#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee0 n SER 2 N 0.00 0.27 -4.55 1.61 2.88 -1.26 -4.99 113.62 107.57 2ee0 n SER 2 Ca 0.00 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.21 2ee0 n SER 2 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2ee0 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ee0 s SER 3 N -4.74 4.90 0.01 -3.46 0.15 -1.26 -4.95 113.70 104.35 2ee0 s SER 3 Ca 0.00 0.28 -0.08 0.00 0.70 0.00 0.00 55.95 56.85 2ee0 s SER 3 Cb 0.00 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.73 2ee0 s SER 3 CO 0.00 -2.73 0.30 -0.83 1.20 0.00 0.00 173.24 171.19 2ee0 s GLY 4 N 9.35 2.29 0.14 9.45 0.00 -1.26 -5.10 107.32 122.19 2ee0 s GLY 4 Ca 0.77 -0.49 -0.01 0.00 0.00 0.00 0.00 44.72 45.00 2ee0 s GLY 4 CO 0.16 -0.26 0.05 -0.56 0.00 0.00 0.00 173.10 172.49 2ee0 s SER 5 N -1.55 0.42 -0.33 1.64 0.01 -1.26 -5.14 113.70 107.48 2ee0 s SER 5 Ca 0.27 -1.21 -0.09 0.00 1.31 0.00 0.00 55.95 56.23 2ee0 s SER 5 Cb -0.14 0.28 0.01 0.00 0.21 0.00 0.00 66.02 66.38 2ee0 s SER 5 CO 0.15 -0.71 0.15 -0.44 0.41 0.00 0.00 173.24 172.80 2ee0 s SER 6 N -3.07 5.49 -0.13 2.44 0.01 -1.26 -5.08 113.70 112.11 2ee0 s SER 6 Ca 0.24 -0.79 -0.14 0.00 1.31 0.00 0.00 55.95 56.57 2ee0 s SER 6 Cb 0.07 -1.97 -0.05 0.00 0.21 0.00 0.00 66.02 64.29 2ee0 s SER 6 CO 0.02 -0.27 0.33 -0.83 0.41 0.00 0.00 173.24 172.90 2ee0 s GLY 7 N 1.54 2.27 -0.10 3.44 0.00 -1.26 -5.01 107.32 108.21 2ee0 s GLY 7 Ca 0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 44.72 44.35 2ee0 s GLY 7 CO 0.05 0.39 -0.01 3.43 0.00 0.00 0.00 173.10 176.96 2ee0 h ASN 8 N 6.28 0.00 -3.75 1.64 2.35 -2.09 -3.47 115.58 116.55 2ee0 h ASN 8 Ca -0.44 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 54.83 2ee0 h ASN 8 Cb 1.18 0.00 -0.32 0.00 0.05 0.00 0.00 38.32 39.23 2ee0 h ASN 8 CO 0.72 0.49 -0.81 -1.81 -1.65 0.00 0.00 177.43 174.38 2ee0 s ASP 9 N -5.46 1.56 -0.28 5.81 1.01 -1.26 -5.12 116.67 112.94 2ee0 s ASP 9 Ca -0.01 -0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.01 2ee0 s ASP 9 Cb 0.00 -0.50 0.08 0.00 1.01 0.00 0.00 42.92 43.51 2ee0 s ASP 9 CO 0.01 0.08 0.01 0.20 0.21 0.00 0.00 175.17 175.68 2ee0 s ASN 10 N 0.27 4.11 -0.08 0.27 0.01 -1.26 -5.10 114.94 113.15 2ee0 s ASN 10 Ca -0.06 -1.52 -0.10 0.00 -0.71 0.00 0.00 52.86 50.47 2ee0 s ASN 10 Cb -0.11 -1.21 0.02 0.00 0.41 0.00 0.00 41.25 40.36 2ee0 s ASN 10 CO 0.01 -0.31 0.27 0.00 -1.51 0.00 0.00 177.10 175.57 2ee0 s ARG 11 N 1.33 0.39 1.21 -0.60 1.70 -1.26 -4.86 118.95 116.86 2ee0 s ARG 11 Ca 0.02 0.24 -0.19 0.00 -0.47 0.00 0.00 55.73 55.33 2ee0 s ARG 11 Cb -0.19 0.18 0.29 0.00 -0.57 0.00 0.00 34.95 34.67 2ee0 s ARG 11 CO -0.11 -0.07 1.11 -1.25 -1.08 0.00 0.00 175.30 173.91 2ee0 s PRO 12 N -0.18 -1.28 -0.20 3.89 0.04 -1.26 -4.94 135.00 131.07 2ee0 s PRO 12 Ca -0.03 -0.09 -0.27 0.00 0.04 0.00 0.00 61.00 60.65 2ee0 s PRO 12 Cb -0.03 -1.59 0.07 0.00 0.04 0.00 0.00 34.50 32.99 2ee0 s PRO 12 CO 0.01 -3.75 0.72 0.54 0.04 0.00 0.00 177.00 174.56 2ee0 s VAL 13 N -3.01 0.00 0.52 -0.36 0.11 -1.26 -4.86 120.40 111.53 2ee0 s VAL 13 Ca 0.71 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.75 2ee0 s VAL 13 Cb -0.09 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.77 2ee0 s VAL 13 CO 0.56 0.00 0.76 -0.36 -3.33 0.00 0.00 175.10 172.73 2ee0 s PHE 14 N -0.17 3.15 0.05 1.54 0.08 -1.26 -4.18 117.98 117.18 2ee0 s PHE 14 Ca -0.04 0.30 -0.27 0.00 0.12 0.00 0.00 56.93 57.04 2ee0 s PHE 14 Cb -0.03 -2.54 -0.17 0.00 -0.57 0.00 0.00 43.02 39.71 2ee0 s PHE 14 CO 0.04 -0.62 1.47 -0.22 -0.10 0.00 0.00 175.22 175.79 2ee0 h LYS 15 N 0.15 -0.47 -2.66 0.44 1.63 -1.94 -3.43 116.57 110.29 2ee0 h LYS 15 Ca -0.45 0.03 -0.29 0.00 -0.85 0.00 0.00 60.65 59.10 2ee0 h LYS 15 Cb 1.26 0.11 -0.35 0.00 -0.60 0.00 0.00 32.23 32.65 2ee0 h LYS 15 CO 0.57 -0.22 -0.60 -1.21 -3.45 0.00 0.00 179.45 174.54 2ee0 s GLU 16 N -5.44 0.16 0.23 1.90 2.02 -1.26 -5.04 118.70 111.27 2ee0 s GLU 16 Ca -0.15 0.39 -0.16 0.00 0.02 0.00 0.00 54.97 55.07 2ee0 s GLU 16 Cb 0.03 -0.78 0.27 0.00 0.10 0.00 0.00 34.13 33.75 2ee0 s GLU 16 CO 0.60 -0.52 1.50 0.41 0.02 0.00 0.00 175.26 177.27 2ee0 n GLY 17 N 5.33 -1.94 3.24 -1.39 0.00 -1.26 -4.22 105.19 104.94 2ee0 n GLY 17 Ca -0.05 1.08 -0.32 0.00 0.00 0.00 0.00 46.02 46.72 2ee0 n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ee0 s GLN 18 N -5.96 3.10 -0.05 1.61 1.11 -1.26 -1.33 119.66 116.88 2ee0 s GLN 18 Ca -0.14 -0.85 -0.00 0.00 0.01 0.00 0.00 55.36 54.38 2ee0 s GLN 18 Cb 0.21 -2.36 0.03 0.00 -1.01 0.00 0.00 33.01 29.88 2ee0 s GLN 18 CO 0.70 0.18 0.00 0.08 0.01 0.00 0.00 175.29 176.26 2ee0 s VAL 19 N 0.36 0.26 0.21 1.09 1.01 -1.22 -5.01 120.40 117.10 2ee0 s VAL 19 Ca -0.17 0.11 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 2ee0 s VAL 19 Cb -0.18 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.77 2ee0 s VAL 19 CO 0.08 0.20 0.44 -0.70 0.00 0.00 0.00 175.10 175.12 2ee0 s GLU 20 N 1.44 3.61 0.19 2.72 2.12 -1.26 -2.02 118.70 125.49 2ee0 s GLU 20 Ca -0.04 -0.12 -0.13 0.00 0.36 0.00 0.00 54.97 55.05 2ee0 s GLU 20 Cb -0.13 -2.78 0.01 0.00 0.26 0.00 0.00 34.13 31.49 2ee0 s GLU 20 CO -0.03 0.37 0.41 0.14 -0.54 0.00 0.00 175.26 175.62 2ee0 s VAL 21 N -1.85 0.04 -0.12 3.70 -7.23 -1.06 -5.00 120.40 108.88 2ee0 s VAL 21 Ca 0.41 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.44 2ee0 s VAL 21 Cb -0.11 -1.80 0.02 0.00 0.56 0.00 0.00 36.38 35.05 2ee0 s VAL 21 CO 0.27 -0.18 -0.12 -1.38 -0.31 0.00 0.00 175.10 173.38 2ee0 s HIS 22 N -3.94 1.86 -0.08 2.82 -3.43 -1.26 -2.29 115.29 108.97 2ee0 s HIS 22 Ca 0.15 -0.95 -0.06 0.00 -0.80 0.00 0.00 55.06 53.40 2ee0 s HIS 22 Cb 0.01 -1.40 0.03 0.00 -1.43 0.00 0.00 32.58 29.78 2ee0 s HIS 22 CO 0.00 -0.54 0.21 -1.50 -2.00 0.00 0.00 174.74 170.91 2ee0 s ILE 23 N 1.37 -0.02 0.81 -5.38 2.07 -1.13 -5.02 121.20 113.90 2ee0 s ILE 23 Ca 0.01 0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.20 2ee0 s ILE 23 Cb -0.13 -0.31 0.08 0.00 0.13 0.00 0.00 42.46 42.22 2ee0 s ILE 23 CO -0.07 0.02 1.09 -2.16 -1.91 0.00 0.00 174.94 171.92 2ee0 s PRO 24 N 0.54 1.96 0.18 3.50 0.04 -1.26 -2.05 135.00 137.91 2ee0 s PRO 24 Ca -0.04 1.07 -0.04 0.00 0.04 0.00 0.00 61.00 62.04 2ee0 s PRO 24 Cb -0.05 -1.87 0.09 0.00 0.04 0.00 0.00 34.50 32.71 2ee0 s PRO 24 CO -0.03 -1.82 1.49 1.05 0.04 0.00 0.00 177.00 177.73 2ee0 h GLU 25 N -1.25 0.56 -0.80 4.56 4.11 -1.66 -2.90 114.58 117.20 2ee0 h GLU 25 Ca -0.45 -0.37 -0.03 0.00 0.07 0.00 0.00 59.36 58.58 2ee0 h GLU 25 Cb 1.25 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 2ee0 h GLU 25 CO 0.52 0.98 0.03 -1.71 0.07 0.00 0.00 179.01 178.91 2ee0 n ASN 26 N -3.95 3.51 -4.60 3.06 5.15 -1.26 -1.79 115.26 115.39 2ee0 n ASN 26 Ca -0.03 -2.53 -0.43 0.00 -0.60 0.00 0.00 54.58 50.99 2ee0 n ASN 26 Cb 0.62 -0.61 0.00 0.00 -0.53 0.00 0.00 39.78 39.26 2ee0 n ASN 26 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ee0 n ALA 27 N 0.26 -0.01 -2.20 5.20 0.00 -1.10 -4.89 120.51 117.78 2ee0 n ALA 27 Ca 0.16 0.29 -0.42 0.00 0.00 0.00 0.00 53.44 53.47 2ee0 n ALA 27 Cb 0.79 -2.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 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 -1.81 4.32 0.30 0.00 0.04 -1.26 -4.77 135.00 131.82 2ee0 s PRO 28 Ca 0.61 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 63.39 2ee0 s PRO 28 Cb -0.61 -3.30 -0.12 0.00 0.04 0.00 0.00 34.50 30.50 2ee0 s PRO 28 CO 0.58 -0.44 1.43 0.28 0.04 0.00 0.00 177.00 178.89 2ee0 n VAL 29 N 4.05 1.43 0.00 -0.36 0.31 -1.26 -2.59 118.33 119.90 2ee0 n VAL 29 Ca 0.11 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2ee0 n VAL 29 Cb 0.43 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 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 1.51 0.47 3.73 2.92 0.00 -0.66 -5.00 105.19 108.17 2ee0 n GLY 30 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 3.73 -0.39 2.61 2.01 -1.07 -4.74 115.64 115.78 2ee0 s THR 31 Ca 0.00 1.43 -0.29 0.00 0.31 0.00 0.00 61.69 63.15 2ee0 s THR 31 Cb 0.00 -3.92 0.01 0.00 0.01 0.00 0.00 72.50 68.61 2ee0 s THR 31 CO 0.00 0.22 1.30 -0.94 -0.69 0.00 0.00 174.62 174.51 2ee0 s SER 32 N 0.17 6.54 -0.06 3.53 1.04 -1.26 -2.32 113.70 121.34 2ee0 s SER 32 Ca 0.52 0.87 -0.02 0.00 0.48 0.00 0.00 55.95 57.80 2ee0 s SER 32 Cb -0.31 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.26 2ee0 s SER 32 CO 0.35 -1.26 -0.04 0.58 0.98 0.00 0.00 173.24 173.85 2ee0 h VAL 33 N 6.22 0.00 -3.71 5.02 2.07 -1.87 -3.49 116.25 120.50 2ee0 h VAL 33 Ca -0.26 -0.47 -0.27 0.00 0.82 0.00 0.00 66.70 66.52 2ee0 h VAL 33 Cb 1.09 0.00 -0.30 0.00 -1.52 0.00 0.00 31.29 30.56 2ee0 h VAL 33 CO 1.08 0.00 -0.73 -0.51 0.02 0.00 0.00 177.57 177.43 2ee0 s ILE 34 N -1.41 0.10 -0.26 4.57 1.10 -1.21 -5.01 121.20 119.07 2ee0 s ILE 34 Ca -0.03 -0.00 0.01 0.00 -0.51 0.00 0.00 60.65 60.12 2ee0 s ILE 34 Cb 0.00 -0.12 0.05 0.00 0.15 0.00 0.00 42.46 42.55 2ee0 s ILE 34 CO 0.05 0.05 -0.09 -1.58 -2.11 0.00 0.00 174.94 171.27 2ee0 s GLN 35 N 0.25 2.39 -0.20 3.50 0.74 -1.26 -1.27 119.66 123.80 2ee0 s GLN 35 Ca -0.02 -1.26 -0.12 0.00 0.05 0.00 0.00 55.36 54.01 2ee0 s GLN 35 Cb -0.04 -2.94 -0.05 0.00 1.10 0.00 0.00 33.01 31.08 2ee0 s GLN 35 CO -0.01 -0.54 0.23 -0.51 -0.55 0.00 0.00 175.29 173.91 2ee0 s LEU 36 N 1.17 4.17 -0.26 3.68 1.43 -0.93 -4.98 118.68 122.97 2ee0 s LEU 36 Ca -0.06 0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.37 2ee0 s LEU 36 Cb -0.19 -2.25 0.06 0.00 0.03 0.00 0.00 46.19 43.84 2ee0 s LEU 36 CO -0.05 0.07 -0.08 -2.28 0.23 0.00 0.00 176.35 174.24 2ee0 s HIS 37 N 0.81 3.06 -0.21 0.29 2.46 -1.26 -4.57 115.29 115.87 2ee0 s HIS 37 Ca 0.12 -2.22 -0.02 0.00 0.47 0.00 0.00 55.06 53.42 2ee0 s HIS 37 Cb -0.13 -1.90 0.06 0.00 -0.13 0.00 0.00 32.58 30.48 2ee0 s HIS 37 CO 0.04 -0.86 0.00 0.00 -2.47 0.00 0.00 174.74 171.45 2ee0 s ALA 38 N 1.17 1.34 0.14 1.58 0.00 -1.26 -3.95 121.76 120.78 2ee0 s ALA 38 Ca -0.07 -0.92 0.10 0.00 0.00 0.00 0.00 51.96 51.07 2ee0 s ALA 38 Cb -0.20 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.62 2ee0 s ALA 38 CO -0.06 -1.18 -0.22 0.95 0.00 0.00 0.00 175.76 175.26 2ee0 s THR 39 N 1.70 2.00 -0.01 0.00 -4.23 -1.26 -4.85 115.64 108.99 2ee0 s THR 39 Ca -0.03 -1.79 0.05 0.00 -1.18 0.00 0.00 61.69 58.74 2ee0 s THR 39 Cb -0.18 -1.85 -0.03 0.00 1.34 0.00 0.00 72.50 71.79 2ee0 s THR 39 CO -0.07 -0.10 -0.14 -0.62 -0.54 0.00 0.00 174.62 173.15 2ee0 s ASP 40 N -2.29 4.09 -0.74 3.99 2.15 -1.26 -4.38 116.67 118.24 2ee0 s ASP 40 Ca 0.13 -0.25 -0.33 0.00 0.43 0.00 0.00 52.55 52.53 2ee0 s ASP 40 Cb -0.09 -0.83 -0.17 0.00 -0.30 0.00 0.00 42.92 41.53 2ee0 s ASP 40 CO 0.06 0.31 2.49 0.00 -0.17 0.00 0.00 175.17 177.86 2ee0 n ALA 41 N 1.91 0.47 -1.64 3.66 0.00 -1.26 -4.76 120.51 118.90 2ee0 n ALA 41 Ca -0.16 -0.28 -0.37 0.00 0.00 0.00 0.00 53.44 52.62 2ee0 n ALA 41 Cb 0.52 -2.44 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 2ee0 n ALA 41 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ee0 n ASP 42 N 10.84 2.97 -4.48 0.00 9.92 -1.26 -4.89 116.55 129.65 2ee0 n ASP 42 Ca 0.56 -2.71 -0.43 0.00 -0.53 0.00 0.00 54.79 51.67 2ee0 n ASP 42 Cb 0.13 -1.43 -0.06 0.00 -0.64 0.00 0.00 41.12 39.12 2ee0 n ASP 42 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 2ee0 s ILE 43 N 7.30 4.81 0.00 0.53 -4.36 -1.26 -4.54 121.20 123.68 2ee0 s ILE 43 Ca 0.61 -0.22 0.00 0.00 -0.26 0.00 0.00 60.65 60.78 2ee0 s ILE 43 Cb 0.08 -4.29 0.00 0.00 1.25 0.00 0.00 42.46 39.50 2ee0 s ILE 43 CO 0.11 -0.77 0.00 0.61 0.24 0.00 0.00 174.94 175.14 2ee0 n GLY 44 N 5.12 2.20 3.37 6.27 0.00 -1.26 -4.95 105.19 115.95 2ee0 n GLY 44 Ca -0.04 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.25 2ee0 n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ee0 s SER 45 N 0.00 2.74 0.67 1.61 1.04 -1.26 -5.01 113.70 113.50 2ee0 s SER 45 Ca 0.00 -1.03 -0.14 0.00 0.48 0.00 0.00 55.95 55.25 2ee0 s SER 45 Cb 0.00 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.96 2ee0 s SER 45 CO 0.00 -0.15 1.10 0.54 0.98 0.00 0.00 173.24 175.71 2ee0 s ASN 46 N -3.36 5.04 -0.24 7.02 4.22 -1.26 -4.69 114.94 121.68 2ee0 s ASN 46 Ca 0.24 1.96 -0.01 0.00 -2.14 0.00 0.00 52.86 52.92 2ee0 s ASN 46 Cb -0.01 -2.55 0.03 0.00 1.28 0.00 0.00 41.25 40.01 2ee0 s ASN 46 CO 0.08 -1.67 -0.09 0.00 -2.04 0.00 0.00 177.10 173.38 2ee0 s ALA 47 N -2.44 2.63 -1.03 3.54 0.00 -1.26 -5.05 121.76 118.14 2ee0 s ALA 47 Ca 0.66 -1.49 -0.15 0.00 0.00 0.00 0.00 51.96 50.98 2ee0 s ALA 47 Cb -0.20 -1.61 0.18 0.00 0.00 0.00 0.00 23.12 21.49 2ee0 s ALA 47 CO 0.44 -0.82 1.18 -1.21 0.00 0.00 0.00 175.76 175.34 2ee0 s GLU 48 N 1.28 3.85 0.02 0.00 8.01 -1.26 -4.94 118.70 125.66 2ee0 s GLU 48 Ca -0.01 -2.34 -0.30 0.00 0.01 0.00 0.00 54.97 52.32 2ee0 s GLU 48 Cb -0.17 -4.85 -0.07 0.00 -4.31 0.00 0.00 34.13 24.74 2ee0 s GLU 48 CO -0.06 -1.63 1.61 0.42 0.01 0.00 0.00 175.26 175.62 2ee0 s ILE 49 N 1.40 3.32 -0.24 -1.63 -1.09 -1.26 -4.92 121.20 116.77 2ee0 s ILE 49 Ca 0.34 0.65 -0.03 0.00 -2.23 0.00 0.00 60.65 59.37 2ee0 s ILE 49 Cb -0.06 -3.42 0.01 0.00 -1.58 0.00 0.00 42.46 37.41 2ee0 s ILE 49 CO -0.06 -0.02 -0.03 -0.13 -1.23 0.00 0.00 174.94 173.47 2ee0 s ARG 50 N 3.04 3.12 0.05 2.79 1.81 -1.26 -4.54 118.95 123.95 2ee0 s ARG 50 Ca 0.72 -0.80 -0.24 0.00 -1.72 0.00 0.00 55.73 53.70 2ee0 s ARG 50 Cb -0.36 -3.06 -0.06 0.00 -0.45 0.00 0.00 34.95 31.02 2ee0 s ARG 50 CO 0.31 -0.32 0.71 0.71 -0.68 0.00 0.00 175.30 176.03 2ee0 s TYR 51 N 1.42 3.74 0.12 -0.53 1.51 -1.23 -4.22 117.35 118.17 2ee0 s TYR 51 Ca 0.03 1.41 0.01 0.00 -1.01 0.00 0.00 57.07 57.50 2ee0 s TYR 51 Cb -0.16 -2.74 -0.04 0.00 -0.11 0.00 0.00 41.96 38.91 2ee0 s TYR 51 CO -0.03 0.34 -0.00 0.96 -1.11 0.00 0.00 175.55 175.70 2ee0 s ILE 52 N -0.26 0.45 -0.17 2.71 -5.25 -1.14 -4.24 121.20 113.30 2ee0 s ILE 52 Ca 0.36 -1.92 -0.29 0.00 -0.99 0.00 0.00 60.65 57.80 2ee0 s ILE 52 Cb -0.20 -1.90 -0.02 0.00 2.95 0.00 0.00 42.46 43.29 2ee0 s ILE 52 CO 0.22 -0.65 1.32 -0.36 -1.79 0.00 0.00 174.94 173.67 2ee0 s PHE 53 N -3.80 2.72 0.68 1.37 0.08 -1.26 -2.54 117.98 115.23 2ee0 s PHE 53 Ca 0.18 0.89 -0.10 0.00 0.12 0.00 0.00 56.93 58.02 2ee0 s PHE 53 Cb 0.07 -3.60 0.16 0.00 -0.57 0.00 0.00 43.02 39.08 2ee0 s PHE 53 CO -0.01 -1.97 0.37 0.41 -0.10 0.00 0.00 175.22 173.92 2ee0 n GLY 54 N 3.76 -3.05 3.85 4.36 0.00 -0.54 -4.92 105.19 108.65 2ee0 n GLY 54 Ca 0.14 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.05 3.22 -1.04 4.61 0.00 -1.26 -4.26 121.76 120.99 2ee0 s ALA 55 Ca 0.29 0.03 -0.02 0.00 0.00 0.00 0.00 51.96 52.26 2ee0 s ALA 55 Cb -0.05 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 2ee0 s ALA 55 CO 0.24 -0.01 0.88 1.04 0.00 0.00 0.00 175.76 177.91 2ee0 n GLN 56 N -1.15 -4.47 -4.08 0.00 1.13 -1.26 -4.98 117.38 102.57 2ee0 n GLN 56 Ca 0.04 0.78 -0.32 0.00 -1.94 0.00 0.00 57.00 55.56 2ee0 n GLN 56 Cb 0.54 -5.51 -0.16 0.00 0.11 0.00 0.00 30.24 25.22 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 -3.34 1.88 0.61 5.09 1.01 -1.26 -5.01 120.40 119.38 2ee0 s VAL 57 Ca 0.16 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 61.11 2ee0 s VAL 57 Cb -0.02 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2ee0 s VAL 57 CO 0.67 0.49 1.23 0.00 0.00 0.00 0.00 175.10 177.49 2ee0 s ALA 58 N 1.36 2.48 -0.02 5.51 0.00 -1.26 -4.97 121.76 124.86 2ee0 s ALA 58 Ca 0.05 1.06 -0.25 0.00 0.00 0.00 0.00 51.96 52.81 2ee0 s ALA 58 Cb -0.13 -3.48 -0.20 0.00 0.00 0.00 0.00 23.12 19.31 2ee0 s ALA 58 CO -0.12 -1.31 1.23 -1.00 0.00 0.00 0.00 175.76 174.56 2ee0 h PRO 59 N 0.73 -0.05 -0.94 0.00 0.13 -2.00 -3.28 132.00 126.59 2ee0 h PRO 59 Ca -0.50 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 64.80 2ee0 h PRO 59 Cb 1.31 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.28 2ee0 h PRO 59 CO 0.54 0.42 -0.28 0.00 -0.23 0.00 0.00 178.00 178.45 2ee0 h ALA 60 N 0.39 0.47 -0.87 -0.56 0.00 -1.99 1.06 119.26 117.76 2ee0 h ALA 60 Ca -0.01 0.33 0.14 0.00 0.00 0.00 0.00 54.91 55.38 2ee0 h ALA 60 Cb 0.49 0.80 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 2ee0 h ALA 60 CO 0.01 -0.46 0.56 1.15 0.00 0.00 0.00 179.25 180.51 2ee0 h THR 61 N -0.01 0.83 -0.14 0.00 2.02 -1.95 -1.30 112.91 112.36 2ee0 h THR 61 Ca 0.42 -0.22 -0.14 0.00 0.77 0.00 0.00 66.41 67.23 2ee0 h THR 61 Cb 0.66 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2ee0 h THR 61 CO -0.96 0.12 -0.46 0.11 0.37 0.00 0.00 175.52 174.69 2ee0 h LYS 62 N 0.64 0.56 -0.92 6.66 1.57 0.10 0.15 116.57 125.33 2ee0 h LYS 62 Ca 0.44 -0.42 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 2ee0 h LYS 62 Cb 0.75 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 33.04 2ee0 h LYS 62 CO -0.19 1.04 0.55 -0.09 -0.57 0.00 0.00 179.45 180.19 2ee0 h ARG 63 N 0.20 0.81 0.01 3.15 9.65 0.11 -2.91 114.38 125.41 2ee0 h ARG 63 Ca -0.02 -0.05 -0.09 0.00 -1.10 0.00 0.00 59.98 58.72 2ee0 h ARG 63 Cb 1.09 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.48 2ee0 h ARG 63 CO 0.10 0.54 -0.47 -0.07 2.80 0.00 0.00 179.97 182.87 2ee0 h LEU 64 N 0.84 0.04 -9.09 3.80 3.38 -1.40 -3.42 115.31 109.45 2ee0 h LEU 64 Ca 0.47 -0.85 -0.61 0.00 0.09 0.00 0.00 57.88 56.99 2ee0 h LEU 64 Cb 0.54 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.16 2ee0 h LEU 64 CO -0.30 1.19 -0.19 -0.36 0.09 0.00 0.00 178.44 178.88 2ee0 s PHE 65 N -2.28 3.34 -0.25 1.13 0.08 0.51 -0.52 117.98 120.00 2ee0 s PHE 65 Ca -0.22 0.59 -0.09 0.00 0.12 0.00 0.00 56.93 57.33 2ee0 s PHE 65 Cb 0.00 -2.55 -0.04 0.00 -0.57 0.00 0.00 43.02 39.86 2ee0 s PHE 65 CO 0.67 -0.07 0.12 0.00 -0.10 0.00 0.00 175.22 175.85 2ee0 s ALA 66 N 1.51 3.39 -0.07 5.36 0.00 -1.16 -4.25 121.76 126.54 2ee0 s ALA 66 Ca 0.19 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.02 2ee0 s ALA 66 Cb -0.15 -2.22 -0.05 0.00 0.00 0.00 0.00 23.12 20.70 2ee0 s ALA 66 CO 0.08 -0.36 0.28 -1.17 0.00 0.00 0.00 175.76 174.60 2ee0 s LEU 67 N 1.38 4.41 -0.16 0.00 2.96 -1.26 -3.25 118.68 122.77 2ee0 s LEU 67 Ca 0.06 0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 54.60 2ee0 s LEU 67 Cb -0.15 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 2ee0 s LEU 67 CO 0.06 0.34 0.09 0.20 -1.32 0.00 0.00 176.35 175.72 2ee0 s ASN 68 N -0.89 5.95 0.00 3.68 -0.87 -1.25 -4.98 114.94 116.58 2ee0 s ASN 68 Ca 0.19 0.24 0.22 0.00 -1.57 0.00 0.00 52.86 51.94 2ee0 s ASN 68 Cb -0.14 -1.96 0.54 0.00 -0.02 0.00 0.00 41.25 39.66 2ee0 s ASN 68 CO 0.08 0.27 1.45 0.59 -2.57 0.00 0.00 177.10 176.92 2ee0 n ASN 69 N 2.89 2.79 -0.01 -1.22 4.13 -1.26 -1.46 115.26 121.13 2ee0 n ASN 69 Ca -0.18 -1.90 -0.01 0.00 1.68 0.00 0.00 54.58 54.17 2ee0 n ASN 69 Cb 0.53 -0.21 -0.01 0.00 -1.54 0.00 0.00 39.78 38.55 2ee0 n ASN 69 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2ee0 n THR 70 N 1.06 0.10 0.00 3.41 -2.24 -1.26 -3.48 114.28 111.87 2ee0 n THR 70 Ca 0.18 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2ee0 n THR 70 Cb 0.50 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 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 -1.99 0.00 -3.22 4.28 -2.24 -1.26 -5.01 114.28 104.84 2ee0 n THR 71 Ca -0.02 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 2ee0 n THR 71 Cb 0.48 0.50 0.05 0.00 -2.10 0.00 0.00 70.33 69.26 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 2.13 -0.53 3.31 3.38 0.00 -0.54 -4.71 105.19 108.23 2ee0 n GLY 72 Ca 0.00 0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 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 -6.90 2.81 -0.19 0.99 2.96 -1.26 -2.18 118.68 114.91 2ee0 s LEU 73 Ca 0.40 -0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 53.67 2ee0 s LEU 73 Cb -0.18 -1.70 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 2ee0 s LEU 73 CO 0.50 0.02 0.78 -0.63 -1.32 0.00 0.00 176.35 175.69 2ee0 s ILE 74 N 1.25 4.91 0.12 6.68 1.01 -0.40 -3.93 121.20 130.84 2ee0 s ILE 74 Ca 0.03 1.51 0.07 0.00 0.00 0.00 0.00 60.65 62.26 2ee0 s ILE 74 Cb -0.14 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 2ee0 s ILE 74 CO -0.03 0.03 -0.18 0.42 0.00 0.00 0.00 174.94 175.19 2ee0 s THR 75 N 2.18 1.58 0.04 2.92 -4.23 -1.20 -2.51 115.64 114.41 2ee0 s THR 75 Ca 0.35 -1.65 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 2ee0 s THR 75 Cb -0.16 -1.56 -0.08 0.00 1.34 0.00 0.00 72.50 72.04 2ee0 s THR 75 CO 0.11 -0.23 1.66 -0.69 -0.54 0.00 0.00 174.62 174.93 2ee0 s VAL 76 N -1.63 3.16 -0.08 2.29 1.01 -0.98 -3.01 120.40 121.16 2ee0 s VAL 76 Ca 0.08 0.53 0.11 0.00 0.00 0.00 0.00 61.98 62.71 2ee0 s VAL 76 Cb -0.08 -3.34 -0.16 0.00 0.00 0.00 0.00 36.38 32.80 2ee0 s VAL 76 CO 0.04 -0.01 0.13 1.67 0.00 0.00 0.00 175.10 176.94 2ee0 n GLN 77 N 5.93 1.41 -3.98 2.72 7.27 0.33 -1.66 117.38 129.40 2ee0 n GLN 77 Ca 0.16 -0.05 -0.08 0.00 0.07 0.00 0.00 57.00 57.10 2ee0 n GLN 77 Cb 0.41 -1.30 -0.08 0.00 2.41 0.00 0.00 30.24 31.68 2ee0 n GLN 77 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2ee0 s ARG 78 N -2.52 0.82 -0.02 3.69 1.81 -1.11 -4.96 118.95 116.66 2ee0 s ARG 78 Ca -0.05 -1.13 -0.30 0.00 -1.72 0.00 0.00 55.73 52.53 2ee0 s ARG 78 Cb 0.05 0.29 -0.07 0.00 -0.45 0.00 0.00 34.95 34.78 2ee0 s ARG 78 CO 0.50 -0.23 1.75 -1.12 -0.68 0.00 0.00 175.30 175.52 2ee0 s SER 79 N -2.92 6.59 0.36 0.23 0.01 -1.26 -4.93 113.70 111.78 2ee0 s SER 79 Ca 0.09 2.39 -0.26 0.00 1.31 0.00 0.00 55.95 59.49 2ee0 s SER 79 Cb 0.06 -2.53 -0.09 0.00 0.21 0.00 0.00 66.02 63.66 2ee0 s SER 79 CO -0.08 -0.96 1.07 -0.76 0.41 0.00 0.00 173.24 172.92 2ee0 s LEU 80 N 4.08 4.29 -0.12 2.44 1.43 -0.74 -5.02 118.68 125.03 2ee0 s LEU 80 Ca 0.78 2.14 0.03 0.00 -1.03 0.00 0.00 54.13 56.05 2ee0 s LEU 80 Cb -0.37 -3.98 0.01 0.00 0.03 0.00 0.00 46.19 41.88 2ee0 s LEU 80 CO 0.34 -0.38 -0.22 -1.81 0.23 0.00 0.00 176.35 174.50 2ee0 s ASP 81 N -1.30 3.05 -0.07 2.29 1.01 -1.26 -4.12 116.67 116.27 2ee0 s ASP 81 Ca 0.53 -0.58 -0.18 0.00 0.71 0.00 0.00 52.55 53.03 2ee0 s ASP 81 Cb -0.26 -1.41 -0.30 0.00 1.01 0.00 0.00 42.92 41.97 2ee0 s ASP 81 CO 0.33 0.10 0.74 -0.09 0.21 0.00 0.00 175.17 176.46 2ee0 h ARG 82 N 7.14 0.29 -1.16 8.23 2.43 -1.92 -3.01 114.38 126.37 2ee0 h ARG 82 Ca -0.28 -0.50 0.43 0.00 -0.81 0.00 0.00 59.98 58.82 2ee0 h ARG 82 Cb 1.20 0.19 -0.16 0.00 -0.42 0.00 0.00 29.97 30.78 2ee0 h ARG 82 CO 0.52 1.24 0.70 1.05 -1.51 0.00 0.00 179.97 181.97 2ee0 h GLU 83 N -0.30 0.06 0.00 0.20 4.11 -1.98 -2.38 114.58 114.29 2ee0 h GLU 83 Ca -0.23 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.20 2ee0 h GLU 83 Cb 1.74 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.98 2ee0 h GLU 83 CO 0.12 0.04 -0.15 1.49 0.07 0.00 0.00 179.01 180.58 2ee0 h GLU 84 N 0.06 0.00 -4.52 1.06 4.22 -2.01 -3.47 114.58 109.92 2ee0 h GLU 84 Ca 0.84 0.00 -0.56 0.00 0.08 0.00 0.00 59.36 59.71 2ee0 h GLU 84 Cb 2.39 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 31.29 2ee0 h GLU 84 CO -0.60 0.00 -0.82 -0.08 -2.18 0.00 0.00 179.01 175.33 2ee0 s THR 85 N -1.48 1.32 -0.27 0.32 -1.32 -0.90 -5.00 115.64 108.32 2ee0 s THR 85 Ca -0.04 -0.50 0.22 0.00 -1.21 0.00 0.00 61.69 60.16 2ee0 s THR 85 Cb 0.01 -1.26 0.06 0.00 -1.51 0.00 0.00 72.50 69.80 2ee0 s THR 85 CO 0.06 0.41 1.15 0.00 -2.21 0.00 0.00 174.62 174.04 2ee0 h ALA 86 N 7.82 0.60 -3.83 11.08 0.00 -1.80 -3.35 119.26 129.78 2ee0 h ALA 86 Ca -0.33 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.18 2ee0 h ALA 86 Cb 1.15 0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.65 2ee0 h ALA 86 CO 0.47 0.03 -0.77 0.42 0.00 0.00 0.00 179.25 179.41 2ee0 s ILE 87 N -3.32 0.54 -0.23 0.00 1.01 -1.26 0.82 121.20 118.77 2ee0 s ILE 87 Ca 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 2ee0 s ILE 87 Cb 0.09 -0.48 0.02 0.00 0.01 0.00 0.00 42.46 42.09 2ee0 s ILE 87 CO 0.77 0.17 -0.09 -1.00 0.00 0.00 0.00 174.94 174.78 2ee0 s HIS 88 N 0.12 2.98 -0.38 3.97 3.76 0.56 -4.98 115.29 121.33 2ee0 s HIS 88 Ca -0.01 -1.50 -0.09 0.00 -0.15 0.00 0.00 55.06 53.31 2ee0 s HIS 88 Cb -0.06 -2.03 0.05 0.00 1.11 0.00 0.00 32.58 31.65 2ee0 s HIS 88 CO -0.00 -0.72 0.20 0.15 -0.85 0.00 0.00 174.74 173.52 2ee0 s LYS 89 N 1.33 2.69 0.04 1.40 1.02 -1.26 -1.55 119.74 123.42 2ee0 s LYS 89 Ca 0.02 -1.24 0.09 0.00 0.02 0.00 0.00 55.97 54.86 2ee0 s LYS 89 Cb -0.15 -3.69 -0.03 0.00 -0.52 0.00 0.00 37.83 33.44 2ee0 s LYS 89 CO -0.06 -0.78 -0.24 0.08 -0.92 0.00 0.00 175.35 173.42 2ee0 s VAL 90 N 1.47 2.31 -0.22 3.17 1.01 -1.23 -4.97 120.40 121.94 2ee0 s VAL 90 Ca 0.01 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2ee0 s VAL 90 Cb -0.21 -1.92 0.05 0.00 0.00 0.00 0.00 36.38 34.30 2ee0 s VAL 90 CO 0.04 0.36 -0.11 -0.89 0.00 0.00 0.00 175.10 174.50 2ee0 s THR 91 N -0.84 1.83 -0.08 3.92 2.01 -1.26 -1.43 115.64 119.79 2ee0 s THR 91 Ca 0.12 -1.19 -0.09 0.00 0.31 0.00 0.00 61.69 60.84 2ee0 s THR 91 Cb -0.10 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.47 2ee0 s THR 91 CO 0.03 0.14 0.22 -0.69 -0.69 0.00 0.00 174.62 173.62 2ee0 s VAL 92 N 1.30 5.37 -0.08 3.82 1.01 -1.04 -1.47 120.40 129.31 2ee0 s VAL 92 Ca -0.03 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.33 2ee0 s VAL 92 Cb -0.17 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2ee0 s VAL 92 CO -0.08 0.59 -0.14 -0.76 0.00 0.00 0.00 175.10 174.72 2ee0 s LEU 93 N -1.11 2.74 -0.14 3.92 1.43 -1.05 -2.07 118.68 122.40 2ee0 s LEU 93 Ca 0.18 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2ee0 s LEU 93 Cb -0.13 -1.58 0.02 0.00 0.03 0.00 0.00 46.19 44.53 2ee0 s LEU 93 CO 0.07 0.28 -0.12 0.00 0.23 0.00 0.00 176.35 176.81 2ee0 s ALA 94 N -0.33 1.70 -0.12 4.21 0.00 -0.62 -2.89 121.76 123.72 2ee0 s ALA 94 Ca 0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 2ee0 s ALA 94 Cb -0.13 -1.01 0.03 0.00 0.00 0.00 0.00 23.12 22.02 2ee0 s ALA 94 CO 0.02 -0.38 -0.04 0.45 0.00 0.00 0.00 175.76 175.81 2ee0 s SER 95 N 1.53 2.17 -0.02 0.00 0.15 -1.26 -0.65 113.70 115.62 2ee0 s SER 95 Ca 0.05 -0.33 -0.24 0.00 0.70 0.00 0.00 55.95 56.13 2ee0 s SER 95 Cb -0.13 -0.73 -0.17 0.00 -1.71 0.00 0.00 66.02 63.29 2ee0 s SER 95 CO -0.10 -0.16 1.11 -0.78 1.20 0.00 0.00 173.24 174.51 2ee0 h ASP 96 N 8.21 -0.25 0.00 5.45 3.58 -1.91 -3.36 116.42 128.15 2ee0 h ASP 96 Ca -0.25 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 56.93 2ee0 h ASP 96 Cb 1.12 0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.24 2ee0 h ASP 96 CO 0.36 0.19 0.00 0.61 -2.88 0.00 0.00 179.24 177.52 2ee0 n GLY 97 N 0.07 0.16 3.91 -0.78 0.00 -1.26 -4.71 105.19 102.58 2ee0 n GLY 97 Ca -0.09 0.71 -0.28 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.24 -3.91 1.61 7.64 -1.26 -4.97 113.62 109.49 2ee0 n SER 98 Ca 0.00 -0.84 -0.10 0.00 1.01 0.00 0.00 58.87 58.93 2ee0 n SER 98 Cb 0.00 -3.69 -0.10 0.00 -1.01 0.00 0.00 64.21 59.40 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 -3.68 0.11 -0.17 6.43 0.01 -1.26 -5.11 113.70 110.02 2ee0 s SER 99 Ca 0.44 -0.31 -0.39 0.00 1.31 0.00 0.00 55.95 57.00 2ee0 s SER 99 Cb -0.22 0.16 -0.15 0.00 0.21 0.00 0.00 66.02 66.01 2ee0 s SER 99 CO 0.84 -0.33 1.67 0.41 0.41 0.00 0.00 173.24 176.24 2ee0 n THR 100 N 1.57 0.26 -2.26 1.44 -1.04 -1.26 -4.71 114.28 108.28 2ee0 n THR 100 Ca -0.23 -0.05 -0.35 0.00 -2.04 0.00 0.00 64.05 61.38 2ee0 n THR 100 Cb 0.55 -1.21 -0.00 0.00 -1.82 0.00 0.00 70.33 67.86 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 2.89 3.45 -0.29 -2.82 0.04 -1.26 -4.72 135.00 132.28 2ee0 s PRO 101 Ca 0.94 1.65 -0.13 0.00 0.04 0.00 0.00 61.00 63.50 2ee0 s PRO 101 Cb -1.00 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 2ee0 s PRO 101 CO 0.60 -0.78 0.27 0.00 0.04 0.00 0.00 177.00 177.13 2ee0 s ALA 102 N -1.72 3.54 -0.14 8.56 0.00 0.17 -4.80 121.76 127.36 2ee0 s ALA 102 Ca 0.71 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 51.56 2ee0 s ALA 102 Cb -0.25 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.22 2ee0 s ALA 102 CO 0.28 -0.67 0.14 -0.98 0.00 0.00 0.00 175.76 174.53 2ee0 s ARG 103 N 1.89 3.65 -0.06 0.00 1.70 -1.25 -1.59 118.95 123.29 2ee0 s ARG 103 Ca 0.10 -0.16 -0.02 0.00 -0.47 0.00 0.00 55.73 55.18 2ee0 s ARG 103 Cb -0.16 -3.25 0.03 0.00 -0.57 0.00 0.00 34.95 31.00 2ee0 s ARG 103 CO 0.11 0.64 0.06 0.00 -1.08 0.00 0.00 175.30 175.03 2ee0 s ALA 104 N -0.62 0.30 -0.43 7.88 0.00 -0.88 -4.87 121.76 123.14 2ee0 s ALA 104 Ca 0.13 0.09 -0.21 0.00 0.00 0.00 0.00 51.96 51.97 2ee0 s ALA 104 Cb -0.12 -0.69 0.02 0.00 0.00 0.00 0.00 23.12 22.33 2ee0 s ALA 104 CO 0.02 -0.59 0.68 0.99 0.00 0.00 0.00 175.76 176.87 2ee0 s THR 105 N 2.15 4.79 -0.47 0.00 2.01 -0.44 -2.51 115.64 121.17 2ee0 s THR 105 Ca 0.05 0.30 -0.18 0.00 0.31 0.00 0.00 61.69 62.17 2ee0 s THR 105 Cb -0.13 -4.22 0.05 0.00 0.01 0.00 0.00 72.50 68.22 2ee0 s THR 105 CO -0.04 -0.58 0.52 -0.69 -0.69 0.00 0.00 174.62 173.14 2ee0 s VAL 106 N 2.93 5.02 -0.67 3.82 1.01 -0.52 -3.41 120.40 128.59 2ee0 s VAL 106 Ca 0.25 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.42 2ee0 s VAL 106 Cb -0.14 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.10 2ee0 s VAL 106 CO 0.19 -0.62 1.21 -0.89 0.00 0.00 0.00 175.10 174.99 2ee0 s THR 107 N 2.27 3.90 -0.37 3.92 2.01 -0.86 -3.52 115.64 122.98 2ee0 s THR 107 Ca 0.12 0.55 -0.14 0.00 0.31 0.00 0.00 61.69 62.53 2ee0 s THR 107 Cb -0.19 -4.82 -0.00 0.00 0.01 0.00 0.00 72.50 67.50 2ee0 s THR 107 CO 0.12 -1.61 0.29 -0.63 -0.69 0.00 0.00 174.62 172.09 2ee0 s ILE 108 N 5.27 5.25 0.38 1.82 1.01 -0.60 -2.57 121.20 131.77 2ee0 s ILE 108 Ca 0.37 -0.37 -0.13 0.00 0.00 0.00 0.00 60.65 60.52 2ee0 s ILE 108 Cb -0.08 -3.83 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 2ee0 s ILE 108 CO 0.19 -0.16 0.77 0.20 0.00 0.00 0.00 174.94 175.94 2ee0 s ASN 109 N 1.71 6.63 -0.19 3.58 0.01 -0.97 -0.32 114.94 125.40 2ee0 s ASN 109 Ca 0.06 1.21 0.01 0.00 -0.71 0.00 0.00 52.86 53.44 2ee0 s ASN 109 Cb -0.18 -2.35 0.03 0.00 0.41 0.00 0.00 41.25 39.16 2ee0 s ASN 109 CO 0.11 -0.33 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.52 2ee0 s VAL 110 N -2.22 1.90 0.51 1.60 1.01 0.24 -2.84 120.40 120.59 2ee0 s VAL 110 Ca 0.53 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.61 2ee0 s VAL 110 Cb -0.10 -1.81 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2ee0 s VAL 110 CO 0.25 0.39 0.47 0.42 0.00 0.00 0.00 175.10 176.64 2ee0 s THR 111 N 1.33 2.11 0.44 3.92 -4.23 -0.87 -4.87 115.64 113.46 2ee0 s THR 111 Ca 0.02 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 2ee0 s THR 111 Cb -0.14 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 2ee0 s THR 111 CO -0.11 0.00 0.66 1.51 -0.54 0.00 0.00 174.62 176.15 2ee0 s ASP 112 N -4.31 5.90 -0.00 3.99 1.47 -1.26 -2.23 116.67 120.22 2ee0 s ASP 112 Ca 0.45 0.33 0.04 0.00 1.18 0.00 0.00 52.55 54.55 2ee0 s ASP 112 Cb -0.03 -1.61 -0.06 0.00 -0.34 0.00 0.00 42.92 40.87 2ee0 s ASP 112 CO 0.27 -0.66 0.13 1.33 0.68 0.00 0.00 175.17 176.92 2ee0 n VAL 113 N -2.06 0.00 1.63 2.11 0.24 -1.26 -4.83 118.33 114.16 2ee0 n VAL 113 Ca 0.01 -0.20 0.15 0.00 -2.04 0.00 0.00 64.34 62.25 2ee0 n VAL 113 Cb 0.57 0.60 0.64 0.00 -1.47 0.00 0.00 33.84 34.18 2ee0 n VAL 113 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23