#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee0 h SER 2 N 0.00 0.00 -2.12 1.61 0.02 -2.11 -3.48 113.55 107.47 2ee0 h SER 2 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2ee0 h SER 2 Cb 0.00 0.00 0.24 0.00 0.14 0.00 0.00 62.40 62.78 2ee0 h SER 2 CO 0.00 0.67 -1.71 -1.20 -1.14 0.00 0.00 176.83 173.45 2ee0 n SER 3 N -4.38 -4.37 0.00 3.07 7.64 -1.26 -4.98 113.62 109.34 2ee0 n SER 3 Ca -0.06 0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2ee0 n SER 3 Cb 0.23 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2ee0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ee0 n GLY 4 N 2.97 -0.13 4.38 0.23 0.00 -1.26 -5.01 105.19 106.37 2ee0 n GLY 4 Ca -0.00 0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2ee0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ee0 n SER 5 N -0.51 -0.67 -3.96 1.61 2.88 -1.26 -4.92 113.62 106.80 2ee0 n SER 5 Ca 0.00 -1.22 -0.25 0.00 -1.33 0.00 0.00 58.87 56.06 2ee0 n SER 5 Cb 0.00 -1.81 -0.17 0.00 -0.75 0.00 0.00 64.21 61.48 2ee0 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2ee0 s SER 6 N -3.82 1.93 -0.38 -3.46 1.04 -1.26 -5.03 113.70 102.73 2ee0 s SER 6 Ca 0.41 -0.29 0.12 0.00 0.48 0.00 0.00 55.95 56.67 2ee0 s SER 6 Cb -0.24 -0.81 0.40 0.00 0.10 0.00 0.00 66.02 65.46 2ee0 s SER 6 CO 1.00 -0.05 1.09 0.61 0.98 0.00 0.00 173.24 176.87 2ee0 n GLY 7 N 4.40 1.62 0.40 7.32 0.00 -1.26 -4.99 105.19 112.68 2ee0 n GLY 7 Ca -0.18 -0.74 -0.07 0.00 0.00 0.00 0.00 46.02 45.04 2ee0 n GLY 7 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2ee0 h ASN 8 N 2.65 -1.77 -7.03 1.61 -1.24 -1.96 -3.44 115.58 104.40 2ee0 h ASN 8 Ca -0.13 0.31 -0.60 0.00 0.71 0.00 0.00 56.30 56.59 2ee0 h ASN 8 Cb 1.18 0.84 -0.31 0.00 0.73 0.00 0.00 38.32 40.75 2ee0 h ASN 8 CO 0.24 -0.27 -0.88 0.47 -1.29 0.00 0.00 177.43 175.70 2ee0 n ASP 9 N -5.37 -2.25 -4.03 1.15 9.92 -1.26 -4.90 116.55 109.81 2ee0 n ASP 9 Ca 0.05 -1.16 -0.31 0.00 -0.53 0.00 0.00 54.79 52.84 2ee0 n ASP 9 Cb 0.33 -2.04 -0.16 0.00 -0.64 0.00 0.00 41.12 38.62 2ee0 n ASP 9 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 2ee0 s ASN 10 N -3.32 3.84 -0.03 -2.24 0.01 -1.26 -5.11 114.94 106.82 2ee0 s ASN 10 Ca 0.76 -1.10 -0.13 0.00 -0.71 0.00 0.00 52.86 51.68 2ee0 s ASN 10 Cb -0.44 -1.38 -0.05 0.00 0.41 0.00 0.00 41.25 39.80 2ee0 s ASN 10 CO 0.99 -0.16 0.36 -0.60 -1.51 0.00 0.00 177.10 176.18 2ee0 s ARG 11 N 1.27 3.86 -0.73 -0.60 3.52 -1.26 -4.93 118.95 120.07 2ee0 s ARG 11 Ca -0.04 0.30 -0.26 0.00 -0.13 0.00 0.00 55.73 55.60 2ee0 s ARG 11 Cb -0.18 -3.23 -0.03 0.00 -1.56 0.00 0.00 34.95 29.95 2ee0 s ARG 11 CO -0.07 0.67 1.90 -1.25 -0.81 0.00 0.00 175.30 175.73 2ee0 s PRO 12 N -0.94 2.60 -0.23 5.12 0.04 -1.26 -4.96 135.00 135.37 2ee0 s PRO 12 Ca 0.22 0.23 -0.10 0.00 0.04 0.00 0.00 61.00 61.39 2ee0 s PRO 12 Cb -0.16 -4.67 -0.05 0.00 0.04 0.00 0.00 34.50 29.66 2ee0 s PRO 12 CO 0.11 -3.00 0.14 0.14 0.04 0.00 0.00 177.00 174.44 2ee0 s VAL 13 N 9.49 5.33 1.02 -0.36 -7.23 -1.26 -4.62 120.40 122.77 2ee0 s VAL 13 Ca 0.68 0.17 -0.12 0.00 -1.81 0.00 0.00 61.98 60.90 2ee0 s VAL 13 Cb -0.10 -3.47 0.20 0.00 0.56 0.00 0.00 36.38 33.58 2ee0 s VAL 13 CO 0.12 0.38 1.08 -0.36 -0.31 0.00 0.00 175.10 176.00 2ee0 s PHE 14 N 0.82 1.71 0.02 2.82 0.08 -1.26 -4.63 117.98 117.53 2ee0 s PHE 14 Ca 0.07 1.34 -0.25 0.00 0.12 0.00 0.00 56.93 58.22 2ee0 s PHE 14 Cb -0.13 -3.18 -0.18 0.00 -0.57 0.00 0.00 43.02 38.96 2ee0 s PHE 14 CO 0.02 -3.17 1.39 1.57 -0.10 0.00 0.00 175.22 174.93 2ee0 h LYS 15 N -2.12 -0.09 -4.11 0.44 2.10 -1.96 -3.44 116.57 107.39 2ee0 h LYS 15 Ca -0.53 0.01 -0.45 0.00 -2.00 0.00 0.00 60.65 57.68 2ee0 h LYS 15 Cb 1.30 0.02 -0.35 0.00 -0.90 0.00 0.00 32.23 32.31 2ee0 h LYS 15 CO 0.50 0.22 -0.78 -1.21 -2.00 0.00 0.00 179.45 176.18 2ee0 s GLU 16 N -4.89 1.05 0.13 0.07 0.41 -1.26 -5.05 118.70 109.16 2ee0 s GLU 16 Ca -0.15 -0.16 -0.25 0.00 -0.41 0.00 0.00 54.97 54.01 2ee0 s GLU 16 Cb 0.03 -1.05 -0.06 0.00 -1.78 0.00 0.00 34.13 31.28 2ee0 s GLU 16 CO 0.64 -0.11 1.36 0.41 -0.49 0.00 0.00 175.26 177.07 2ee0 n GLY 17 N 4.23 -2.49 3.22 -1.39 0.00 -1.26 -4.65 105.19 102.86 2ee0 n GLY 17 Ca -0.21 1.02 -0.13 0.00 0.00 0.00 0.00 46.02 46.71 2ee0 n GLY 17 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ee0 s GLN 18 N -5.11 0.98 -0.14 1.61 1.03 -1.26 -3.22 119.66 113.55 2ee0 s GLN 18 Ca -0.10 -1.40 -0.10 0.00 0.04 0.00 0.00 55.36 53.81 2ee0 s GLN 18 Cb 0.09 -0.49 0.05 0.00 0.03 0.00 0.00 33.01 32.68 2ee0 s GLN 18 CO 0.49 0.05 0.36 0.08 -2.54 0.00 0.00 175.29 173.73 2ee0 s VAL 19 N -3.37 -0.02 -0.15 3.63 1.01 -1.21 -5.04 120.40 115.25 2ee0 s VAL 19 Ca 0.15 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.12 2ee0 s VAL 19 Cb 0.03 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2ee0 s VAL 19 CO -0.01 0.03 0.11 -0.70 0.00 0.00 0.00 175.10 174.53 2ee0 s GLU 20 N 0.89 3.74 0.22 2.72 2.12 -1.26 -2.04 118.70 125.09 2ee0 s GLU 20 Ca -0.06 -0.22 0.03 0.00 0.36 0.00 0.00 54.97 55.09 2ee0 s GLU 20 Cb -0.06 -3.24 -0.05 0.00 0.26 0.00 0.00 34.13 31.04 2ee0 s GLU 20 CO -0.07 0.54 0.01 0.14 -0.54 0.00 0.00 175.26 175.34 2ee0 s VAL 21 N -0.34 0.90 -0.14 3.70 -7.23 -0.43 -5.01 120.40 111.85 2ee0 s VAL 21 Ca 0.11 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.24 2ee0 s VAL 21 Cb -0.12 -2.32 0.04 0.00 0.56 0.00 0.00 36.38 34.54 2ee0 s VAL 21 CO 0.01 -0.32 -0.00 -1.38 -0.31 0.00 0.00 175.10 173.10 2ee0 s HIS 22 N -3.51 1.11 -0.03 2.82 -3.43 -1.26 -0.83 115.29 110.15 2ee0 s HIS 22 Ca 0.28 -0.69 0.04 0.00 -0.80 0.00 0.00 55.06 53.89 2ee0 s HIS 22 Cb 0.06 -1.04 -0.00 0.00 -1.43 0.00 0.00 32.58 30.17 2ee0 s HIS 22 CO 0.08 -0.52 -0.15 -1.50 -2.00 0.00 0.00 174.74 170.65 2ee0 s ILE 23 N 1.83 1.25 0.26 -5.38 2.07 -0.45 -4.94 121.20 115.84 2ee0 s ILE 23 Ca 0.02 -0.63 -0.30 0.00 -1.41 0.00 0.00 60.65 58.33 2ee0 s ILE 23 Cb -0.15 -1.07 -0.09 0.00 0.13 0.00 0.00 42.46 41.27 2ee0 s ILE 23 CO -0.07 0.36 1.26 -2.16 -1.91 0.00 0.00 174.94 172.42 2ee0 s PRO 24 N 0.00 4.43 0.30 3.50 0.04 -1.26 -2.86 135.00 139.15 2ee0 s PRO 24 Ca -0.02 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.12 2ee0 s PRO 24 Cb -0.10 -3.16 0.72 0.00 0.04 0.00 0.00 34.50 32.00 2ee0 s PRO 24 CO 0.01 -0.13 1.77 1.05 0.04 0.00 0.00 177.00 179.74 2ee0 h GLU 25 N 4.41 0.69 -0.93 4.56 4.11 -1.87 0.54 114.58 126.09 2ee0 h GLU 25 Ca -0.46 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 58.86 2ee0 h GLU 25 Cb 1.22 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 2ee0 h GLU 25 CO 0.71 0.46 0.08 0.09 0.07 0.00 0.00 179.01 180.42 2ee0 n ASN 26 N -4.81 2.72 -4.76 3.06 3.02 -1.26 -3.33 115.26 109.90 2ee0 n ASN 26 Ca 0.23 -2.35 -0.40 0.00 -0.03 0.00 0.00 54.58 52.03 2ee0 n ASN 26 Cb 0.57 -0.57 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2ee0 n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ee0 n ALA 27 N 0.12 1.93 -2.19 5.41 0.00 0.19 -4.93 120.51 121.04 2ee0 n ALA 27 Ca 0.12 0.23 -0.42 0.00 0.00 0.00 0.00 53.44 53.37 2ee0 n ALA 27 Cb 0.65 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 2ee0 n ALA 27 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ee0 s PRO 28 N -2.51 4.31 -0.08 0.00 0.04 -1.26 -4.88 135.00 130.62 2ee0 s PRO 28 Ca 0.63 2.03 -0.36 0.00 0.04 0.00 0.00 61.00 63.34 2ee0 s PRO 28 Cb -0.45 -3.39 -0.13 0.00 0.04 0.00 0.00 34.50 30.58 2ee0 s PRO 28 CO 0.56 -0.49 1.77 0.28 0.04 0.00 0.00 177.00 179.16 2ee0 n VAL 29 N 4.24 0.40 0.00 -0.36 0.31 -1.26 -2.48 118.33 119.17 2ee0 n VAL 29 Ca 0.12 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 2ee0 n VAL 29 Cb 0.43 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 2ee0 n VAL 29 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ee0 n GLY 30 N 4.09 1.41 3.61 2.92 0.00 0.15 -4.96 105.19 112.40 2ee0 n GLY 30 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2ee0 n GLY 30 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ee0 s THR 31 N -2.00 4.81 -0.34 2.61 2.01 -1.04 -4.77 115.64 116.92 2ee0 s THR 31 Ca 0.00 1.07 -0.28 0.00 0.31 0.00 0.00 61.69 62.79 2ee0 s THR 31 Cb 0.00 -4.13 -0.07 0.00 0.01 0.00 0.00 72.50 68.31 2ee0 s THR 31 CO 0.00 -0.26 2.30 -1.54 -0.69 0.00 0.00 174.62 174.43 2ee0 n SER 32 N 6.18 2.77 0.00 3.53 3.41 -1.26 -3.09 113.62 125.17 2ee0 n SER 32 Ca 0.03 -0.02 -0.02 0.00 -0.26 0.00 0.00 58.87 58.60 2ee0 n SER 32 Cb 0.48 -1.53 -0.01 0.00 -0.26 0.00 0.00 64.21 62.90 2ee0 n SER 32 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ee0 h VAL 33 N 7.36 0.00 -3.45 -3.33 2.07 -1.48 -3.48 116.25 113.94 2ee0 h VAL 33 Ca -0.33 -0.79 -0.16 0.00 0.82 0.00 0.00 66.70 66.24 2ee0 h VAL 33 Cb 1.26 0.00 -0.23 0.00 -1.52 0.00 0.00 31.29 30.80 2ee0 h VAL 33 CO 1.04 0.00 -0.50 -0.51 0.02 0.00 0.00 177.57 177.62 2ee0 s ILE 34 N -1.85 0.06 -0.09 4.57 1.10 -1.21 -4.99 121.20 118.78 2ee0 s ILE 34 Ca -0.02 -0.46 0.01 0.00 -0.51 0.00 0.00 60.65 59.68 2ee0 s ILE 34 Cb 0.00 -0.37 0.02 0.00 0.15 0.00 0.00 42.46 42.26 2ee0 s ILE 34 CO 0.05 -0.25 -0.11 -1.58 -2.11 0.00 0.00 174.94 170.94 2ee0 s GLN 35 N -0.88 1.72 -0.21 3.50 0.74 -1.26 -1.50 119.66 121.76 2ee0 s GLN 35 Ca -0.10 -0.38 -0.10 0.00 0.05 0.00 0.00 55.36 54.83 2ee0 s GLN 35 Cb -0.05 -1.55 -0.05 0.00 1.10 0.00 0.00 33.01 32.46 2ee0 s GLN 35 CO 0.01 -0.10 0.13 -0.51 -0.55 0.00 0.00 175.29 174.28 2ee0 s LEU 36 N 1.09 4.11 -0.36 3.68 1.43 -0.90 -5.03 118.68 122.71 2ee0 s LEU 36 Ca -0.06 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 2ee0 s LEU 36 Cb -0.14 -2.08 0.07 0.00 0.03 0.00 0.00 46.19 44.07 2ee0 s LEU 36 CO -0.02 0.13 0.11 -2.28 0.23 0.00 0.00 176.35 174.53 2ee0 s HIS 37 N 0.65 3.39 -0.28 0.29 5.65 -1.26 -4.77 115.29 118.96 2ee0 s HIS 37 Ca 0.07 -1.98 -0.00 0.00 0.25 0.00 0.00 55.06 53.39 2ee0 s HIS 37 Cb -0.12 -2.62 0.09 0.00 -1.18 0.00 0.00 32.58 28.74 2ee0 s HIS 37 CO 0.01 -0.86 0.05 0.00 -0.65 0.00 0.00 174.74 173.29 2ee0 s ALA 38 N 1.25 1.66 0.06 1.58 0.00 -1.26 -3.51 121.76 121.54 2ee0 s ALA 38 Ca 0.01 -1.53 0.08 0.00 0.00 0.00 0.00 51.96 50.52 2ee0 s ALA 38 Cb -0.21 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.34 2ee0 s ALA 38 CO -0.01 -1.49 -0.22 0.95 0.00 0.00 0.00 175.76 174.99 2ee0 s THR 39 N 1.54 1.78 0.04 0.00 -4.23 -1.26 -4.94 115.64 108.57 2ee0 s THR 39 Ca 0.05 -1.35 0.02 0.00 -1.18 0.00 0.00 61.69 59.23 2ee0 s THR 39 Cb -0.18 -1.56 -0.02 0.00 1.34 0.00 0.00 72.50 72.08 2ee0 s THR 39 CO -0.17 0.15 -0.08 -1.81 -0.54 0.00 0.00 174.62 172.18 2ee0 s ASP 40 N -1.43 0.84 -0.46 3.99 1.01 -1.26 -4.82 116.67 114.54 2ee0 s ASP 40 Ca 0.08 -0.57 -0.44 0.00 0.71 0.00 0.00 52.55 52.34 2ee0 s ASP 40 Cb -0.09 0.04 -0.18 0.00 1.01 0.00 0.00 42.92 43.70 2ee0 s ASP 40 CO 0.03 -0.22 1.93 0.00 0.21 0.00 0.00 175.17 177.12 2ee0 n ALA 41 N 1.40 -0.24 0.06 5.23 0.00 -1.26 -4.77 120.51 120.94 2ee0 n ALA 41 Ca -0.22 0.28 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2ee0 n ALA 41 Cb 0.55 -2.09 0.03 0.00 0.00 0.00 0.00 19.45 17.94 2ee0 n ALA 41 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ee0 n ASP 42 N 6.41 4.15 -4.45 0.00 2.03 -1.26 -4.82 116.55 118.61 2ee0 n ASP 42 Ca 0.43 -2.50 -0.37 0.00 0.52 0.00 0.00 54.79 52.87 2ee0 n ASP 42 Cb -0.00 -0.76 -0.12 0.00 -0.72 0.00 0.00 41.12 39.51 2ee0 n ASP 42 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2ee0 s ILE 43 N -0.90 4.42 0.00 5.18 -5.25 -1.26 -4.70 121.20 118.69 2ee0 s ILE 43 Ca 0.14 -0.22 0.00 0.00 -0.99 0.00 0.00 60.65 59.58 2ee0 s ILE 43 Cb 0.11 -3.12 0.00 0.00 2.95 0.00 0.00 42.46 42.40 2ee0 s ILE 43 CO 0.02 0.26 0.00 0.61 -1.79 0.00 0.00 174.94 174.04 2ee0 n GLY 44 N 4.94 2.24 2.71 6.27 0.00 -1.26 -4.77 105.19 115.32 2ee0 n GLY 44 Ca -0.15 -0.69 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 2ee0 n GLY 44 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ee0 s SER 45 N -1.36 1.39 -0.02 1.61 0.15 -1.26 -5.11 113.70 109.09 2ee0 s SER 45 Ca 0.00 -0.02 -0.30 0.00 0.70 0.00 0.00 55.95 56.33 2ee0 s SER 45 Cb 0.00 -0.27 -0.07 0.00 -1.71 0.00 0.00 66.02 63.97 2ee0 s SER 45 CO 0.00 -0.23 1.81 0.21 1.20 0.00 0.00 173.24 176.23 2ee0 s ASN 46 N 2.09 6.53 -0.02 5.45 3.84 -1.26 -4.98 114.94 126.58 2ee0 s ASN 46 Ca 0.05 2.40 0.07 0.00 0.21 0.00 0.00 52.86 55.59 2ee0 s ASN 46 Cb -0.12 -2.53 -0.02 0.00 -0.55 0.00 0.00 41.25 38.03 2ee0 s ASN 46 CO -0.04 -1.02 -0.22 0.00 -2.79 0.00 0.00 177.10 173.03 2ee0 s ALA 47 N 4.37 1.82 -0.65 1.71 0.00 -1.26 -5.10 121.76 122.66 2ee0 s ALA 47 Ca 0.81 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.73 2ee0 s ALA 47 Cb -0.37 -0.47 0.17 0.00 0.00 0.00 0.00 23.12 22.45 2ee0 s ALA 47 CO 0.35 0.44 0.53 -1.21 0.00 0.00 0.00 175.76 175.88 2ee0 s GLU 48 N -0.50 2.95 0.08 0.00 8.01 -1.26 -5.05 118.70 122.93 2ee0 s GLU 48 Ca 0.08 -2.22 -0.31 0.00 0.01 0.00 0.00 54.97 52.54 2ee0 s GLU 48 Cb -0.09 -4.09 -0.09 0.00 -4.31 0.00 0.00 34.13 25.56 2ee0 s GLU 48 CO -0.01 -1.24 1.74 0.42 0.01 0.00 0.00 175.26 176.19 2ee0 s ILE 49 N 0.57 2.87 -0.23 -1.63 1.01 -1.26 -4.95 121.20 117.58 2ee0 s ILE 49 Ca 0.13 0.29 -0.06 0.00 0.00 0.00 0.00 60.65 61.02 2ee0 s ILE 49 Cb -0.19 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 39.07 2ee0 s ILE 49 CO -0.04 -0.00 0.02 -0.60 0.00 0.00 0.00 174.94 174.31 2ee0 s ARG 50 N 2.87 3.53 -0.26 2.79 6.06 -1.23 -4.83 118.95 127.89 2ee0 s ARG 50 Ca 0.78 -0.54 -0.16 0.00 -2.50 0.00 0.00 55.73 53.30 2ee0 s ARG 50 Cb -0.42 -3.17 -0.03 0.00 0.06 0.00 0.00 34.95 31.39 2ee0 s ARG 50 CO 0.34 -0.18 0.45 0.71 -2.50 0.00 0.00 175.30 174.12 2ee0 s TYR 51 N 1.51 3.27 0.20 5.12 1.51 -1.25 -3.94 117.35 123.76 2ee0 s TYR 51 Ca 0.06 0.54 0.01 0.00 -1.01 0.00 0.00 57.07 56.67 2ee0 s TYR 51 Cb -0.15 -2.64 -0.05 0.00 -0.11 0.00 0.00 41.96 39.02 2ee0 s TYR 51 CO 0.00 -0.23 0.06 0.96 -1.11 0.00 0.00 175.55 175.23 2ee0 s ILE 52 N 2.12 0.44 0.50 2.71 -0.00 -1.08 -3.92 121.20 121.96 2ee0 s ILE 52 Ca 0.18 -1.98 -0.22 0.00 -0.00 0.00 0.00 60.65 58.64 2ee0 s ILE 52 Cb -0.16 -2.33 -0.06 0.00 -0.00 0.00 0.00 42.46 39.91 2ee0 s ILE 52 CO 0.09 -0.25 1.19 -0.36 -0.00 0.00 0.00 174.94 175.61 2ee0 s PHE 53 N -3.83 2.70 0.00 1.37 0.08 -1.26 -0.18 117.98 116.86 2ee0 s PHE 53 Ca 0.31 1.52 0.00 0.00 0.12 0.00 0.00 56.93 58.87 2ee0 s PHE 53 Cb 0.07 -3.42 0.00 0.00 -0.57 0.00 0.00 43.02 39.10 2ee0 s PHE 53 CO 0.08 -1.77 0.00 0.41 -0.10 0.00 0.00 175.22 173.84 2ee0 n GLY 54 N 0.43 -2.39 3.93 4.36 0.00 0.19 -4.71 105.19 107.00 2ee0 n GLY 54 Ca 0.09 -1.22 -0.25 0.00 0.00 0.00 0.00 46.02 44.64 2ee0 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ee0 s ALA 55 N -2.54 3.91 -1.30 4.61 0.00 -1.26 -4.48 121.76 120.70 2ee0 s ALA 55 Ca 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.79 2ee0 s ALA 55 Cb 0.00 -1.72 0.01 0.00 0.00 0.00 0.00 23.12 21.41 2ee0 s ALA 55 CO 0.00 0.47 1.13 1.04 0.00 0.00 0.00 175.76 178.40 2ee0 n GLN 56 N -0.71 -7.59 -3.80 0.00 1.13 -1.26 -4.98 117.38 100.17 2ee0 n GLN 56 Ca -0.08 0.82 -0.35 0.00 -1.94 0.00 0.00 57.00 55.45 2ee0 n GLN 56 Cb 0.55 -5.82 -0.08 0.00 0.11 0.00 0.00 30.24 24.99 2ee0 n GLN 56 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ee0 s VAL 57 N -3.32 5.29 0.48 5.09 1.01 -1.26 -5.09 120.40 122.61 2ee0 s VAL 57 Ca 0.46 0.15 -0.21 0.00 0.00 0.00 0.00 61.98 62.38 2ee0 s VAL 57 Cb -0.20 -3.40 -0.08 0.00 0.00 0.00 0.00 36.38 32.69 2ee0 s VAL 57 CO 0.72 0.46 1.06 0.00 0.00 0.00 0.00 175.10 177.34 2ee0 s ALA 58 N 0.26 2.87 -0.02 5.51 0.00 -1.26 -4.99 121.76 124.13 2ee0 s ALA 58 Ca 0.08 0.67 -0.26 0.00 0.00 0.00 0.00 51.96 52.45 2ee0 s ALA 58 Cb -0.11 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.52 2ee0 s ALA 58 CO -0.01 -0.40 1.27 -1.00 0.00 0.00 0.00 175.76 175.62 2ee0 h PRO 59 N 1.63 0.01 -0.97 0.00 0.13 -2.00 -3.25 132.00 127.55 2ee0 h PRO 59 Ca -0.49 -0.01 0.25 0.00 -0.87 0.00 0.00 66.00 64.88 2ee0 h PRO 59 Cb 1.23 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.18 2ee0 h PRO 59 CO 0.59 0.50 -0.03 0.00 -0.23 0.00 0.00 178.00 178.83 2ee0 h ALA 60 N 0.52 1.04 -0.47 -0.56 0.00 -2.00 0.56 119.26 118.34 2ee0 h ALA 60 Ca 0.00 0.34 0.04 0.00 0.00 0.00 0.00 54.91 55.29 2ee0 h ALA 60 Cb 0.49 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2ee0 h ALA 60 CO 0.00 -0.52 0.24 1.15 0.00 0.00 0.00 179.25 180.12 2ee0 h THR 61 N 0.02 0.97 0.73 0.00 2.02 -1.95 -2.75 112.91 111.94 2ee0 h THR 61 Ca 0.56 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.54 2ee0 h THR 61 Cb 1.09 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 2ee0 h THR 61 CO -0.92 0.09 -0.40 0.11 0.37 0.00 0.00 175.52 174.77 2ee0 h LYS 62 N 0.48 -1.00 -0.90 6.66 1.57 0.03 0.04 116.57 123.46 2ee0 h LYS 62 Ca 0.21 0.07 0.21 0.00 -1.87 0.00 0.00 60.65 59.27 2ee0 h LYS 62 Cb 0.11 0.23 -0.17 0.00 0.08 0.00 0.00 32.23 32.48 2ee0 h LYS 62 CO -0.14 -0.67 -0.10 -2.13 -0.57 0.00 0.00 179.45 175.85 2ee0 n ARG 63 N -4.95 -0.08 0.28 3.15 0.63 -0.60 -0.69 116.66 114.41 2ee0 n ARG 63 Ca -0.13 1.37 -0.13 0.00 -0.92 0.00 0.00 57.85 58.04 2ee0 n ARG 63 Cb 0.42 -2.11 -0.07 0.00 0.45 0.00 0.00 32.46 31.15 2ee0 n ARG 63 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2ee0 h LEU 64 N 0.00 -0.62 -8.78 6.15 4.07 -1.29 -3.31 115.31 111.53 2ee0 h LEU 64 Ca 0.49 -0.04 -0.64 0.00 0.08 0.00 0.00 57.88 57.77 2ee0 h LEU 64 Cb 0.90 0.16 -0.20 0.00 1.08 0.00 0.00 40.66 42.60 2ee0 h LEU 64 CO -0.88 -0.24 -0.60 -0.36 -1.08 0.00 0.00 178.44 175.28 2ee0 s PHE 65 N -4.46 3.13 -0.12 1.13 0.08 0.14 0.83 117.98 118.71 2ee0 s PHE 65 Ca -0.13 -0.25 -0.07 0.00 0.12 0.00 0.00 56.93 56.60 2ee0 s PHE 65 Cb 0.02 -2.21 -0.04 0.00 -0.57 0.00 0.00 43.02 40.22 2ee0 s PHE 65 CO 0.43 -0.21 0.15 0.00 -0.10 0.00 0.00 175.22 175.49 2ee0 s ALA 66 N 1.31 3.87 -0.09 5.36 0.00 -0.80 -4.21 121.76 127.20 2ee0 s ALA 66 Ca 0.05 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.40 2ee0 s ALA 66 Cb -0.15 -1.99 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 2ee0 s ALA 66 CO 0.04 0.60 -0.14 -1.17 0.00 0.00 0.00 175.76 175.09 2ee0 s LEU 67 N -0.98 2.74 -0.06 0.00 2.96 -1.26 -2.30 118.68 119.78 2ee0 s LEU 67 Ca 0.15 -0.26 -0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2ee0 s LEU 67 Cb -0.12 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 2ee0 s LEU 67 CO 0.04 0.26 0.16 0.20 -1.32 0.00 0.00 176.35 175.68 2ee0 s ASN 68 N -0.20 6.32 0.00 3.68 -0.87 -1.22 -4.98 114.94 117.67 2ee0 s ASN 68 Ca 0.00 0.38 0.23 0.00 -1.57 0.00 0.00 52.86 51.91 2ee0 s ASN 68 Cb -0.13 -2.00 0.09 0.00 -0.02 0.00 0.00 41.25 39.19 2ee0 s ASN 68 CO 0.03 0.33 1.15 0.59 -2.57 0.00 0.00 177.10 176.63 2ee0 n ASN 69 N 1.41 1.86 -0.04 -1.22 5.03 -1.25 -1.63 115.26 119.42 2ee0 n ASN 69 Ca -0.15 -1.41 0.01 0.00 0.87 0.00 0.00 54.58 53.90 2ee0 n ASN 69 Cb 0.54 0.45 -0.12 0.00 -1.02 0.00 0.00 39.78 39.62 2ee0 n ASN 69 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2ee0 n THR 70 N -0.15 0.49 0.00 3.41 -2.24 -1.26 -3.86 114.28 110.67 2ee0 n THR 70 Ca 0.09 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2ee0 n THR 70 Cb 0.45 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 2ee0 n THR 70 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2ee0 n THR 71 N -2.30 0.00 -3.78 4.28 -2.24 -1.26 -5.03 114.28 103.95 2ee0 n THR 71 Ca -0.13 -0.22 -0.28 0.00 -2.27 0.00 0.00 64.05 61.14 2ee0 n THR 71 Cb 0.69 0.72 0.04 0.00 -2.10 0.00 0.00 70.33 69.68 2ee0 n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ee0 n GLY 72 N 1.53 -0.51 3.18 3.38 0.00 -0.64 -4.75 105.19 107.38 2ee0 n GLY 72 Ca 0.00 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2ee0 n GLY 72 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ee0 s LEU 73 N -7.24 2.04 -0.22 0.99 2.96 -1.26 -2.12 118.68 113.84 2ee0 s LEU 73 Ca 0.63 -0.55 -0.16 0.00 -0.22 0.00 0.00 54.13 53.83 2ee0 s LEU 73 Cb -0.31 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 2ee0 s LEU 73 CO 0.77 0.11 0.40 -0.63 -1.32 0.00 0.00 176.35 175.69 2ee0 s ILE 74 N 0.57 5.19 0.21 6.68 1.01 -0.56 -3.37 121.20 130.93 2ee0 s ILE 74 Ca -0.14 0.69 0.08 0.00 0.00 0.00 0.00 60.65 61.29 2ee0 s ILE 74 Cb -0.17 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 2ee0 s ILE 74 CO 0.04 0.23 -0.15 0.42 0.00 0.00 0.00 174.94 175.48 2ee0 s THR 75 N 1.50 1.80 -0.49 2.92 -4.23 -0.97 -1.10 115.64 115.06 2ee0 s THR 75 Ca 0.18 -2.22 -0.28 0.00 -1.18 0.00 0.00 61.69 58.19 2ee0 s THR 75 Cb -0.15 -2.06 -0.00 0.00 1.34 0.00 0.00 72.50 71.63 2ee0 s THR 75 CO 0.08 -0.57 1.64 -0.69 -0.54 0.00 0.00 174.62 174.53 2ee0 s VAL 76 N -2.91 3.60 -0.04 2.29 1.01 -1.18 -1.91 120.40 121.26 2ee0 s VAL 76 Ca 0.23 0.53 -0.22 0.00 0.00 0.00 0.00 61.98 62.52 2ee0 s VAL 76 Cb -0.01 -4.06 -0.32 0.00 0.00 0.00 0.00 36.38 31.99 2ee0 s VAL 76 CO 0.07 -0.84 0.90 -0.61 0.00 0.00 0.00 175.10 174.62 2ee0 h GLN 77 N 12.54 0.31 -4.67 2.72 4.15 0.19 0.46 115.11 130.81 2ee0 h GLN 77 Ca -0.28 -0.53 -0.25 0.00 0.77 0.00 0.00 58.65 58.36 2ee0 h GLN 77 Cb 1.13 0.20 -0.15 0.00 0.21 0.00 0.00 27.48 28.87 2ee0 h GLN 77 CO 1.14 1.25 -0.66 1.03 -1.93 0.00 0.00 178.83 179.66 2ee0 s ARG 78 N -2.43 1.02 0.72 1.69 0.52 -0.81 -4.87 118.95 114.78 2ee0 s ARG 78 Ca -0.13 -1.48 -0.16 0.00 -0.52 0.00 0.00 55.73 53.43 2ee0 s ARG 78 Cb 0.01 -0.11 -0.06 0.00 0.52 0.00 0.00 34.95 35.31 2ee0 s ARG 78 CO 0.84 -0.15 0.34 0.45 0.02 0.00 0.00 175.30 176.79 2ee0 n SER 79 N -0.17 -1.89 -4.65 0.23 2.88 -1.26 -4.75 113.62 104.01 2ee0 n SER 79 Ca -0.07 0.57 -0.33 0.00 -1.33 0.00 0.00 58.87 57.70 2ee0 n SER 79 Cb 0.63 -1.13 -0.10 0.00 -0.75 0.00 0.00 64.21 62.86 2ee0 n SER 79 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2ee0 s LEU 80 N 1.07 3.42 -0.22 2.46 1.43 -1.21 -4.84 118.68 120.78 2ee0 s LEU 80 Ca 0.62 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.70 2ee0 s LEU 80 Cb -0.35 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 43.99 2ee0 s LEU 80 CO 0.61 0.32 -0.05 -1.81 0.23 0.00 0.00 176.35 175.66 2ee0 s ASP 81 N -1.20 4.28 -0.15 2.29 1.11 -1.26 -4.72 116.67 117.01 2ee0 s ASP 81 Ca 0.16 -0.40 -0.24 0.00 0.18 0.00 0.00 52.55 52.26 2ee0 s ASP 81 Cb -0.11 -1.73 -0.21 0.00 1.07 0.00 0.00 42.92 41.94 2ee0 s ASP 81 CO 0.06 -0.02 0.51 -0.09 1.18 0.00 0.00 175.17 176.81 2ee0 h ARG 82 N 8.11 0.00 -0.92 8.23 1.12 -1.96 -3.04 114.38 125.93 2ee0 h ARG 82 Ca -0.42 0.00 0.23 0.00 -1.11 0.00 0.00 59.98 58.68 2ee0 h ARG 82 Cb 1.16 0.00 -0.17 0.00 -0.01 0.00 0.00 29.97 30.95 2ee0 h ARG 82 CO 0.60 0.86 -0.04 0.93 -3.11 0.00 0.00 179.97 179.22 2ee0 h GLU 83 N -1.00 0.03 0.37 0.20 5.08 -2.00 -2.11 114.58 115.15 2ee0 h GLU 83 Ca -0.09 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2ee0 h GLU 83 Cb 0.96 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2ee0 h GLU 83 CO -0.05 0.02 -0.18 1.49 -1.00 0.00 0.00 179.01 179.29 2ee0 h GLU 84 N 0.03 -0.48 -4.33 2.33 4.57 -2.01 -3.45 114.58 111.26 2ee0 h GLU 84 Ca 0.52 0.03 -0.48 0.00 -1.18 0.00 0.00 59.36 58.25 2ee0 h GLU 84 Cb 0.97 0.11 -0.34 0.00 -0.16 0.00 0.00 28.75 29.32 2ee0 h GLU 84 CO -0.87 -0.32 -0.80 -0.08 -1.18 0.00 0.00 179.01 175.76 2ee0 s THR 85 N -3.33 0.92 -0.18 0.32 -1.32 -0.80 -5.04 115.64 106.21 2ee0 s THR 85 Ca -0.07 -0.33 -0.20 0.00 -1.21 0.00 0.00 61.69 59.88 2ee0 s THR 85 Cb 0.01 -0.88 -0.22 0.00 -1.51 0.00 0.00 72.50 69.90 2ee0 s THR 85 CO 0.22 0.31 0.33 0.00 -2.21 0.00 0.00 174.62 173.27 2ee0 h ALA 86 N 7.21 0.25 -3.35 11.08 0.00 -1.80 -3.34 119.26 129.31 2ee0 h ALA 86 Ca -0.33 -1.15 -0.65 0.00 0.00 0.00 0.00 54.91 52.79 2ee0 h ALA 86 Cb 1.17 0.63 -0.19 0.00 0.00 0.00 0.00 17.79 19.40 2ee0 h ALA 86 CO 0.46 0.72 -0.65 0.42 0.00 0.00 0.00 179.25 180.20 2ee0 s ILE 87 N -2.38 4.07 -0.27 0.00 1.01 -1.26 -3.17 121.20 119.20 2ee0 s ILE 87 Ca -0.26 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.03 2ee0 s ILE 87 Cb 0.05 -2.75 0.01 0.00 0.01 0.00 0.00 42.46 39.77 2ee0 s ILE 87 CO 0.64 0.53 0.02 -1.00 0.00 0.00 0.00 174.94 175.14 2ee0 s HIS 88 N -0.11 3.09 -0.42 3.97 3.76 -1.01 -4.99 115.29 119.58 2ee0 s HIS 88 Ca 0.03 -1.08 -0.14 0.00 -0.15 0.00 0.00 55.06 53.72 2ee0 s HIS 88 Cb -0.13 -2.18 0.04 0.00 1.11 0.00 0.00 32.58 31.42 2ee0 s HIS 88 CO 0.02 -0.60 0.30 0.15 -0.85 0.00 0.00 174.74 173.77 2ee0 s LYS 89 N 1.46 2.92 -0.11 1.40 -0.14 -1.26 -2.91 119.74 121.09 2ee0 s LYS 89 Ca 0.03 -1.14 0.03 0.00 -1.36 0.00 0.00 55.97 53.52 2ee0 s LYS 89 Cb -0.16 -3.96 0.01 0.00 -1.68 0.00 0.00 37.83 32.04 2ee0 s LYS 89 CO -0.00 -0.82 -0.20 0.08 -0.76 0.00 0.00 175.35 173.65 2ee0 s VAL 90 N 1.63 1.82 -0.15 3.17 1.01 -1.22 -4.98 120.40 121.68 2ee0 s VAL 90 Ca 0.04 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 2ee0 s VAL 90 Cb -0.21 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2ee0 s VAL 90 CO 0.08 0.51 0.01 -0.89 0.00 0.00 0.00 175.10 174.80 2ee0 s THR 91 N 0.71 4.29 -0.00 3.92 2.01 -1.26 -2.83 115.64 122.47 2ee0 s THR 91 Ca -0.11 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.67 2ee0 s THR 91 Cb -0.16 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2ee0 s THR 91 CO 0.02 0.50 0.04 -0.69 -0.69 0.00 0.00 174.62 173.80 2ee0 s VAL 92 N 0.16 4.47 -0.10 3.82 1.01 -1.18 0.54 120.40 129.12 2ee0 s VAL 92 Ca 0.01 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.53 2ee0 s VAL 92 Cb -0.13 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 2ee0 s VAL 92 CO 0.02 0.37 -0.18 -0.76 0.00 0.00 0.00 175.10 174.55 2ee0 s LEU 93 N -1.64 2.47 -0.20 3.92 1.43 0.75 -2.73 118.68 122.67 2ee0 s LEU 93 Ca 0.21 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 2ee0 s LEU 93 Cb -0.12 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.61 2ee0 s LEU 93 CO 0.12 0.21 -0.16 0.00 0.23 0.00 0.00 176.35 176.75 2ee0 s ALA 94 N 0.06 2.44 -0.08 4.21 0.00 -0.57 -2.65 121.76 125.18 2ee0 s ALA 94 Ca -0.07 -1.33 0.04 0.00 0.00 0.00 0.00 51.96 50.60 2ee0 s ALA 94 Cb -0.15 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 2ee0 s ALA 94 CO 0.05 -0.54 -0.22 0.45 0.00 0.00 0.00 175.76 175.50 2ee0 s SER 95 N 1.28 3.29 -0.14 0.00 0.15 -1.25 -1.49 113.70 115.53 2ee0 s SER 95 Ca 0.02 -0.48 -0.07 0.00 0.70 0.00 0.00 55.95 56.12 2ee0 s SER 95 Cb -0.15 -1.16 -0.06 0.00 -1.71 0.00 0.00 66.02 62.94 2ee0 s SER 95 CO -0.10 0.21 -0.19 -0.90 1.20 0.00 0.00 173.24 173.46 2ee0 n ASP 96 N 3.19 1.05 0.00 5.45 5.75 -1.26 -3.48 116.55 127.25 2ee0 n ASP 96 Ca -0.18 0.18 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2ee0 n ASP 96 Cb 0.52 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2ee0 n ASP 96 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ee0 n GLY 97 N 2.11 1.33 1.71 6.12 0.00 -1.26 -4.67 105.19 110.54 2ee0 n GLY 97 Ca -0.27 0.35 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 2ee0 n GLY 97 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ee0 n SER 98 N 0.00 5.34 -3.70 1.61 7.64 -1.26 -4.73 113.62 118.51 2ee0 n SER 98 Ca 0.00 -2.46 -0.19 0.00 1.01 0.00 0.00 58.87 57.24 2ee0 n SER 98 Cb 0.00 -1.24 -0.17 0.00 -1.01 0.00 0.00 64.21 61.78 2ee0 n SER 98 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ee0 s SER 99 N 1.95 0.84 0.13 6.43 0.01 -1.26 -5.12 113.70 116.68 2ee0 s SER 99 Ca 0.27 0.07 -0.25 0.00 1.31 0.00 0.00 55.95 57.35 2ee0 s SER 99 Cb 0.13 -0.13 -0.14 0.00 0.21 0.00 0.00 66.02 66.09 2ee0 s SER 99 CO -0.00 -0.21 0.52 0.41 0.41 0.00 0.00 173.24 174.36 2ee0 n THR 100 N 4.98 1.26 -2.25 1.44 -1.04 -1.26 -4.55 114.28 112.86 2ee0 n THR 100 Ca -0.10 -0.32 -0.40 0.00 -2.04 0.00 0.00 64.05 61.19 2ee0 n THR 100 Cb 0.50 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.98 2ee0 n THR 100 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2ee0 s PRO 101 N -0.63 4.46 0.42 -2.82 0.04 -1.26 -4.93 135.00 130.28 2ee0 s PRO 101 Ca 0.56 2.06 -0.08 0.00 0.04 0.00 0.00 61.00 63.58 2ee0 s PRO 101 Cb -0.81 -3.11 -0.05 0.00 0.04 0.00 0.00 34.50 30.57 2ee0 s PRO 101 CO 0.45 -0.04 0.75 0.00 0.04 0.00 0.00 177.00 178.20 2ee0 s ALA 102 N -1.15 3.40 0.03 8.56 0.00 -0.56 -4.82 121.76 127.22 2ee0 s ALA 102 Ca 0.47 -0.37 0.04 0.00 0.00 0.00 0.00 51.96 52.11 2ee0 s ALA 102 Cb -0.37 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 2ee0 s ALA 102 CO 0.48 -0.12 -0.12 -0.98 0.00 0.00 0.00 175.76 175.02 2ee0 s ARG 103 N -4.19 0.84 -0.04 0.00 1.70 -1.26 -1.51 118.95 114.49 2ee0 s ARG 103 Ca 0.49 -0.69 -0.02 0.00 -0.47 0.00 0.00 55.73 55.04 2ee0 s ARG 103 Cb -0.10 -0.81 0.03 0.00 -0.57 0.00 0.00 34.95 33.50 2ee0 s ARG 103 CO 0.37 0.20 0.05 0.00 -1.08 0.00 0.00 175.30 174.84 2ee0 s ALA 104 N -0.83 0.30 -0.12 7.88 0.00 -1.11 -4.98 121.76 122.90 2ee0 s ALA 104 Ca 0.00 0.15 -0.26 0.00 0.00 0.00 0.00 51.96 51.84 2ee0 s ALA 104 Cb -0.07 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 2ee0 s ALA 104 CO 0.01 -0.47 0.87 0.99 0.00 0.00 0.00 175.76 177.15 2ee0 s THR 105 N 2.11 4.88 -0.18 0.00 2.01 -1.20 -3.09 115.64 120.17 2ee0 s THR 105 Ca 0.05 1.75 0.00 0.00 0.31 0.00 0.00 61.69 63.79 2ee0 s THR 105 Cb -0.12 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.22 2ee0 s THR 105 CO -0.03 0.07 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.11 2ee0 s VAL 106 N 1.79 2.43 -0.27 3.82 1.01 -1.13 -3.30 120.40 124.76 2ee0 s VAL 106 Ca 0.42 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 2ee0 s VAL 106 Cb -0.18 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 2ee0 s VAL 106 CO 0.16 0.51 0.26 -0.89 0.00 0.00 0.00 175.10 175.14 2ee0 s THR 107 N 1.18 5.27 -0.32 3.92 2.01 -0.87 -3.39 115.64 123.44 2ee0 s THR 107 Ca 0.02 0.33 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 2ee0 s THR 107 Cb -0.14 -3.59 0.07 0.00 0.01 0.00 0.00 72.50 68.84 2ee0 s THR 107 CO -0.07 0.23 0.04 -0.63 -0.69 0.00 0.00 174.62 173.50 2ee0 s ILE 108 N 1.74 2.97 0.19 1.82 1.01 -1.15 -1.32 121.20 126.48 2ee0 s ILE 108 Ca 0.10 -1.59 -0.14 0.00 0.00 0.00 0.00 60.65 59.03 2ee0 s ILE 108 Cb -0.16 -2.81 -0.07 0.00 0.01 0.00 0.00 42.46 39.43 2ee0 s ILE 108 CO 0.10 -0.25 0.59 0.20 0.00 0.00 0.00 174.94 175.57 2ee0 s ASN 109 N 1.34 6.79 -0.26 3.58 0.01 -0.01 -2.41 114.94 123.97 2ee0 s ASN 109 Ca -0.02 1.09 -0.05 0.00 -0.71 0.00 0.00 52.86 53.17 2ee0 s ASN 109 Cb -0.20 -2.29 0.00 0.00 0.41 0.00 0.00 41.25 39.17 2ee0 s ASN 109 CO -0.02 0.02 0.03 -0.69 -1.51 0.00 0.00 177.10 174.92 2ee0 s VAL 110 N -1.62 3.72 0.52 1.60 1.01 -1.19 -1.34 120.40 123.10 2ee0 s VAL 110 Ca 0.43 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2ee0 s VAL 110 Cb -0.14 -2.82 0.04 0.00 0.00 0.00 0.00 36.38 33.46 2ee0 s VAL 110 CO 0.20 0.23 0.71 0.42 0.00 0.00 0.00 175.10 176.66 2ee0 s THR 111 N 1.49 2.69 0.56 3.92 -4.23 -1.14 -4.93 115.64 114.00 2ee0 s THR 111 Ca 0.04 -0.83 -0.12 0.00 -1.18 0.00 0.00 61.69 59.59 2ee0 s THR 111 Cb -0.16 -2.85 -0.05 0.00 1.34 0.00 0.00 72.50 70.77 2ee0 s THR 111 CO 0.00 0.00 0.98 -0.62 -0.54 0.00 0.00 174.62 174.44 2ee0 s ASP 112 N -4.45 6.37 -0.22 3.99 2.15 -1.26 -3.53 116.67 119.72 2ee0 s ASP 112 Ca 0.58 1.41 0.02 0.00 0.43 0.00 0.00 52.55 54.98 2ee0 s ASP 112 Cb -0.09 -2.45 0.04 0.00 -0.30 0.00 0.00 42.92 40.12 2ee0 s ASP 112 CO 0.37 -0.73 -0.14 0.68 -0.17 0.00 0.00 175.17 175.18 2ee0 s VAL 113 N -2.92 2.02 -1.77 1.11 -7.23 -1.26 -4.90 120.40 105.45 2ee0 s VAL 113 Ca 0.55 -1.25 0.14 0.00 -1.81 0.00 0.00 61.98 59.61 2ee0 s VAL 113 Cb -0.11 -2.01 0.11 0.00 0.56 0.00 0.00 36.38 34.94 2ee0 s VAL 113 CO 0.45 0.22 0.95 -3.20 -0.31 0.00 0.00 175.10 173.21