#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g2p s ASN 4 N 0.00 6.95 0.33 1.69 2.47 -1.26 -4.82 114.94 120.30 2g2p s ASN 4 Ca 0.00 1.59 0.10 0.00 0.42 0.00 0.00 52.86 54.97 2g2p s ASN 4 Cb 0.00 -2.50 0.86 0.00 -1.45 0.00 0.00 41.25 38.16 2g2p s ASN 4 CO 0.00 -0.27 1.78 -0.29 -3.72 0.00 0.00 177.10 174.60 2g2p h ILE 5 N 2.04 0.65 -3.08 -5.21 2.10 -1.89 -3.35 117.51 108.77 2g2p h ILE 5 Ca -0.48 -0.22 -0.36 0.00 1.08 0.00 0.00 64.86 64.88 2g2p h ILE 5 Cb 1.18 -0.05 -0.38 0.00 -1.09 0.00 0.00 36.82 36.48 2g2p h ILE 5 CO 0.63 0.12 -0.69 -0.22 -1.08 0.00 0.00 178.15 176.90 2g2p s LEU 6 N -10.11 0.08 0.06 2.19 2.96 -1.25 0.13 118.68 112.74 2g2p s LEU 6 Ca -0.10 -0.03 0.08 0.00 -0.22 0.00 0.00 54.13 53.86 2g2p s LEU 6 Cb 0.25 0.05 -0.03 0.00 0.50 0.00 0.00 46.19 46.96 2g2p s LEU 6 CO 0.80 -0.28 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.88 2g2p s SER 7 N 2.23 2.71 0.08 3.68 0.01 -0.51 -0.77 113.70 121.13 2g2p s SER 7 Ca 0.04 -0.57 0.03 0.00 1.31 0.00 0.00 55.95 56.76 2g2p s SER 7 Cb -0.13 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 2g2p s SER 7 CO -0.06 0.17 -0.10 0.68 0.41 0.00 0.00 173.24 174.34 2g2p s VAL 8 N -0.86 0.85 0.14 3.43 -7.23 -0.53 -1.20 120.40 115.00 2g2p s VAL 8 Ca 0.09 -1.44 -0.07 0.00 -1.81 0.00 0.00 61.98 58.74 2g2p s VAL 8 Cb -0.09 -1.12 -0.01 0.00 0.56 0.00 0.00 36.38 35.71 2g2p s VAL 8 CO 0.02 -0.47 0.22 -1.38 -0.31 0.00 0.00 175.10 173.18 2g2p s HIS 9 N -2.00 0.42 -0.05 2.82 -3.43 -1.24 -0.41 115.29 111.40 2g2p s HIS 9 Ca 0.00 -0.81 0.03 0.00 -0.80 0.00 0.00 55.06 53.48 2g2p s HIS 9 Cb -0.06 -0.14 0.01 0.00 -1.43 0.00 0.00 32.58 30.97 2g2p s HIS 9 CO 0.00 -0.64 -0.12 0.42 -2.00 0.00 0.00 174.74 172.40 2g2p s ILE 10 N -3.96 1.10 -0.15 -5.38 1.01 0.21 -0.51 121.20 113.53 2g2p s ILE 10 Ca 0.15 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.31 2g2p s ILE 10 Cb 0.04 -0.98 -0.00 0.00 0.01 0.00 0.00 42.46 41.53 2g2p s ILE 10 CO -0.02 0.34 -0.15 -0.22 0.00 0.00 0.00 174.94 174.88 2g2p s LEU 11 N 0.40 2.50 -0.60 2.97 2.96 0.15 -2.40 118.68 124.68 2g2p s LEU 11 Ca -0.09 -0.44 -0.28 0.00 -0.22 0.00 0.00 54.13 53.10 2g2p s LEU 11 Cb -0.13 -1.56 0.03 0.00 0.50 0.00 0.00 46.19 45.03 2g2p s LEU 11 CO 0.02 0.11 1.19 0.21 -1.32 0.00 0.00 176.35 176.56 2g2p s ASN 12 N 0.68 6.41 0.00 3.68 3.84 -0.43 -0.75 114.94 128.36 2g2p s ASN 12 Ca -0.08 0.02 0.14 0.00 0.21 0.00 0.00 52.86 53.15 2g2p s ASN 12 Cb -0.16 -2.55 0.71 0.00 -0.55 0.00 0.00 41.25 38.70 2g2p s ASN 12 CO 0.02 -1.51 1.40 0.00 -2.79 0.00 0.00 177.10 174.22 2g2p n GLN 13 N 8.50 0.17 0.00 0.43 6.02 -0.09 -0.57 117.38 131.84 2g2p n GLN 13 Ca 0.07 0.17 -0.05 0.00 -0.01 0.00 0.00 57.00 57.18 2g2p n GLN 13 Cb 0.49 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.13 2g2p n GLN 13 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2g2p n GLN 14 N -1.32 0.63 -0.00 -1.09 6.02 -1.26 -4.28 117.38 116.08 2g2p n GLN 14 Ca 0.06 0.27 0.07 0.00 -0.01 0.00 0.00 57.00 57.39 2g2p n GLN 14 Cb 0.12 -1.81 -0.10 0.00 1.02 0.00 0.00 30.24 29.47 2g2p n GLN 14 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2g2p n THR 15 N -2.98 0.00 -2.00 5.09 -2.24 -1.12 -4.99 114.28 106.04 2g2p n THR 15 Ca -0.13 -0.29 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 2g2p n THR 15 Cb 0.96 0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 2g2p n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g2p n GLY 16 N 1.58 0.48 3.25 3.38 0.00 0.26 -5.00 105.19 109.14 2g2p n GLY 16 Ca -0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2g2p n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g2p s LYS 17 N -4.31 1.05 0.54 1.61 -0.14 -1.17 -4.97 119.74 112.35 2g2p s LYS 17 Ca 0.00 -1.43 -0.21 0.00 -1.36 0.00 0.00 55.97 52.98 2g2p s LYS 17 Cb 0.00 -0.63 -0.05 0.00 -1.68 0.00 0.00 37.83 35.47 2g2p s LYS 17 CO 0.00 0.08 1.23 -2.14 -0.76 0.00 0.00 175.35 173.76 2g2p s PRO 18 N -3.66 3.23 -0.39 -1.68 0.02 -1.26 -1.32 135.00 129.95 2g2p s PRO 18 Ca 0.16 1.91 -0.20 0.00 0.02 0.00 0.00 61.00 62.89 2g2p s PRO 18 Cb 0.02 -2.14 0.01 0.00 0.02 0.00 0.00 34.50 32.41 2g2p s PRO 18 CO 0.01 -1.02 0.60 0.00 -0.33 0.00 0.00 177.00 176.26 2g2p s ALA 19 N -1.51 3.41 0.07 -1.55 0.00 -1.01 -4.69 121.76 116.48 2g2p s ALA 19 Ca 0.72 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.62 2g2p s ALA 19 Cb -0.32 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2g2p s ALA 19 CO 0.37 -1.51 0.18 0.00 0.00 0.00 0.00 175.76 174.79 2g2p s ALA 20 N 2.65 3.88 -1.34 0.00 0.00 -1.26 -4.06 121.76 121.62 2g2p s ALA 20 Ca 0.22 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 2g2p s ALA 20 Cb -0.15 -1.71 0.00 0.00 0.00 0.00 0.00 23.12 21.27 2g2p s ALA 20 CO 0.16 0.79 0.58 -3.47 0.00 0.00 0.00 175.76 173.82 2g2p n ASP 21 N 0.30 -5.58 -4.63 0.00 2.03 -0.39 -4.97 116.55 103.32 2g2p n ASP 21 Ca -0.06 -0.27 -0.38 0.00 0.52 0.00 0.00 54.79 54.60 2g2p n ASP 21 Cb 0.51 -4.39 -0.09 0.00 -0.72 0.00 0.00 41.12 36.43 2g2p n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2g2p s VAL 22 N -3.11 5.27 0.19 5.18 1.01 -1.26 -4.83 120.40 122.84 2g2p s VAL 22 Ca 0.29 0.38 -0.31 0.00 0.00 0.00 0.00 61.98 62.34 2g2p s VAL 22 Cb -0.13 -3.60 -0.10 0.00 0.00 0.00 0.00 36.38 32.56 2g2p s VAL 22 CO 0.35 0.25 1.48 -0.89 0.00 0.00 0.00 175.10 176.29 2g2p s THR 23 N 1.56 2.79 -0.08 3.92 2.01 -1.26 -2.13 115.64 122.45 2g2p s THR 23 Ca 0.11 0.60 0.01 0.00 0.31 0.00 0.00 61.69 62.72 2g2p s THR 23 Cb -0.15 -3.39 0.02 0.00 0.01 0.00 0.00 72.50 69.00 2g2p s THR 23 CO 0.08 0.07 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.31 2g2p s VAL 24 N 0.68 0.88 0.21 3.82 1.01 0.11 -1.05 120.40 126.06 2g2p s VAL 24 Ca 0.65 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.41 2g2p s VAL 24 Cb -0.41 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 2g2p s VAL 24 CO 0.36 0.32 0.29 0.42 0.00 0.00 0.00 175.10 176.49 2g2p s THR 25 N 1.26 5.07 -0.06 3.92 -4.23 -0.79 -1.29 115.64 119.53 2g2p s THR 25 Ca -0.04 -0.97 0.04 0.00 -1.18 0.00 0.00 61.69 59.53 2g2p s THR 25 Cb -0.14 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2g2p s THR 25 CO -0.03 -0.24 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.43 2g2p s LEU 26 N -3.65 1.86 0.06 4.79 2.96 0.20 -1.54 118.68 123.36 2g2p s LEU 26 Ca 0.34 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 53.91 2g2p s LEU 26 Cb -0.10 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 2g2p s LEU 26 CO 0.28 0.12 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.73 2g2p s GLU 27 N 0.26 0.62 -0.03 1.98 2.02 0.04 -0.57 118.70 123.03 2g2p s GLU 27 Ca -0.09 -0.90 0.03 0.00 0.02 0.00 0.00 54.97 54.03 2g2p s GLU 27 Cb -0.13 -0.33 -0.03 0.00 0.10 0.00 0.00 34.13 33.74 2g2p s GLU 27 CO 0.03 0.05 -0.09 0.21 0.02 0.00 0.00 175.26 175.49 2g2p s LYS 28 N -2.08 2.58 -1.07 1.61 2.20 -0.56 -0.63 119.74 121.78 2g2p s LYS 28 Ca -0.04 -0.68 -0.22 0.00 -0.36 0.00 0.00 55.97 54.67 2g2p s LYS 28 Cb -0.07 -2.49 0.03 0.00 -1.51 0.00 0.00 37.83 33.79 2g2p s LYS 28 CO -0.00 0.62 1.63 0.21 -0.36 0.00 0.00 175.35 177.45 2g2p s LYS 29 N -1.11 3.42 0.68 4.03 2.20 -0.06 -1.07 119.74 127.84 2g2p s LYS 29 Ca 0.15 -1.17 -0.08 0.00 -0.36 0.00 0.00 55.97 54.51 2g2p s LYS 29 Cb -0.11 -5.34 0.04 0.00 -1.51 0.00 0.00 37.83 30.91 2g2p s LYS 29 CO 0.04 -2.54 1.01 0.00 -0.36 0.00 0.00 175.35 173.50 2g2p s ALA 30 N 6.10 3.11 0.28 3.13 0.00 -0.73 -4.75 121.76 128.90 2g2p s ALA 30 Ca 0.53 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.74 2g2p s ALA 30 Cb -0.00 -2.69 0.54 0.00 0.00 0.00 0.00 23.12 20.96 2g2p s ALA 30 CO -0.03 -1.18 1.83 -0.44 0.00 0.00 0.00 175.76 175.94 2g2p h ASP 31 N -0.53 0.87 -0.25 0.00 3.32 -2.01 -2.62 116.42 115.19 2g2p h ASP 31 Ca -0.45 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2g2p h ASP 31 Cb 1.29 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2g2p h ASP 31 CO 0.61 0.45 0.00 0.59 -1.72 0.00 0.00 179.24 179.18 2g2p n ASN 32 N -4.66 1.56 0.00 6.45 5.03 -1.26 -5.01 115.26 117.37 2g2p n ASN 32 Ca 0.18 -2.04 0.00 0.00 0.87 0.00 0.00 54.58 53.59 2g2p n ASN 32 Cb 0.36 -0.23 0.00 0.00 -1.02 0.00 0.00 39.78 38.89 2g2p n ASN 32 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2g2p n GLY 33 N 0.82 0.47 3.74 7.41 0.00 -0.99 -5.03 105.19 111.61 2g2p n GLY 33 Ca 0.09 -2.30 -0.41 0.00 0.00 0.00 0.00 46.02 43.40 2g2p n GLY 33 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2g2p s TRP 34 N -0.40 3.52 -0.16 1.61 0.52 -1.26 -1.76 118.94 121.01 2g2p s TRP 34 Ca 0.00 1.54 0.01 0.00 0.02 0.00 0.00 56.10 57.67 2g2p s TRP 34 Cb 0.00 -3.34 0.02 0.00 -1.15 0.00 0.00 33.47 29.00 2g2p s TRP 34 CO 0.00 -0.84 -0.16 -1.17 0.02 0.00 0.00 176.95 174.81 2g2p s LEU 35 N -0.47 1.81 0.15 2.99 2.96 -0.23 -4.92 118.68 120.97 2g2p s LEU 35 Ca 0.50 -0.53 -0.30 0.00 -0.22 0.00 0.00 54.13 53.58 2g2p s LEU 35 Cb -0.31 -1.26 -0.08 0.00 0.50 0.00 0.00 46.19 45.04 2g2p s LEU 35 CO 0.36 -0.04 1.24 -1.58 -1.32 0.00 0.00 176.35 175.02 2g2p s GLN 36 N 1.43 4.44 -0.16 1.98 0.74 -1.26 -1.50 119.66 125.33 2g2p s GLN 36 Ca 0.05 1.91 0.00 0.00 0.05 0.00 0.00 55.36 57.37 2g2p s GLN 36 Cb -0.13 -3.26 -0.10 0.00 1.10 0.00 0.00 33.01 30.62 2g2p s GLN 36 CO -0.11 -0.21 -0.15 1.28 -0.55 0.00 0.00 175.29 175.55 2g2p n LEU 37 N 3.08 2.81 -3.50 3.68 4.77 0.27 -4.94 117.00 123.16 2g2p n LEU 37 Ca 0.07 -0.06 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 2g2p n LEU 37 Cb 0.44 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 2g2p n LEU 37 CO 0.56 0.73 0.33 0.21 -1.33 0.00 0.00 177.39 177.89 2g2p s ASN 38 N -5.62 -0.49 0.02 -1.43 2.47 -1.11 -4.69 114.94 104.10 2g2p s ASN 38 Ca -0.21 0.05 0.01 0.00 0.42 0.00 0.00 52.86 53.13 2g2p s ASN 38 Cb 0.06 0.55 -0.02 0.00 -1.45 0.00 0.00 41.25 40.39 2g2p s ASN 38 CO 0.36 -0.86 -0.05 0.28 -3.72 0.00 0.00 177.10 173.11 2g2p s THR 39 N -3.21 0.32 0.19 -5.21 -1.32 -1.26 -0.62 115.64 104.53 2g2p s THR 39 Ca -0.01 -0.81 -0.23 0.00 -1.21 0.00 0.00 61.69 59.43 2g2p s THR 39 Cb -0.00 -0.40 0.06 0.00 -1.51 0.00 0.00 72.50 70.65 2g2p s THR 39 CO -0.08 -0.32 0.93 0.00 -2.21 0.00 0.00 174.62 172.94 2g2p s ALA 40 N -1.12 -1.52 -0.05 11.08 0.00 -0.41 -5.00 121.76 124.75 2g2p s ALA 40 Ca -0.10 -0.08 0.04 0.00 0.00 0.00 0.00 51.96 51.82 2g2p s ALA 40 Cb -0.08 0.69 -0.00 0.00 0.00 0.00 0.00 23.12 23.73 2g2p s ALA 40 CO -0.00 -1.04 -0.17 0.15 0.00 0.00 0.00 175.76 174.70 2g2p s LYS 41 N -3.09 1.79 0.32 0.00 1.02 -1.26 0.09 119.74 118.61 2g2p s LYS 41 Ca 0.14 -0.60 -0.29 0.00 0.02 0.00 0.00 55.97 55.24 2g2p s LYS 41 Cb -0.02 -1.55 -0.12 0.00 -0.52 0.00 0.00 37.83 35.62 2g2p s LYS 41 CO 0.04 0.23 1.55 0.25 -0.92 0.00 0.00 175.35 176.50 2g2p n THR 42 N 3.19 1.32 -0.46 2.17 -2.24 -0.91 -4.77 114.28 112.59 2g2p n THR 42 Ca -0.18 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2g2p n THR 42 Cb 0.53 -1.94 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 2g2p n THR 42 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2g2p n ASP 43 N 1.65 -0.56 0.19 3.42 5.68 -0.85 -1.26 116.55 124.82 2g2p n ASP 43 Ca 0.06 -0.46 0.18 0.00 -0.50 0.00 0.00 54.79 54.07 2g2p n ASP 43 Cb 0.37 0.00 0.82 0.00 -1.14 0.00 0.00 41.12 41.17 2g2p n ASP 43 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2g2p h LYS 44 N 0.00 0.00 -0.52 0.11 2.10 -1.95 -2.27 116.57 114.05 2g2p h LYS 44 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2g2p h LYS 44 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2g2p h LYS 44 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 2g2p n ASP 45 N -3.76 2.75 -1.47 7.07 8.00 -1.26 -4.69 116.55 123.18 2g2p n ASP 45 Ca 0.02 -2.11 -0.15 0.00 0.71 0.00 0.00 54.79 53.26 2g2p n ASP 45 Cb 0.36 -0.37 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 2g2p n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g2p n GLY 46 N 1.08 0.59 3.37 0.44 0.00 -0.85 -4.75 105.19 105.07 2g2p n GLY 46 Ca 0.16 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2g2p n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2g2p s ARG 47 N -4.07 2.07 -0.33 1.61 0.52 -1.26 -0.62 118.95 116.87 2g2p s ARG 47 Ca 0.00 -0.96 0.04 0.00 -0.52 0.00 0.00 55.73 54.29 2g2p s ARG 47 Cb 0.00 -2.09 0.10 0.00 0.52 0.00 0.00 34.95 33.48 2g2p s ARG 47 CO 0.00 0.55 0.05 0.42 0.02 0.00 0.00 175.30 176.34 2g2p s ILE 48 N -0.73 2.16 -0.17 1.52 1.01 0.45 -2.00 121.20 123.44 2g2p s ILE 48 Ca 0.11 -2.24 0.19 0.00 0.00 0.00 0.00 60.65 58.72 2g2p s ILE 48 Cb -0.10 -2.59 0.18 0.00 0.01 0.00 0.00 42.46 39.96 2g2p s ILE 48 CO 0.01 -0.58 1.57 0.11 0.00 0.00 0.00 174.94 176.05 2g2p h LYS 49 N 7.66 0.00 -3.50 2.79 1.57 -1.88 -1.40 116.57 121.81 2g2p h LYS 49 Ca -0.05 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.16 2g2p h LYS 49 Cb 1.02 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.93 2g2p h LYS 49 CO 0.51 0.30 -0.76 0.00 -0.57 0.00 0.00 179.45 178.93 2g2p s ALA 50 N -3.17 1.38 -0.61 3.86 0.00 -1.26 -4.38 121.76 117.57 2g2p s ALA 50 Ca 0.04 -1.46 0.22 0.00 0.00 0.00 0.00 51.96 50.76 2g2p s ALA 50 Cb 0.07 -1.53 -0.11 0.00 0.00 0.00 0.00 23.12 21.55 2g2p s ALA 50 CO 0.70 -1.58 0.88 -0.11 0.00 0.00 0.00 175.76 175.65 2g2p n LEU 51 N 4.91 0.60 -4.77 0.00 7.94 0.05 -4.93 117.00 120.80 2g2p n LEU 51 Ca -0.04 -0.16 -0.39 0.00 -1.11 0.00 0.00 56.01 54.31 2g2p n LEU 51 Cb 0.43 -0.05 -0.02 0.00 0.53 0.00 0.00 43.42 44.31 2g2p n LEU 51 CO 0.11 0.10 0.89 0.86 -1.11 0.00 0.00 177.39 178.24 2g2p s TRP 52 N -3.20 3.06 0.00 1.96 -0.11 -1.26 -4.77 118.94 114.62 2g2p s TRP 52 Ca 0.03 1.51 0.00 0.00 1.22 0.00 0.00 56.10 58.85 2g2p s TRP 52 Cb 0.15 -3.51 0.00 0.00 -1.50 0.00 0.00 33.47 28.61 2g2p s TRP 52 CO 0.84 -1.54 0.00 -0.35 -4.62 0.00 0.00 176.95 171.29 2g2p n PRO 53 N 0.38 -0.44 -0.54 5.86 -0.04 -1.26 -4.94 135.00 134.02 2g2p n PRO 53 Ca 0.03 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.40 2g2p n PRO 53 Cb 0.44 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.00 2g2p n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2g2p n GLU 54 N -1.11 1.74 -4.76 0.54 -0.58 -1.26 -4.90 120.64 110.31 2g2p n GLU 54 Ca 0.00 -1.37 -0.28 0.00 -0.42 0.00 0.00 57.16 55.09 2g2p n GLU 54 Cb 0.00 -1.58 -0.14 0.00 -0.57 0.00 0.00 31.44 29.15 2g2p n GLU 54 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2g2p s GLN 55 N -1.54 1.59 0.26 3.49 -2.07 -1.26 -5.11 119.66 115.03 2g2p s GLN 55 Ca 0.26 -1.04 -0.30 0.00 -1.82 0.00 0.00 55.36 52.45 2g2p s GLN 55 Cb 0.21 -1.76 -0.14 0.00 -1.09 0.00 0.00 33.01 30.24 2g2p s GLN 55 CO 0.05 0.45 1.23 2.41 -1.32 0.00 0.00 175.29 178.11 2g2p n THR 56 N 1.77 1.46 -3.00 3.63 -1.04 -1.26 -4.95 114.28 110.88 2g2p n THR 56 Ca -0.17 -0.37 -0.39 0.00 -2.04 0.00 0.00 64.05 61.08 2g2p n THR 56 Cb 0.53 -1.26 -0.06 0.00 -1.82 0.00 0.00 70.33 67.72 2g2p n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g2p s ALA 57 N -0.59 3.46 0.22 2.41 0.00 -1.26 -5.08 121.76 120.92 2g2p s ALA 57 Ca 0.64 0.34 0.08 0.00 0.00 0.00 0.00 51.96 53.02 2g2p s ALA 57 Cb -0.68 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 2g2p s ALA 57 CO 0.56 0.30 0.00 0.95 0.00 0.00 0.00 175.76 177.57 2g2p s THR 58 N -1.15 3.59 1.03 0.00 -4.23 -1.26 -4.92 115.64 108.70 2g2p s THR 58 Ca 0.35 -1.67 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 2g2p s THR 58 Cb -0.23 -2.86 0.17 0.00 1.34 0.00 0.00 72.50 70.91 2g2p s THR 58 CO 0.26 -0.25 0.85 0.35 -0.54 0.00 0.00 174.62 175.28 2g2p n THR 59 N -0.53 0.00 -0.03 3.99 -2.24 -1.26 -4.94 114.28 109.26 2g2p n THR 59 Ca -0.08 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2g2p n THR 59 Cb 0.57 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 2g2p n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g2p n GLY 60 N 0.91 0.94 3.88 3.38 0.00 -0.85 -4.99 105.19 108.46 2g2p n GLY 60 Ca 0.07 -1.92 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 2g2p n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2g2p s ASP 61 N -1.37 6.47 0.16 1.61 -0.00 -1.26 -1.04 116.67 121.23 2g2p s ASP 61 Ca 0.00 0.53 0.01 0.00 -0.00 0.00 0.00 52.55 53.09 2g2p s ASP 61 Cb 0.00 -2.09 -0.04 0.00 -0.00 0.00 0.00 42.92 40.79 2g2p s ASP 61 CO 0.00 0.34 0.03 -0.31 -0.00 0.00 0.00 175.17 175.23 2g2p s TYR 62 N -1.15 1.07 -0.16 4.23 2.02 -0.36 -0.88 117.35 122.12 2g2p s TYR 62 Ca 0.21 -1.12 -0.12 0.00 -0.37 0.00 0.00 57.07 55.67 2g2p s TYR 62 Cb -0.13 -0.61 0.05 0.00 -0.40 0.00 0.00 41.96 40.87 2g2p s TYR 62 CO 0.11 -0.35 0.40 -0.98 -1.57 0.00 0.00 175.55 173.15 2g2p s ARG 63 N -3.98 0.43 -0.07 -0.62 1.70 0.20 -1.37 118.95 115.24 2g2p s ARG 63 Ca 0.25 0.64 -0.06 0.00 -0.47 0.00 0.00 55.73 56.08 2g2p s ARG 63 Cb 0.07 0.12 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 2g2p s ARG 63 CO 0.03 -0.10 0.18 0.14 -1.08 0.00 0.00 175.30 174.48 2g2p s VAL 64 N 0.68 5.44 -0.23 4.99 -7.23 -0.63 -0.78 120.40 122.64 2g2p s VAL 64 Ca -0.04 0.13 0.01 0.00 -1.81 0.00 0.00 61.98 60.27 2g2p s VAL 64 Cb -0.05 -3.47 0.06 0.00 0.56 0.00 0.00 36.38 33.47 2g2p s VAL 64 CO -0.05 0.51 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.49 2g2p s VAL 65 N -1.15 1.64 -0.33 1.32 1.01 -0.59 -0.30 120.40 122.01 2g2p s VAL 65 Ca 0.20 -1.25 -0.26 0.00 0.00 0.00 0.00 61.98 60.68 2g2p s VAL 65 Cb -0.13 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.41 2g2p s VAL 65 CO 0.10 -0.05 0.90 -0.36 0.00 0.00 0.00 175.10 175.69 2g2p s PHE 66 N 1.35 3.15 -1.49 5.22 0.08 -0.56 -1.89 117.98 123.85 2g2p s PHE 66 Ca -0.06 0.90 -0.13 0.00 0.12 0.00 0.00 56.93 57.76 2g2p s PHE 66 Cb -0.19 -3.47 0.02 0.00 -0.57 0.00 0.00 43.02 38.81 2g2p s PHE 66 CO -0.06 -0.70 2.38 1.63 -0.10 0.00 0.00 175.22 178.37 2g2p n LYS 67 N 6.54 3.08 0.15 0.44 4.76 -0.22 -1.25 118.16 131.66 2g2p n LYS 67 Ca 0.07 -2.56 0.05 0.00 -2.87 0.00 0.00 58.31 53.00 2g2p n LYS 67 Cb 0.48 -3.16 0.05 0.00 -1.84 0.00 0.00 35.03 30.55 2g2p n LYS 67 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2g2p h THR 68 N 3.76 0.57 -0.24 -0.18 1.35 -1.85 -3.17 112.91 113.15 2g2p h THR 68 Ca 0.63 -1.84 0.01 0.00 -0.55 0.00 0.00 66.41 64.66 2g2p h THR 68 Cb 0.56 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 69.19 2g2p h THR 68 CO 1.85 0.33 0.12 1.23 -0.25 0.00 0.00 175.52 178.80 2g2p h GLY 69 N 3.67 0.32 0.54 5.82 0.00 -1.58 -1.28 103.07 110.56 2g2p h GLY 69 Ca -0.02 -0.09 0.09 0.00 0.00 0.00 0.00 47.33 47.31 2g2p h GLY 69 CO 0.04 0.08 0.44 -0.55 0.00 0.00 0.00 176.54 176.55 2g2p h ASP 70 N 0.26 0.63 -0.15 0.19 5.19 -1.74 -0.47 116.42 120.33 2g2p h ASP 70 Ca 0.10 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2g2p h ASP 70 Cb 0.02 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.45 2g2p h ASP 70 CO -0.06 0.37 0.10 0.22 -3.12 0.00 0.00 179.24 176.74 2g2p h TYR 71 N 0.76 0.20 -0.14 4.55 3.20 -1.39 -2.08 116.97 122.07 2g2p h TYR 71 Ca 0.38 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.12 2g2p h TYR 71 Cb 0.33 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2g2p h TYR 71 CO -0.07 0.15 -0.48 0.74 -1.64 0.00 0.00 178.16 176.85 2g2p h PHE 72 N 0.19 0.44 -0.11 -3.82 0.04 -1.13 -3.14 116.94 109.41 2g2p h PHE 72 Ca 0.06 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.63 2g2p h PHE 72 Cb -0.00 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.05 2g2p h PHE 72 CO -0.06 0.78 -0.17 -0.22 -0.60 0.00 0.00 178.31 178.04 2g2p h LYS 73 N 0.29 0.19 0.00 1.51 3.64 -0.69 -0.42 116.57 121.09 2g2p h LYS 73 Ca 0.02 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 2g2p h LYS 73 Cb 0.96 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 2g2p h LYS 73 CO 0.08 0.36 -0.23 0.87 -2.27 0.00 0.00 179.45 178.26 2g2p h LYS 74 N 0.17 0.00 -0.61 1.90 1.57 -1.34 -2.47 116.57 115.80 2g2p h LYS 74 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2g2p h LYS 74 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2g2p h LYS 74 CO 0.03 0.23 0.00 1.04 -0.57 0.00 0.00 179.45 180.18 2g2p n GLN 75 N -3.71 2.96 -3.58 3.15 6.02 -0.29 -4.93 117.38 117.00 2g2p n GLN 75 Ca -0.01 -2.07 -0.26 0.00 -0.01 0.00 0.00 57.00 54.64 2g2p n GLN 75 Cb 0.35 -1.71 -0.01 0.00 1.02 0.00 0.00 30.24 29.89 2g2p n GLN 75 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2g2p n ASN 76 N 0.78 -3.73 -4.48 1.08 5.03 -0.93 -4.99 115.26 108.02 2g2p n ASN 76 Ca 0.19 -0.55 -0.33 0.00 0.87 0.00 0.00 54.58 54.76 2g2p n ASN 76 Cb 0.67 -3.07 -0.13 0.00 -1.02 0.00 0.00 39.78 36.23 2g2p n ASN 76 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2g2p s LEU 77 N -6.71 2.90 0.52 3.41 1.43 -0.47 -5.02 118.68 114.74 2g2p s LEU 77 Ca 0.49 -0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 53.25 2g2p s LEU 77 Cb -0.26 -1.63 -0.07 0.00 0.03 0.00 0.00 46.19 44.26 2g2p s LEU 77 CO 0.61 0.29 0.99 -1.61 0.23 0.00 0.00 176.35 176.86 2g2p s GLU 78 N -0.37 3.89 -0.00 1.70 2.02 -1.26 -3.50 118.70 121.18 2g2p s GLU 78 Ca 0.04 0.98 -0.03 0.00 0.02 0.00 0.00 54.97 55.98 2g2p s GLU 78 Cb -0.12 -2.13 -0.00 0.00 0.10 0.00 0.00 34.13 31.98 2g2p s GLU 78 CO 0.02 -0.32 0.05 0.45 0.02 0.00 0.00 175.26 175.48 2g2p s SER 79 N -3.05 0.06 0.50 -0.19 0.15 -1.26 -4.83 113.70 105.08 2g2p s SER 79 Ca 0.59 -0.17 0.17 0.00 0.70 0.00 0.00 55.95 57.24 2g2p s SER 79 Cb -0.10 0.14 1.22 0.00 -1.71 0.00 0.00 66.02 65.57 2g2p s SER 79 CO 0.32 -0.20 2.07 0.15 1.20 0.00 0.00 173.24 176.78 2g2p h PHE 80 N 5.13 0.12 -3.44 3.44 3.57 -1.63 -3.42 116.94 120.71 2g2p h PHE 80 Ca -0.29 0.00 -0.64 0.00 3.53 0.00 0.00 57.97 60.57 2g2p h PHE 80 Cb 1.20 -0.04 -0.22 0.00 2.79 0.00 0.00 35.95 39.68 2g2p h PHE 80 CO 0.54 0.07 -0.65 -0.06 -2.23 0.00 0.00 178.31 175.98 2g2p s PHE 81 N -5.15 3.06 0.33 0.41 0.08 -1.26 -4.98 117.98 110.47 2g2p s PHE 81 Ca -0.06 -0.40 0.03 0.00 0.12 0.00 0.00 56.93 56.63 2g2p s PHE 81 Cb 0.18 -2.09 0.59 0.00 -0.57 0.00 0.00 43.02 41.12 2g2p s PHE 81 CO 0.70 -0.21 1.89 -1.00 -0.10 0.00 0.00 175.22 176.51 2g2p h PRO 82 N 7.45 0.61 -2.76 0.24 0.13 -1.97 -3.33 132.00 132.37 2g2p h PRO 82 Ca -0.36 -0.11 0.10 0.00 -0.87 0.00 0.00 66.00 64.76 2g2p h PRO 82 Cb 1.18 -0.10 -0.07 0.00 0.13 0.00 0.00 31.00 32.14 2g2p h PRO 82 CO 0.62 0.57 0.32 -1.83 -0.23 0.00 0.00 178.00 177.45 2g2p s GLU 83 N -5.11 1.52 -0.32 0.86 -1.05 -1.26 -2.34 118.70 111.01 2g2p s GLU 83 Ca -0.08 -0.82 0.01 0.00 -0.15 0.00 0.00 54.97 53.93 2g2p s GLU 83 Cb 0.16 0.53 0.10 0.00 -0.44 0.00 0.00 34.13 34.48 2g2p s GLU 83 CO 0.77 -0.69 0.07 0.42 0.95 0.00 0.00 175.26 176.78 2g2p s ILE 84 N -3.67 1.44 0.26 1.83 1.01 -0.38 -4.93 121.20 116.75 2g2p s ILE 84 Ca 0.10 -1.75 -0.28 0.00 0.00 0.00 0.00 60.65 58.73 2g2p s ILE 84 Cb -0.04 -2.06 -0.09 0.00 0.01 0.00 0.00 42.46 40.28 2g2p s ILE 84 CO 0.03 -0.62 0.92 -2.16 0.00 0.00 0.00 174.94 173.12 2g2p s PRO 85 N 1.34 4.74 -0.10 2.79 0.04 -1.26 -1.50 135.00 141.04 2g2p s PRO 85 Ca 0.09 1.40 -0.00 0.00 0.04 0.00 0.00 61.00 62.53 2g2p s PRO 85 Cb -0.18 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.26 2g2p s PRO 85 CO -0.18 0.45 -0.08 0.08 0.04 0.00 0.00 177.00 177.32 2g2p s VAL 86 N -1.32 0.99 -0.11 -0.36 1.01 0.59 -4.99 120.40 116.22 2g2p s VAL 86 Ca 0.43 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 62.06 2g2p s VAL 86 Cb -0.23 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2g2p s VAL 86 CO 0.29 0.36 0.14 -1.61 0.00 0.00 0.00 175.10 174.28 2g2p s GLU 87 N 1.58 3.43 0.14 2.72 2.02 -1.26 -1.60 118.70 125.73 2g2p s GLU 87 Ca 0.02 -0.15 -0.18 0.00 0.02 0.00 0.00 54.97 54.69 2g2p s GLU 87 Cb -0.13 -3.17 0.04 0.00 0.10 0.00 0.00 34.13 30.97 2g2p s GLU 87 CO -0.07 0.77 0.45 -0.59 0.02 0.00 0.00 175.26 175.85 2g2p s PHE 88 N -1.05 -0.26 -0.01 1.61 -0.12 -0.47 -5.00 117.98 112.68 2g2p s PHE 88 Ca 0.16 -0.04 -0.15 0.00 -0.05 0.00 0.00 56.93 56.85 2g2p s PHE 88 Cb -0.12 0.33 -0.06 0.00 -0.63 0.00 0.00 43.02 42.55 2g2p s PHE 88 CO 0.05 -0.76 0.41 -1.01 -0.05 0.00 0.00 175.22 173.86 2g2p s HIS 89 N -3.80 3.71 -0.41 3.49 3.76 -1.26 -1.23 115.29 119.56 2g2p s HIS 89 Ca 0.03 0.98 -0.07 0.00 -0.15 0.00 0.00 55.06 55.85 2g2p s HIS 89 Cb 0.01 -2.30 0.08 0.00 1.11 0.00 0.00 32.58 31.48 2g2p s HIS 89 CO -0.11 0.61 0.22 0.42 -0.85 0.00 0.00 174.74 175.04 2g2p s ILE 90 N -0.96 3.89 -0.14 0.60 1.01 -0.21 -4.95 121.20 120.44 2g2p s ILE 90 Ca 0.24 -1.56 0.21 0.00 0.00 0.00 0.00 60.65 59.53 2g2p s ILE 90 Cb -0.16 -3.43 -0.16 0.00 0.01 0.00 0.00 42.46 38.71 2g2p s ILE 90 CO 0.13 -0.52 0.74 -0.46 0.00 0.00 0.00 174.94 174.83 2g2p n ASN 91 N 4.82 0.51 -3.81 3.58 6.94 -1.26 -2.01 115.26 124.02 2g2p n ASN 91 Ca -0.09 0.21 -0.28 0.00 -0.02 0.00 0.00 54.58 54.40 2g2p n ASN 91 Cb 0.42 0.94 -0.16 0.00 -2.36 0.00 0.00 39.78 38.62 2g2p n ASN 91 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2g2p s LYS 92 N -3.26 0.99 0.49 -3.83 -0.14 -1.26 -4.89 119.74 107.84 2g2p s LYS 92 Ca -0.04 -0.59 0.27 0.00 -1.36 0.00 0.00 55.97 54.25 2g2p s LYS 92 Cb 0.11 -2.23 1.25 0.00 -1.68 0.00 0.00 37.83 35.27 2g2p s LYS 92 CO 0.84 -0.61 1.97 -0.39 -0.76 0.00 0.00 175.35 176.40 2g2p h VAL 93 N 6.55 0.52 -0.28 3.17 -1.51 -1.91 -2.61 116.25 120.18 2g2p h VAL 93 Ca -0.17 -0.77 -0.03 0.00 -1.23 0.00 0.00 66.70 64.50 2g2p h VAL 93 Cb 1.11 1.52 -0.02 0.00 -2.13 0.00 0.00 31.29 31.77 2g2p h VAL 93 CO 0.36 0.15 0.03 -0.46 -1.23 0.00 0.00 177.57 176.43 2g2p n ASN 94 N -3.49 3.12 -4.85 4.19 6.94 -1.26 -4.88 115.26 115.03 2g2p n ASN 94 Ca -0.01 -2.45 -0.21 0.00 -0.02 0.00 0.00 54.58 51.89 2g2p n ASN 94 Cb 0.32 -0.59 -0.04 0.00 -2.36 0.00 0.00 39.78 37.11 2g2p n ASN 94 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2g2p s GLU 95 N -1.74 2.62 -0.19 -3.83 2.02 -0.99 -5.10 118.70 111.49 2g2p s GLU 95 Ca 0.24 -1.41 -0.05 0.00 0.02 0.00 0.00 54.97 53.77 2g2p s GLU 95 Cb 0.19 -2.41 -0.02 0.00 0.10 0.00 0.00 34.13 31.98 2g2p s GLU 95 CO 0.07 -0.02 -0.01 -1.58 0.02 0.00 0.00 175.26 173.74 2g2p s HIS 96 N -2.38 3.04 -0.15 1.61 5.65 -1.26 -4.42 115.29 117.37 2g2p s HIS 96 Ca 0.44 -0.43 -0.02 0.00 0.25 0.00 0.00 55.06 55.29 2g2p s HIS 96 Cb -0.04 -2.06 -0.02 0.00 -1.18 0.00 0.00 32.58 29.27 2g2p s HIS 96 CO 0.27 -0.20 -0.08 0.71 -0.65 0.00 0.00 174.74 174.78 2g2p s TYR 97 N 0.89 2.92 -0.08 3.88 2.02 0.12 -4.99 117.35 122.10 2g2p s TYR 97 Ca 0.01 -0.51 -0.01 0.00 -0.37 0.00 0.00 57.07 56.19 2g2p s TYR 97 Cb -0.14 -1.91 0.03 0.00 -0.40 0.00 0.00 41.96 39.53 2g2p s TYR 97 CO 0.02 -0.15 -0.02 -1.58 -1.57 0.00 0.00 175.55 172.24 2g2p s HIS 98 N 0.43 0.90 -0.54 2.71 2.46 -1.26 -1.42 115.29 118.58 2g2p s HIS 98 Ca -0.07 -0.33 0.04 0.00 0.47 0.00 0.00 55.06 55.17 2g2p s HIS 98 Cb -0.15 -0.91 0.14 0.00 -0.13 0.00 0.00 32.58 31.53 2g2p s HIS 98 CO 0.04 -0.36 0.31 0.08 -2.47 0.00 0.00 174.74 172.33 2g2p s VAL 99 N 1.79 2.32 0.66 0.89 1.01 -0.34 -0.76 120.40 125.96 2g2p s VAL 99 Ca 0.03 -3.33 -0.15 0.00 0.00 0.00 0.00 61.98 58.53 2g2p s VAL 99 Cb -0.13 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.66 2g2p s VAL 99 CO -0.05 -0.88 1.12 -2.84 0.00 0.00 0.00 175.10 172.45 2g2p s PRO 100 N -0.38 2.78 -0.11 2.72 0.02 -1.25 -3.59 135.00 135.18 2g2p s PRO 100 Ca 0.19 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.65 2g2p s PRO 100 Cb -0.20 -1.94 0.02 0.00 0.02 0.00 0.00 34.50 32.40 2g2p s PRO 100 CO -0.04 -1.28 -0.09 -1.17 -0.33 0.00 0.00 177.00 174.09 2g2p s LEU 101 N -4.83 1.33 -0.34 -5.54 2.96 0.34 -3.77 118.68 108.82 2g2p s LEU 101 Ca 0.68 -0.33 -0.13 0.00 -0.22 0.00 0.00 54.13 54.13 2g2p s LEU 101 Cb -0.21 -0.88 -0.02 0.00 0.50 0.00 0.00 46.19 45.58 2g2p s LEU 101 CO 0.41 -0.08 0.26 -0.76 -1.32 0.00 0.00 176.35 174.85 2g2p s LEU 102 N 1.50 4.52 -0.10 -0.68 1.43 -0.05 -0.67 118.68 124.64 2g2p s LEU 102 Ca 0.02 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2g2p s LEU 102 Cb -0.13 -2.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 2g2p s LEU 102 CO -0.07 -0.25 -0.21 -0.22 0.23 0.00 0.00 176.35 175.83 2g2p s LEU 103 N 1.77 2.26 0.24 1.79 2.96 0.07 -1.22 118.68 126.53 2g2p s LEU 103 Ca 0.07 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.53 2g2p s LEU 103 Cb -0.17 -1.46 -0.05 0.00 0.50 0.00 0.00 46.19 45.01 2g2p s LEU 103 CO 0.11 0.19 0.02 -0.44 -1.32 0.00 0.00 176.35 174.90 2g2p s SER 104 N 0.19 1.68 0.34 3.68 0.01 0.71 -0.92 113.70 119.39 2g2p s SER 104 Ca -0.13 -1.25 0.01 0.00 1.31 0.00 0.00 55.95 55.89 2g2p s SER 104 Cb -0.16 0.04 0.58 0.00 0.21 0.00 0.00 66.02 66.69 2g2p s SER 104 CO 0.07 -0.57 1.98 1.56 0.41 0.00 0.00 173.24 176.69 2g2p h GLN 105 N 2.46 0.85 0.00 12.44 4.20 -1.99 -3.18 115.11 129.89 2g2p h GLN 105 Ca -0.38 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.25 2g2p h GLN 105 Cb 1.23 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 2g2p h GLN 105 CO 0.64 0.60 -0.16 0.66 -0.67 0.00 0.00 178.83 179.90 2g2p n TYR 106 N -4.41 0.00 -3.59 2.96 4.01 -1.26 -1.49 117.16 113.38 2g2p n TYR 106 Ca 0.06 -0.90 -0.10 0.00 -0.16 0.00 0.00 57.90 56.81 2g2p n TYR 106 Cb 0.07 -0.15 -0.05 0.00 -0.31 0.00 0.00 39.34 38.90 2g2p n TYR 106 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2g2p s GLY 107 N -2.62 -0.23 0.14 2.72 0.00 -1.20 -4.96 107.32 101.17 2g2p s GLY 107 Ca 0.28 2.16 -0.19 0.00 0.00 0.00 0.00 44.72 46.98 2g2p s GLY 107 CO 0.01 1.15 0.48 -2.52 0.00 0.00 0.00 173.10 172.22 2g2p s TYR 108 N -0.91 -0.31 0.07 1.90 -0.85 -1.26 -0.21 117.35 115.78 2g2p s TYR 108 Ca -0.01 0.03 0.05 0.00 -0.52 0.00 0.00 57.07 56.63 2g2p s TYR 108 Cb -0.01 0.37 -0.03 0.00 0.38 0.00 0.00 41.96 42.67 2g2p s TYR 108 CO 0.00 -0.77 -0.15 -1.12 -1.52 0.00 0.00 175.55 171.99 2g2p s SER 109 N -2.79 1.76 0.09 -0.18 0.01 -0.36 -4.99 113.70 107.24 2g2p s SER 109 Ca 0.03 -0.60 -0.11 0.00 1.31 0.00 0.00 55.95 56.58 2g2p s SER 109 Cb 0.01 -0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.18 2g2p s SER 109 CO -0.12 -0.05 0.25 0.28 0.41 0.00 0.00 173.24 174.02 2g2p s THR 110 N -1.20 0.12 0.17 1.44 -1.32 -1.26 -0.87 115.64 112.73 2g2p s THR 110 Ca -0.01 -1.00 -0.24 0.00 -1.21 0.00 0.00 61.69 59.23 2g2p s THR 110 Cb -0.10 -1.27 0.06 0.00 -1.51 0.00 0.00 72.50 69.68 2g2p s THR 110 CO 0.02 -0.55 0.94 -0.72 -2.21 0.00 0.00 174.62 172.10 2g2p s TYR 111 N -3.76 -0.12 -0.44 9.09 -0.85 -1.25 -5.06 117.35 114.97 2g2p s TYR 111 Ca 0.04 -0.21 -0.23 0.00 -0.52 0.00 0.00 57.07 56.14 2g2p s TYR 111 Cb 0.04 0.65 0.02 0.00 0.38 0.00 0.00 41.96 43.05 2g2p s TYR 111 CO -0.11 -0.89 0.80 0.50 -1.52 0.00 0.00 175.55 174.33 2g2p s ARG 112 N -3.28 3.48 0.10 -3.49 3.52 -1.26 -3.82 118.95 114.20 2g2p s ARG 112 Ca 0.13 -0.01 -0.01 0.00 -0.13 0.00 0.00 55.73 55.70 2g2p s ARG 112 Cb -0.02 -3.92 0.02 0.00 -1.56 0.00 0.00 34.95 29.48 2g2p s ARG 112 CO 0.03 -1.08 0.13 0.41 -0.81 0.00 0.00 175.30 173.98 2g2p n GLY 113 N 4.91 -0.25 0.73 8.12 0.00 0.06 -5.00 105.19 113.75 2g2p n GLY 113 Ca 0.03 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.33 2g2p n GLY 113 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18