65 0.00 0.00 174.74 175.57 2g2n s TYR 97 N -0.80 2.26 -0.11 3.88 2.02 0.93 -5.01 117.35 120.52 2g2n s TYR 97 Ca 0.25 -0.99 -0.00 0.00 -0.37 0.00 0.00 57.07 55.96 2g2n s TYR 97 Cb -0.17 -1.56 0.02 0.00 -0.40 0.00 0.00 41.96 39.86 2g2n s TYR 97 CO 0.14 -0.45 -0.08 -1.58 -1.57 0.00 0.00 175.55 172.02 2g2n s HIS 98 N 0.63 1.49 -0.47 2.71 5.65 -1.26 -1.04 115.29 123.00 2g2n s HIS 98 Ca -0.13 -0.73 0.03 0.00 0.25 0.00 0.00 55.06 54.47 2g2n s HIS 98 Cb -0.16 -1.22 0.14 0.00 -1.18 0.00 0.00 32.58 30.16 2g2n s HIS 98 CO 0.04 -0.50 0.28 0.08 -0.65 0.00 0.00 174.74 173.99 2g2n s VAL 99 N 1.61 1.45 0.66 0.89 1.01 -0.42 -0.35 120.40 125.25 2g2n s VAL 99 Ca 0.03 -2.78 -0.12 0.00 0.00 0.00 0.00 61.98 59.12 2g2n s VAL 99 Cb -0.13 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 2g2n s VAL 99 CO -0.07 -0.95 1.05 -2.84 0.00 0.00 0.00 175.10 172.29 2g2n s PRO 100 N 0.09 3.15 -0.08 2.72 0.02 -1.24 -3.73 135.00 135.93 2g2n s PRO 100 Ca 0.20 0.95 0.00 0.00 0.02 0.00 0.00 61.00 62.18 2g2n s PRO 100 Cb -0.18 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.34 2g2n s PRO 100 CO -0.04 -0.93 -0.07 -1.17 -0.33 0.00 0.00 177.00 174.46 2g2n s LEU 101 N -5.28 1.22 -0.28 -5.54 2.96 -0.12 -3.69 118.68 107.95 2g2n s LEU 101 Ca 0.58 -0.23 -0.15 0.00 -0.22 0.00 0.00 54.13 54.11 2g2n s LEU 101 Cb -0.14 -0.69 -0.03 0.00 0.50 0.00 0.00 46.19 45.83 2g2n s LEU 101 CO 0.51 -0.08 0.38 -0.76 -1.32 0.00 0.00 176.35 175.08 2g2n s LEU 102 N 1.36 4.10 -0.11 -0.68 1.43 -0.13 -1.24 118.68 123.42 2g2n s LEU 102 Ca -0.03 0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2g2n s LEU 102 Cb -0.14 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2g2n s LEU 102 CO -0.03 -0.22 -0.23 -0.22 0.23 0.00 0.00 176.35 175.88 2g2n s LEU 103 N 2.08 2.07 0.24 1.79 2.96 -0.07 -1.40 118.68 126.34 2g2n s LEU 103 Ca 0.15 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 53.55 2g2n s LEU 103 Cb -0.16 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.09 2g2n s LEU 103 CO 0.10 0.14 -0.02 -0.44 -1.32 0.00 0.00 176.35 174.81 2g2n s SER 104 N 0.45 2.02 0.38 3.68 0.01 -0.20 -0.67 113.70 119.37 2g2n s SER 104 Ca -0.16 -1.20 0.12 0.00 1.31 0.00 0.00 55.95 56.01 2g2n s SER 104 Cb -0.17 -0.03 0.91 0.00 0.21 0.00 0.00 66.02 66.94 2g2n s SER 104 CO 0.07 -0.47 1.89 1.56 0.41 0.00 0.00 173.24 176.70 2g2n h GLN 105 N 2.45 0.56 0.00 12.44 4.20 -2.00 -3.25 115.11 129.52 2g2n h GLN 105 Ca -0.39 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.29 2g2n h GLN 105 Cb 1.22 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.86 2g2n h GLN 105 CO 0.65 0.37 -0.24 0.66 -0.67 0.00 0.00 178.83 179.60 2g2n n TYR 106 N -4.53 0.00 -3.55 2.96 4.01 -1.26 -1.90 117.16 112.89 2g2n n TYR 106 Ca 0.16 -0.63 -0.10 0.00 -0.16 0.00 0.00 57.90 57.18 2g2n n TYR 106 Cb 0.50 -0.12 -0.04 0.00 -0.31 0.00 0.00 39.34 39.37 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 -2.15 -0.36 0.22 2.72 0.00 -1.23 -4.98 107.32 101.54 2g2n s GLY 107 Ca 0.20 1.61 -0.17 0.00 0.00 0.00 0.00 44.72 46.36 2g2n s GLY 107 CO 0.01 0.76 0.54 -2.52 0.00 0.00 0.00 173.10 171.89 2g2n s TYR 108 N -1.87 -0.04 0.03 1.90 -0.85 -1.26 -1.03 117.35 114.22 2g2n s TYR 108 Ca 0.00 -0.32 0.02 0.00 -0.52 0.00 0.00 57.07 56.25 2g2n s TYR 108 Cb -0.01 0.40 -0.02 0.00 0.38 0.00 0.00 41.96 42.72 2g2n s TYR 108 CO -0.02 -0.98 -0.07 -1.12 -1.52 0.00 0.00 175.55 171.84 2g2n s SER 109 N -2.91 0.80 0.10 -0.18 0.01 -0.49 -4.99 113.70 106.04 2g2n s SER 109 Ca 0.12 -0.41 -0.05 0.00 1.31 0.00 0.00 55.95 56.92 2g2n s SER 109 Cb -0.02 0.00 -0.02 0.00 0.21 0.00 0.00 66.02 66.19 2g2n s SER 109 CO 0.01 -0.12 0.11 0.28 0.41 0.00 0.00 173.24 173.93 2g2n s THR 110 N -0.99 0.15 -0.01 1.44 -1.32 -1.26 -0.95 115.64 112.69 2g2n s THR 110 Ca -0.06 -1.56 -0.30 0.00 -1.21 0.00 0.00 61.69 58.57 2g2n s THR 110 Cb -0.08 -1.62 0.10 0.00 -1.51 0.00 0.00 72.50 69.40 2g2n s THR 110 CO 0.00 -0.67 1.03 -0.72 -2.21 0.00 0.00 174.62 172.06 2g2n s TYR 111 N -3.93 -0.21 -0.25 9.09 -0.85 -1.24 -5.06 117.35 114.90 2g2n s TYR 111 Ca 0.11 0.06 -0.29 0.00 -0.52 0.00 0.00 57.07 56.43 2g2n s TYR 111 Cb 0.06 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.96 2g2n s TYR 111 CO -0.06 -0.50 1.20 0.50 -1.52 0.00 0.00 175.55 175.17 2g2n s ARG 112 N -2.91 4.11 0.91 -3.49 3.52 -1.26 -3.66 118.95 116.16 2g2n s ARG 112 Ca 0.09 1.36 -0.14 0.00 -0.13 0.00 0.00 55.73 56.91 2g2n s ARG 112 Cb -0.00 -3.77 0.16 0.00 -1.56 0.00 0.00 34.95 29.78 2g2n s ARG 112 CO -0.05 -0.86 1.26 0.20 -0.81 0.00 0.00 175.30 175.05 2g2n s GLY 113 N 2.02 1.73 0.00 8.12 0.00 0.52 -5.02 107.32 114.70 2g2n s GLY 113 Ca 0.51 -1.09 0.28 0.00 0.00 0.00 0.00 44.72 44.42 2g2n s GLY 113 CO 0.16 -0.41 1.75 -1.14 0.00 0.00 0.00 173.10 173.46