#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee0 s SER 2 N 0.00 -0.07 0.07 1.61 0.01 -1.26 -5.11 113.70 108.95 2ee0 s SER 2 Ca 0.00 -0.79 -0.02 0.00 1.31 0.00 0.00 55.95 56.45 2ee0 s SER 2 Cb 0.00 0.67 -0.01 0.00 0.21 0.00 0.00 66.02 66.89 2ee0 s SER 2 CO 0.00 -1.30 -0.04 -1.54 0.41 0.00 0.00 173.24 170.78 2ee0 n SER 3 N -1.04 1.18 0.00 2.44 3.41 -1.26 -5.12 113.62 113.23 2ee0 n SER 3 Ca -0.06 0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2ee0 n SER 3 Cb 0.60 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2ee0 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ee0 n GLY 4 N 3.27 0.45 4.22 5.00 0.00 -1.26 -4.87 105.19 112.00 2ee0 n GLY 4 Ca -0.02 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2ee0 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ee0 n SER 5 N 0.00 -2.33 -4.88 1.61 7.64 -1.26 -4.92 113.62 109.48 2ee0 n SER 5 Ca 0.00 -1.06 -0.30 0.00 1.01 0.00 0.00 58.87 58.53 2ee0 n SER 5 Cb 0.00 -2.60 -0.03 0.00 -1.01 0.00 0.00 64.21 60.57 2ee0 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ee0 s SER 6 N -3.55 6.48 0.00 6.43 0.01 -1.26 -5.08 113.70 116.73 2ee0 s SER 6 Ca 0.57 1.09 0.00 0.00 1.31 0.00 0.00 55.95 58.93 2ee0 s SER 6 Cb -0.32 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2ee0 s SER 6 CO 0.94 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 174.78 2ee0 n GLY 7 N -1.42 -3.16 3.92 3.44 0.00 -1.26 -5.02 105.19 101.70 2ee0 n GLY 7 Ca 0.02 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 2ee0 n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ee0 s ASN 8 N -1.96 4.72 0.52 1.61 0.01 -1.26 -5.08 114.94 113.50 2ee0 s ASN 8 Ca 0.00 -1.16 -0.21 0.00 -0.71 0.00 0.00 52.86 50.78 2ee0 s ASN 8 Cb 0.00 0.35 -0.07 0.00 0.41 0.00 0.00 41.25 41.94 2ee0 s ASN 8 CO 0.00 -1.12 1.03 0.47 -1.51 0.00 0.00 177.10 175.97 2ee0 n ASP 9 N -1.83 1.23 -3.67 -1.22 9.92 -1.26 -5.01 116.55 114.71 2ee0 n ASP 9 Ca 0.02 0.92 -0.16 0.00 -0.53 0.00 0.00 54.79 55.04 2ee0 n ASP 9 Cb 0.64 -1.40 -0.15 0.00 -0.64 0.00 0.00 41.12 39.57 2ee0 n ASP 9 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2ee0 s ASN 10 N -0.98 0.59 0.15 -2.24 3.84 -1.26 -5.15 114.94 109.89 2ee0 s ASN 10 Ca 0.70 0.40 0.09 0.00 0.21 0.00 0.00 52.86 54.25 2ee0 s ASN 10 Cb -0.47 0.37 -0.04 0.00 -0.55 0.00 0.00 41.25 40.56 2ee0 s ASN 10 CO 0.52 -0.24 -0.15 0.00 -2.79 0.00 0.00 177.10 174.44 2ee0 s ARG 11 N 2.23 1.87 0.64 0.43 3.03 -1.26 -4.40 118.95 121.49 2ee0 s ARG 11 Ca 0.02 -1.26 -0.16 0.00 2.03 0.00 0.00 55.73 56.36 2ee0 s ARG 11 Cb -0.12 -2.10 -0.01 0.00 -1.03 0.00 0.00 34.95 31.69 2ee0 s ARG 11 CO -0.06 0.45 1.11 -1.25 -1.13 0.00 0.00 175.30 174.42 2ee0 s PRO 12 N -2.50 2.90 -0.05 3.89 0.04 -1.26 -5.00 135.00 133.02 2ee0 s PRO 12 Ca 0.21 1.43 0.03 0.00 0.04 0.00 0.00 61.00 62.71 2ee0 s PRO 12 Cb -0.09 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.49 2ee0 s PRO 12 CO 0.12 -1.18 -0.12 0.54 0.04 0.00 0.00 177.00 176.40 2ee0 s VAL 13 N -2.24 1.10 0.50 -0.36 0.11 -1.26 -4.65 120.40 113.60 2ee0 s VAL 13 Ca 0.68 -0.50 -0.18 0.00 -2.93 0.00 0.00 61.98 59.05 2ee0 s VAL 13 Cb -0.21 -0.98 -0.08 0.00 -1.53 0.00 0.00 36.38 33.58 2ee0 s VAL 13 CO 0.39 0.34 0.99 -0.36 -3.33 0.00 0.00 175.10 173.13 2ee0 s PHE 14 N 0.36 3.32 0.26 1.54 0.08 -1.26 -4.17 117.98 118.10 2ee0 s PHE 14 Ca -0.08 1.51 -0.11 0.00 0.12 0.00 0.00 56.93 58.38 2ee0 s PHE 14 Cb -0.12 -2.86 0.39 0.00 -0.57 0.00 0.00 43.02 39.85 2ee0 s PHE 14 CO 0.02 -0.45 1.57 -0.22 -0.10 0.00 0.00 175.22 176.04 2ee0 h LYS 15 N 1.13 -0.01 -3.82 0.44 3.64 -2.00 -3.42 116.57 112.52 2ee0 h LYS 15 Ca -0.48 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 58.82 2ee0 h LYS 15 Cb 1.19 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.87 2ee0 h LYS 15 CO 0.61 -0.00 -0.37 -1.83 -2.27 0.00 0.00 179.45 175.58 2ee0 s GLU 16 N -6.20 0.87 -0.00 1.90 -1.05 -1.26 -5.09 118.70 107.86 2ee0 s GLU 16 Ca -0.15 -0.98 -0.20 0.00 -0.15 0.00 0.00 54.97 53.49 2ee0 s GLU 16 Cb 0.25 0.34 -0.11 0.00 -0.44 0.00 0.00 34.13 34.17 2ee0 s GLU 16 CO 0.76 -0.28 0.90 0.78 0.95 0.00 0.00 175.26 178.37 2ee0 h GLY 17 N 2.74 -0.75 -5.10 -3.83 0.00 -1.97 -3.45 103.07 90.72 2ee0 h GLY 17 Ca -0.34 0.28 -0.67 0.00 0.00 0.00 0.00 47.33 46.60 2ee0 h GLY 17 CO 0.56 -0.27 -0.60 1.62 0.00 0.00 0.00 176.54 177.84 2ee0 s GLN 18 N -3.95 2.98 -0.03 4.80 0.74 -1.26 -3.78 119.66 119.17 2ee0 s GLN 18 Ca -0.10 -0.48 0.02 0.00 0.05 0.00 0.00 55.36 54.85 2ee0 s GLN 18 Cb 0.01 -2.80 0.01 0.00 1.10 0.00 0.00 33.01 31.32 2ee0 s GLN 18 CO 0.31 0.66 -0.08 0.08 -0.55 0.00 0.00 175.29 175.72 2ee0 s VAL 19 N -1.07 0.70 -0.06 1.34 1.01 -1.22 -5.07 120.40 116.04 2ee0 s VAL 19 Ca 0.19 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 61.90 2ee0 s VAL 19 Cb -0.12 -0.64 -0.00 0.00 0.00 0.00 0.00 36.38 35.62 2ee0 s VAL 19 CO 0.09 0.23 -0.21 -0.70 0.00 0.00 0.00 175.10 174.51 2ee0 s GLU 20 N 0.26 2.29 0.05 2.72 2.12 -1.26 -0.90 118.70 123.98 2ee0 s GLU 20 Ca -0.04 -0.75 0.03 0.00 0.36 0.00 0.00 54.97 54.57 2ee0 s GLU 20 Cb -0.09 -1.90 -0.03 0.00 0.26 0.00 0.00 34.13 32.38 2ee0 s GLU 20 CO 0.00 0.26 -0.09 0.14 -0.54 0.00 0.00 175.26 175.03 2ee0 s VAL 21 N 0.08 0.68 -0.17 3.70 -7.23 -0.95 -5.01 120.40 111.50 2ee0 s VAL 21 Ca -0.08 -1.14 -0.01 0.00 -1.81 0.00 0.00 61.98 58.94 2ee0 s VAL 21 Cb -0.14 -0.73 -0.01 0.00 0.56 0.00 0.00 36.38 36.07 2ee0 s VAL 21 CO 0.04 -0.35 -0.12 -1.38 -0.31 0.00 0.00 175.10 172.98 2ee0 s HIS 22 N -1.37 2.84 -0.13 2.82 -3.43 -1.26 -1.69 115.29 113.07 2ee0 s HIS 22 Ca -0.08 -0.95 -0.08 0.00 -0.80 0.00 0.00 55.06 53.15 2ee0 s HIS 22 Cb -0.10 -1.94 0.05 0.00 -1.43 0.00 0.00 32.58 29.16 2ee0 s HIS 22 CO 0.01 -0.45 0.31 -1.50 -2.00 0.00 0.00 174.74 171.11 2ee0 s ILE 23 N 0.91 -0.03 0.66 -5.38 2.07 -0.95 -5.00 121.20 113.49 2ee0 s ILE 23 Ca -0.03 0.10 -0.15 0.00 -1.41 0.00 0.00 60.65 59.16 2ee0 s ILE 23 Cb -0.15 -0.46 -0.00 0.00 0.13 0.00 0.00 42.46 41.98 2ee0 s ILE 23 CO -0.01 0.04 1.11 -2.16 -1.91 0.00 0.00 174.94 172.02 2ee0 s PRO 24 N 1.06 2.81 0.18 3.50 0.04 -1.26 -2.41 135.00 138.92 2ee0 s PRO 24 Ca -0.07 1.40 -0.07 0.00 0.04 0.00 0.00 61.00 62.30 2ee0 s PRO 24 Cb -0.08 -1.95 0.07 0.00 0.04 0.00 0.00 34.50 32.58 2ee0 s PRO 24 CO -0.08 -1.24 1.54 1.05 0.04 0.00 0.00 177.00 178.31 2ee0 h GLU 25 N 0.07 0.80 -1.00 4.56 4.11 -1.73 -2.88 114.58 118.52 2ee0 h GLU 25 Ca -0.47 -0.40 -0.14 0.00 0.07 0.00 0.00 59.36 58.42 2ee0 h GLU 25 Cb 1.25 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.42 2ee0 h GLU 25 CO 0.54 1.03 0.18 0.09 0.07 0.00 0.00 179.01 180.92 2ee0 n ASN 26 N -4.06 3.19 -4.77 3.06 4.13 -1.26 -3.56 115.26 111.99 2ee0 n ASN 26 Ca -0.02 -2.43 -0.39 0.00 1.68 0.00 0.00 54.58 53.43 2ee0 n ASN 26 Cb 0.52 -0.59 -0.01 0.00 -1.54 0.00 0.00 39.78 38.15 2ee0 n ASN 26 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ee0 s ALA 27 N -0.91 3.17 0.38 5.41 0.00 -1.09 -4.99 121.76 123.74 2ee0 s ALA 27 Ca 0.15 1.07 -0.26 0.00 0.00 0.00 0.00 51.96 52.92 2ee0 s ALA 27 Cb 0.13 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.74 2ee0 s ALA 27 CO 0.03 -0.66 1.20 -1.25 0.00 0.00 0.00 175.76 175.08 2ee0 s PRO 28 N -2.30 4.15 0.20 0.00 0.04 -1.26 -4.87 135.00 130.95 2ee0 s PRO 28 Ca 0.58 1.93 -0.31 0.00 0.04 0.00 0.00 61.00 63.23 2ee0 s PRO 28 Cb -0.33 -2.80 -0.10 0.00 0.04 0.00 0.00 34.50 31.30 2ee0 s PRO 28 CO 0.42 -0.27 1.57 0.08 0.04 0.00 0.00 177.00 178.85 2ee0 s VAL 29 N -1.33 2.49 0.00 -0.36 1.01 -1.26 -2.87 120.40 118.08 2ee0 s VAL 29 Ca 0.54 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.89 2ee0 s VAL 29 Cb -0.33 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 32.81 2ee0 s VAL 29 CO 0.42 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.17 2ee0 n GLY 30 N 3.40 0.98 3.69 4.51 0.00 0.04 -4.97 105.19 112.84 2ee0 n GLY 30 Ca 0.12 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 4.89 -0.38 2.61 2.01 -1.14 -4.80 115.64 116.84 2ee0 s THR 31 Ca 0.00 1.78 -0.28 0.00 0.31 0.00 0.00 61.69 63.50 2ee0 s THR 31 Cb 0.00 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 2ee0 s THR 31 CO 0.00 0.10 1.68 -0.94 -0.69 0.00 0.00 174.62 174.77 2ee0 s SER 32 N 1.03 6.00 0.00 3.53 1.04 -1.26 -2.82 113.70 121.22 2ee0 s SER 32 Ca 0.44 1.07 0.00 0.00 0.48 0.00 0.00 55.95 57.94 2ee0 s SER 32 Cb -0.18 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.41 2ee0 s SER 32 CO 0.18 -1.67 0.00 0.52 0.98 0.00 0.00 173.24 173.26 2ee0 n VAL 33 N 7.29 0.00 -3.89 5.02 0.31 -0.13 -5.01 118.33 121.92 2ee0 n VAL 33 Ca 0.21 0.37 -0.11 0.00 -0.01 0.00 0.00 64.34 64.80 2ee0 n VAL 33 Cb 0.47 -1.11 -0.11 0.00 -0.91 0.00 0.00 33.84 32.18 2ee0 n VAL 33 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2ee0 s ILE 34 N -0.74 0.06 -0.30 2.52 1.10 -1.22 -5.01 121.20 117.61 2ee0 s ILE 34 Ca 0.00 -0.54 0.02 0.00 -0.51 0.00 0.00 60.65 59.63 2ee0 s ILE 34 Cb 0.00 -0.29 0.09 0.00 0.15 0.00 0.00 42.46 42.41 2ee0 s ILE 34 CO 0.00 -0.29 0.01 -1.58 -2.11 0.00 0.00 174.94 170.97 2ee0 s GLN 35 N -0.95 1.48 0.41 3.50 0.74 -1.26 -2.00 119.66 121.59 2ee0 s GLN 35 Ca -0.10 -1.45 -0.24 0.00 0.05 0.00 0.00 55.36 53.61 2ee0 s GLN 35 Cb -0.06 -2.80 -0.08 0.00 1.10 0.00 0.00 33.01 31.17 2ee0 s GLN 35 CO 0.00 -0.82 1.12 -0.51 -0.55 0.00 0.00 175.29 174.54 2ee0 s LEU 36 N 1.17 4.14 -0.10 3.68 1.43 -0.87 -5.01 118.68 123.12 2ee0 s LEU 36 Ca 0.04 2.22 -0.03 0.00 -1.03 0.00 0.00 54.13 55.33 2ee0 s LEU 36 Cb -0.19 -4.13 0.04 0.00 0.03 0.00 0.00 46.19 41.95 2ee0 s LEU 36 CO -0.10 -0.66 0.06 -2.28 0.23 0.00 0.00 176.35 173.60 2ee0 s HIS 37 N -1.53 0.22 -0.13 0.29 2.46 -1.26 -4.76 115.29 110.58 2ee0 s HIS 37 Ca 0.59 -0.04 0.02 0.00 0.47 0.00 0.00 55.06 56.10 2ee0 s HIS 37 Cb -0.27 -0.62 0.00 0.00 -0.13 0.00 0.00 32.58 31.57 2ee0 s HIS 37 CO 0.33 -0.34 -0.21 0.00 -2.47 0.00 0.00 174.74 172.06 2ee0 s ALA 38 N 2.12 2.29 -0.19 1.58 0.00 -1.26 -3.58 121.76 122.72 2ee0 s ALA 38 Ca 0.04 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.96 2ee0 s ALA 38 Cb -0.14 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.04 2ee0 s ALA 38 CO -0.06 0.09 -0.07 0.95 0.00 0.00 0.00 175.76 176.67 2ee0 s THR 39 N 0.64 1.37 -0.03 0.00 -4.23 -1.26 -4.96 115.64 107.17 2ee0 s THR 39 Ca -0.11 -0.85 0.04 0.00 -1.18 0.00 0.00 61.69 59.60 2ee0 s THR 39 Cb -0.16 -1.52 -0.00 0.00 1.34 0.00 0.00 72.50 72.16 2ee0 s THR 39 CO 0.02 0.12 -0.14 -0.62 -0.54 0.00 0.00 174.62 173.47 2ee0 s ASP 40 N 1.51 1.74 -1.37 3.99 2.15 -1.26 -4.60 116.67 118.83 2ee0 s ASP 40 Ca -0.01 -0.28 -0.17 0.00 0.43 0.00 0.00 52.55 52.53 2ee0 s ASP 40 Cb -0.16 -0.40 0.02 0.00 -0.30 0.00 0.00 42.92 42.08 2ee0 s ASP 40 CO -0.08 0.13 0.38 0.00 -0.17 0.00 0.00 175.17 175.44 2ee0 n ALA 41 N 3.07 -2.31 -0.83 3.66 0.00 -1.26 -4.75 120.51 118.09 2ee0 n ALA 41 Ca -0.17 -0.47 -0.09 0.00 0.00 0.00 0.00 53.44 52.71 2ee0 n ALA 41 Cb 0.54 -1.85 -0.13 0.00 0.00 0.00 0.00 19.45 18.02 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 -2.56 4.90 -4.30 0.00 2.03 -1.26 -4.76 116.55 110.60 2ee0 n ASP 42 Ca -0.22 -2.39 -0.46 0.00 0.52 0.00 0.00 54.79 52.24 2ee0 n ASP 42 Cb 0.63 -1.27 -0.03 0.00 -0.72 0.00 0.00 41.12 39.73 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 0.93 5.34 0.00 5.18 -4.36 -1.26 -4.85 121.20 122.17 2ee0 s ILE 43 Ca 0.49 -2.43 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 2ee0 s ILE 43 Cb 0.24 -4.32 0.00 0.00 1.25 0.00 0.00 42.46 39.62 2ee0 s ILE 43 CO 0.00 -0.99 0.00 0.61 0.24 0.00 0.00 174.94 174.80 2ee0 n GLY 44 N 4.05 1.45 3.91 6.27 0.00 -1.26 -5.03 105.19 114.58 2ee0 n GLY 44 Ca 0.10 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 -4.00 6.43 -0.42 1.61 0.15 -1.26 -5.05 113.70 111.16 2ee0 s SER 45 Ca 0.00 0.48 -0.28 0.00 0.70 0.00 0.00 55.95 56.84 2ee0 s SER 45 Cb 0.00 -2.04 0.02 0.00 -1.71 0.00 0.00 66.02 62.29 2ee0 s SER 45 CO 0.00 0.04 1.09 0.21 1.20 0.00 0.00 173.24 175.77 2ee0 s ASN 46 N -2.69 6.71 0.49 5.45 3.84 -1.26 -4.88 114.94 122.60 2ee0 s ASN 46 Ca 0.39 0.62 -0.22 0.00 0.21 0.00 0.00 52.86 53.86 2ee0 s ASN 46 Cb -0.12 -2.53 -0.07 0.00 -0.55 0.00 0.00 41.25 37.98 2ee0 s ASN 46 CO 0.27 -1.10 1.18 0.00 -2.79 0.00 0.00 177.10 174.66 2ee0 s ALA 47 N 4.09 2.89 -0.95 1.71 0.00 -1.26 -4.96 121.76 123.28 2ee0 s ALA 47 Ca 0.46 0.97 -0.16 0.00 0.00 0.00 0.00 51.96 53.22 2ee0 s ALA 47 Cb -0.09 -3.40 0.18 0.00 0.00 0.00 0.00 23.12 19.80 2ee0 s ALA 47 CO 0.25 -0.78 1.05 -1.21 0.00 0.00 0.00 175.76 175.08 2ee0 s GLU 48 N -2.84 3.72 -0.30 0.00 0.41 -1.26 -5.01 118.70 113.42 2ee0 s GLU 48 Ca 0.67 -2.21 -0.29 0.00 -0.41 0.00 0.00 54.97 52.72 2ee0 s GLU 48 Cb -0.29 -4.75 0.02 0.00 -1.78 0.00 0.00 34.13 27.32 2ee0 s GLU 48 CO 0.35 -1.58 1.07 0.42 -0.49 0.00 0.00 175.26 175.03 2ee0 s ILE 49 N 1.42 4.54 0.70 -1.63 1.01 -1.26 -4.93 121.20 121.05 2ee0 s ILE 49 Ca 0.29 1.80 -0.11 0.00 0.00 0.00 0.00 60.65 62.63 2ee0 s ILE 49 Cb -0.07 -4.40 0.01 0.00 0.01 0.00 0.00 42.46 38.02 2ee0 s ILE 49 CO -0.08 -0.42 1.07 -0.60 0.00 0.00 0.00 174.94 174.91 2ee0 s ARG 50 N 3.56 2.94 -0.18 2.79 6.06 -1.21 -4.85 118.95 128.06 2ee0 s ARG 50 Ca 0.45 0.66 -0.04 0.00 -2.50 0.00 0.00 55.73 54.30 2ee0 s ARG 50 Cb -0.13 -2.01 0.06 0.00 0.06 0.00 0.00 34.95 32.93 2ee0 s ARG 50 CO 0.13 -1.02 0.06 0.71 -2.50 0.00 0.00 175.30 172.68 2ee0 s TYR 51 N -3.22 0.67 0.41 5.12 2.02 -1.22 -3.58 117.35 117.55 2ee0 s TYR 51 Ca 0.58 -0.60 0.07 0.00 -0.37 0.00 0.00 57.07 56.75 2ee0 s TYR 51 Cb -0.12 -0.88 -0.05 0.00 -0.40 0.00 0.00 41.96 40.51 2ee0 s TYR 51 CO 0.53 -0.56 0.21 0.96 -1.57 0.00 0.00 175.55 175.13 2ee0 s ILE 52 N 1.98 2.39 0.17 2.71 -4.36 -1.18 -4.06 121.20 118.85 2ee0 s ILE 52 Ca 0.00 -1.64 -0.30 0.00 -0.26 0.00 0.00 60.65 58.45 2ee0 s ILE 52 Cb -0.16 -3.00 -0.08 0.00 1.25 0.00 0.00 42.46 40.47 2ee0 s ILE 52 CO -0.08 -0.01 1.15 -0.36 0.24 0.00 0.00 174.94 175.88 2ee0 s PHE 53 N -2.57 3.51 0.00 1.37 0.08 -1.26 -2.16 117.98 116.95 2ee0 s PHE 53 Ca 0.42 1.51 0.00 0.00 0.12 0.00 0.00 56.93 58.98 2ee0 s PHE 53 Cb 0.02 -3.35 0.00 0.00 -0.57 0.00 0.00 43.02 39.12 2ee0 s PHE 53 CO 0.23 -0.90 0.00 0.41 -0.10 0.00 0.00 175.22 174.86 2ee0 n GLY 54 N 2.18 -2.36 3.82 4.36 0.00 0.28 -4.81 105.19 108.67 2ee0 n GLY 54 Ca 0.04 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.43 3.60 -1.30 4.61 0.00 -1.26 -4.60 121.76 120.38 2ee0 s ALA 55 Ca 0.00 -1.37 -0.02 0.00 0.00 0.00 0.00 51.96 50.57 2ee0 s ALA 55 Cb 0.00 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.80 2ee0 s ALA 55 CO 0.00 0.31 0.89 1.04 0.00 0.00 0.00 175.76 177.99 2ee0 n GLN 56 N -1.01 -5.90 -3.89 0.00 6.02 -1.26 -4.92 117.38 106.42 2ee0 n GLN 56 Ca -0.08 0.72 -0.36 0.00 -0.01 0.00 0.00 57.00 57.27 2ee0 n GLN 56 Cb 0.57 -5.52 -0.13 0.00 1.02 0.00 0.00 30.24 26.18 2ee0 n GLN 56 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2ee0 s VAL 57 N -3.49 4.04 0.70 5.09 1.01 -1.26 -5.05 120.40 121.44 2ee0 s VAL 57 Ca 0.13 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 2ee0 s VAL 57 Cb -0.06 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.47 2ee0 s VAL 57 CO 0.78 0.39 1.18 0.00 0.00 0.00 0.00 175.10 177.44 2ee0 n ALA 58 N 4.65 0.50 -0.11 5.51 0.00 -1.26 -4.94 120.51 124.87 2ee0 n ALA 58 Ca -0.17 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.02 2ee0 n ALA 58 Cb 0.51 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 2ee0 n ALA 58 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ee0 h PRO 59 N 0.01 0.86 0.43 0.00 0.13 -2.00 -3.21 132.00 128.24 2ee0 h PRO 59 Ca -0.49 -0.46 -0.01 0.00 -0.87 0.00 0.00 66.00 64.18 2ee0 h PRO 59 Cb 1.33 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 2ee0 h PRO 59 CO 0.50 1.10 -0.39 0.00 -0.23 0.00 0.00 178.00 178.97 2ee0 h ALA 60 N 0.75 -0.88 -1.10 -0.56 0.00 -1.99 -1.71 119.26 113.77 2ee0 h ALA 60 Ca 0.06 -0.15 0.30 0.00 0.00 0.00 0.00 54.91 55.12 2ee0 h ALA 60 Cb 0.94 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 19.19 2ee0 h ALA 60 CO 0.09 -1.03 0.72 1.15 0.00 0.00 0.00 179.25 180.18 2ee0 h THR 61 N -0.83 0.46 0.00 0.00 2.02 -1.94 1.08 112.91 113.70 2ee0 h THR 61 Ca -0.04 -0.10 -0.10 0.00 0.77 0.00 0.00 66.41 66.94 2ee0 h THR 61 Cb 0.73 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2ee0 h THR 61 CO -0.04 0.05 -0.48 0.11 0.37 0.00 0.00 175.52 175.54 2ee0 h LYS 62 N 0.28 0.00 0.00 6.66 1.57 -1.36 -1.87 116.57 121.85 2ee0 h LYS 62 Ca 0.61 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.33 2ee0 h LYS 62 Cb 1.76 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.06 2ee0 h LYS 62 CO -0.25 0.48 -0.45 0.00 -0.57 0.00 0.00 179.45 178.66 2ee0 h ARG 63 N 0.00 0.00 -0.45 3.15 3.08 0.18 -3.38 114.38 116.96 2ee0 h ARG 63 Ca -0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.08 2ee0 h ARG 63 Cb 1.03 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.04 2ee0 h ARG 63 CO 0.06 0.56 0.22 -0.07 -1.07 0.00 0.00 179.97 179.67 2ee0 h LEU 64 N -1.00 0.31 -8.79 3.04 3.38 -0.56 -3.41 115.31 108.29 2ee0 h LEU 64 Ca -0.09 0.03 -0.64 0.00 0.09 0.00 0.00 57.88 57.26 2ee0 h LEU 64 Cb 0.75 -0.03 -0.21 0.00 0.09 0.00 0.00 40.66 41.25 2ee0 h LEU 64 CO -0.06 0.22 -0.64 -0.36 0.09 0.00 0.00 178.44 177.69 2ee0 s PHE 65 N -6.14 3.07 -0.10 1.13 0.08 -0.70 0.47 117.98 115.78 2ee0 s PHE 65 Ca -0.13 -0.33 -0.12 0.00 0.12 0.00 0.00 56.93 56.47 2ee0 s PHE 65 Cb 0.13 -2.06 -0.05 0.00 -0.57 0.00 0.00 43.02 40.47 2ee0 s PHE 65 CO 0.73 -0.14 0.27 0.00 -0.10 0.00 0.00 175.22 175.98 2ee0 s ALA 66 N 0.79 3.72 -0.03 5.36 0.00 -0.82 -4.35 121.76 126.44 2ee0 s ALA 66 Ca 0.01 -0.46 0.04 0.00 0.00 0.00 0.00 51.96 51.54 2ee0 s ALA 66 Cb -0.14 -2.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2ee0 s ALA 66 CO 0.02 0.38 -0.12 -1.17 0.00 0.00 0.00 175.76 174.87 2ee0 s LEU 67 N -0.49 2.86 -0.24 0.00 2.96 -1.26 -2.50 118.68 120.01 2ee0 s LEU 67 Ca 0.18 -0.20 -0.09 0.00 -0.22 0.00 0.00 54.13 53.80 2ee0 s LEU 67 Cb -0.14 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 2ee0 s LEU 67 CO 0.06 0.32 0.11 0.20 -1.32 0.00 0.00 176.35 175.73 2ee0 s ASN 68 N -0.99 5.62 0.00 3.68 -0.87 -0.77 -4.96 114.94 116.66 2ee0 s ASN 68 Ca 0.13 -0.04 0.18 0.00 -1.57 0.00 0.00 52.86 51.56 2ee0 s ASN 68 Cb -0.11 -2.01 0.81 0.00 -0.02 0.00 0.00 41.25 39.92 2ee0 s ASN 68 CO 0.03 0.03 1.55 0.59 -2.57 0.00 0.00 177.10 176.73 2ee0 n ASN 69 N 4.51 0.87 -0.01 -1.22 4.13 -1.26 0.32 115.26 122.60 2ee0 n ASN 69 Ca -0.16 -1.63 -0.00 0.00 1.68 0.00 0.00 54.58 54.47 2ee0 n ASN 69 Cb 0.52 -0.06 -0.03 0.00 -1.54 0.00 0.00 39.78 38.67 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 -0.18 0.14 0.00 3.41 -2.24 -1.26 -3.44 114.28 110.71 2ee0 n THR 70 Ca 0.14 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2ee0 n THR 70 Cb 0.19 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 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 -1.93 0.00 -3.29 4.28 -2.24 -1.23 -5.01 114.28 104.86 2ee0 n THR 71 Ca -0.03 -0.19 -0.21 0.00 -2.27 0.00 0.00 64.05 61.34 2ee0 n THR 71 Cb 0.41 0.69 0.06 0.00 -2.10 0.00 0.00 70.33 69.39 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 1.80 -0.39 3.60 3.38 0.00 0.15 -4.67 105.19 109.06 2ee0 n GLY 72 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 -6.42 3.13 -0.15 0.99 2.96 -1.25 -2.05 118.68 115.89 2ee0 s LEU 73 Ca 0.44 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 2ee0 s LEU 73 Cb -0.19 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.62 2ee0 s LEU 73 CO 0.54 0.19 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.94 2ee0 s ILE 74 N -1.20 1.90 0.21 6.68 1.01 -0.85 -1.85 121.20 127.11 2ee0 s ILE 74 Ca 0.21 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 60.06 2ee0 s ILE 74 Cb -0.11 -1.72 -0.05 0.00 0.01 0.00 0.00 42.46 40.59 2ee0 s ILE 74 CO 0.14 0.52 -0.09 0.42 0.00 0.00 0.00 174.94 175.92 2ee0 s THR 75 N 1.15 1.41 0.11 2.92 -4.23 -1.04 -0.96 115.64 115.00 2ee0 s THR 75 Ca 0.00 -2.12 -0.31 0.00 -1.18 0.00 0.00 61.69 58.09 2ee0 s THR 75 Cb -0.14 -2.12 -0.07 0.00 1.34 0.00 0.00 72.50 71.51 2ee0 s THR 75 CO -0.08 -0.53 1.29 -0.69 -0.54 0.00 0.00 174.62 174.07 2ee0 s VAL 76 N -3.18 3.58 -0.15 2.29 1.01 -1.13 -1.94 120.40 120.89 2ee0 s VAL 76 Ca 0.23 1.17 0.06 0.00 0.00 0.00 0.00 61.98 63.44 2ee0 s VAL 76 Cb 0.02 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.52 2ee0 s VAL 76 CO 0.06 0.11 -0.07 1.67 0.00 0.00 0.00 175.10 176.88 2ee0 n GLN 77 N 3.62 1.04 -3.81 2.72 7.27 0.18 -0.78 117.38 127.62 2ee0 n GLN 77 Ca 0.09 0.05 -0.12 0.00 0.07 0.00 0.00 57.00 57.10 2ee0 n GLN 77 Cb 0.44 -1.33 -0.09 0.00 2.41 0.00 0.00 30.24 31.67 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 -2.32 0.66 0.41 3.69 0.52 -1.08 -4.91 118.95 115.92 2ee0 s ARG 78 Ca -0.15 -0.43 -0.17 0.00 -0.52 0.00 0.00 55.73 54.46 2ee0 s ARG 78 Cb 0.05 0.28 -0.14 0.00 0.52 0.00 0.00 34.95 35.66 2ee0 s ARG 78 CO 0.44 -0.18 -0.04 -1.13 0.02 0.00 0.00 175.30 174.41 2ee0 n SER 79 N 1.02 -3.00 -4.78 0.23 3.41 -1.26 -4.86 113.62 104.38 2ee0 n SER 79 Ca -0.21 0.64 -0.28 0.00 -0.26 0.00 0.00 58.87 58.76 2ee0 n SER 79 Cb 0.57 -0.77 -0.06 0.00 -0.26 0.00 0.00 64.21 63.70 2ee0 n SER 79 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ee0 s LEU 80 N 4.24 3.78 -0.19 1.04 1.43 -1.23 -4.98 118.68 122.77 2ee0 s LEU 80 Ca 0.52 -0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.53 2ee0 s LEU 80 Cb -0.49 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.34 2ee0 s LEU 80 CO 0.58 0.11 -0.17 -1.81 0.23 0.00 0.00 176.35 175.29 2ee0 s ASP 81 N -2.80 3.24 -0.08 2.29 1.01 -1.26 -4.80 116.67 114.27 2ee0 s ASP 81 Ca 0.30 -0.74 -0.25 0.00 0.71 0.00 0.00 52.55 52.58 2ee0 s ASP 81 Cb -0.11 -1.42 -0.29 0.00 1.01 0.00 0.00 42.92 42.12 2ee0 s ASP 81 CO 0.23 -0.05 0.86 -0.09 0.21 0.00 0.00 175.17 176.33 2ee0 h ARG 82 N 7.94 0.18 -0.94 8.23 1.12 -1.96 -3.17 114.38 125.78 2ee0 h ARG 82 Ca -0.40 -0.30 0.20 0.00 -1.11 0.00 0.00 59.98 58.37 2ee0 h ARG 82 Cb 1.12 0.11 -0.18 0.00 -0.01 0.00 0.00 29.97 31.02 2ee0 h ARG 82 CO 0.58 1.14 -0.19 0.93 -3.11 0.00 0.00 179.97 179.32 2ee0 h GLU 83 N -0.61 0.01 0.73 0.20 5.08 -2.01 -1.31 114.58 116.66 2ee0 h GLU 83 Ca -0.08 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2ee0 h GLU 83 Cb 1.37 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.62 2ee0 h GLU 83 CO 0.09 0.00 -0.35 0.93 -1.00 0.00 0.00 179.01 178.68 2ee0 h GLU 84 N 0.01 -0.94 -4.79 2.33 4.39 -2.01 -3.45 114.58 110.10 2ee0 h GLU 84 Ca 0.47 0.06 -0.36 0.00 0.34 0.00 0.00 59.36 59.87 2ee0 h GLU 84 Cb 0.77 0.21 -0.25 0.00 -0.10 0.00 0.00 28.75 29.38 2ee0 h GLU 84 CO -0.95 -0.63 -0.77 -0.08 -1.16 0.00 0.00 179.01 175.43 2ee0 s THR 85 N -4.77 0.74 -0.08 1.13 -1.32 -0.49 -5.04 115.64 105.81 2ee0 s THR 85 Ca -0.14 -0.74 0.15 0.00 -1.21 0.00 0.00 61.69 59.75 2ee0 s THR 85 Cb 0.01 -0.68 -0.23 0.00 -1.51 0.00 0.00 72.50 70.09 2ee0 s THR 85 CO 0.44 -0.04 0.23 0.00 -2.21 0.00 0.00 174.62 173.04 2ee0 n ALA 86 N 2.18 2.20 -3.24 11.08 0.00 -1.24 -3.93 120.51 127.57 2ee0 n ALA 86 Ca -0.17 -0.65 -0.19 0.00 0.00 0.00 0.00 53.44 52.43 2ee0 n ALA 86 Cb 0.56 -0.36 -0.16 0.00 0.00 0.00 0.00 19.45 19.49 2ee0 n ALA 86 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2ee0 s ILE 87 N -2.82 0.54 -0.27 0.00 1.01 -1.26 -2.03 121.20 116.36 2ee0 s ILE 87 Ca -0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 2ee0 s ILE 87 Cb 0.08 -0.51 0.03 0.00 0.01 0.00 0.00 42.46 42.06 2ee0 s ILE 87 CO 0.66 0.19 -0.01 -1.00 0.00 0.00 0.00 174.94 174.78 2ee0 s HIS 88 N 0.44 3.13 -0.42 3.97 3.76 -0.81 -4.94 115.29 120.42 2ee0 s HIS 88 Ca -0.06 -1.48 -0.13 0.00 -0.15 0.00 0.00 55.06 53.25 2ee0 s HIS 88 Cb -0.09 -2.12 0.05 0.00 1.11 0.00 0.00 32.58 31.52 2ee0 s HIS 88 CO 0.00 -0.71 0.28 0.15 -0.85 0.00 0.00 174.74 173.62 2ee0 s LYS 89 N 1.35 2.85 -0.01 1.40 1.02 -1.26 -1.58 119.74 123.51 2ee0 s LYS 89 Ca -0.00 -1.21 0.05 0.00 0.02 0.00 0.00 55.97 54.82 2ee0 s LYS 89 Cb -0.17 -3.90 -0.03 0.00 -0.52 0.00 0.00 37.83 33.21 2ee0 s LYS 89 CO -0.02 -0.85 -0.14 0.08 -0.92 0.00 0.00 175.35 173.50 2ee0 s VAL 90 N 1.58 3.08 -0.16 3.17 1.01 -0.93 -4.94 120.40 123.21 2ee0 s VAL 90 Ca 0.03 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2ee0 s VAL 90 Cb -0.21 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 33.93 2ee0 s VAL 90 CO 0.06 0.48 -0.19 -0.89 0.00 0.00 0.00 175.10 174.57 2ee0 s THR 91 N -0.84 1.92 -0.08 3.92 2.01 -1.26 -0.94 115.64 120.38 2ee0 s THR 91 Ca 0.13 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.26 2ee0 s THR 91 Cb -0.11 -1.74 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 2ee0 s THR 91 CO 0.03 0.52 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.77 2ee0 s VAL 92 N 1.22 4.11 -0.09 3.82 1.01 -1.19 0.10 120.40 129.38 2ee0 s VAL 92 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 2ee0 s VAL 92 Cb -0.14 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.49 2ee0 s VAL 92 CO -0.10 0.59 0.03 -0.76 0.00 0.00 0.00 175.10 174.87 2ee0 s LEU 93 N -0.89 3.77 -0.06 3.92 1.43 -0.92 -2.80 118.68 123.13 2ee0 s LEU 93 Ca 0.13 0.22 0.06 0.00 -1.03 0.00 0.00 54.13 53.51 2ee0 s LEU 93 Cb -0.11 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 2ee0 s LEU 93 CO 0.02 0.38 -0.23 0.00 0.23 0.00 0.00 176.35 176.76 2ee0 s ALA 94 N -0.92 2.27 0.01 4.21 0.00 0.19 -3.12 121.76 124.39 2ee0 s ALA 94 Ca 0.14 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.06 2ee0 s ALA 94 Cb -0.11 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 2ee0 s ALA 94 CO 0.03 0.44 -0.02 0.45 0.00 0.00 0.00 175.76 176.66 2ee0 s SER 95 N -0.28 0.17 0.00 0.00 0.15 -1.23 -1.15 113.70 111.35 2ee0 s SER 95 Ca 0.00 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2ee0 s SER 95 Cb -0.13 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 2ee0 s SER 95 CO 0.03 -0.06 0.00 -0.90 1.20 0.00 0.00 173.24 173.51 2ee0 n ASP 96 N 2.71 1.17 0.00 5.45 5.75 -1.26 -3.36 116.55 127.01 2ee0 n ASP 96 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 2ee0 n ASP 96 Cb 0.59 0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 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 1.65 0.00 3.03 6.12 0.00 -1.26 -4.98 105.19 109.74 2ee0 n GLY 97 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2ee0 n GLY 97 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ee0 n SER 98 N 0.00 2.85 0.00 1.61 2.88 -1.26 -4.96 113.62 114.74 2ee0 n SER 98 Ca 0.00 -2.70 0.00 0.00 -1.33 0.00 0.00 58.87 54.84 2ee0 n SER 98 Cb 0.00 0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 2ee0 n SER 98 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2ee0 n SER 99 N -1.51 0.00 -4.79 -3.46 7.64 -1.26 -4.81 113.62 105.43 2ee0 n SER 99 Ca -0.11 0.65 -0.36 0.00 1.01 0.00 0.00 58.87 60.06 2ee0 n SER 99 Cb 0.52 -0.42 -0.07 0.00 -1.01 0.00 0.00 64.21 63.23 2ee0 n SER 99 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ee0 s THR 100 N -1.68 5.42 0.90 0.44 2.01 -1.26 -5.09 115.64 116.38 2ee0 s THR 100 Ca 0.00 0.19 -0.12 0.00 0.31 0.00 0.00 61.69 62.07 2ee0 s THR 100 Cb 0.00 -3.43 0.13 0.00 0.01 0.00 0.00 72.50 69.21 2ee0 s THR 100 CO 0.00 0.51 1.09 -2.16 -0.69 0.00 0.00 174.62 173.37 2ee0 s PRO 101 N -0.20 1.24 -0.17 4.92 0.04 -1.26 -4.84 135.00 134.73 2ee0 s PRO 101 Ca 0.11 0.81 -0.14 0.00 0.04 0.00 0.00 61.00 61.82 2ee0 s PRO 101 Cb -0.11 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 2ee0 s PRO 101 CO 0.00 -2.25 0.29 0.00 0.04 0.00 0.00 177.00 175.09 2ee0 s ALA 102 N -2.93 3.59 0.09 8.56 0.00 -0.30 -4.86 121.76 125.90 2ee0 s ALA 102 Ca 0.63 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.13 2ee0 s ALA 102 Cb -0.18 -2.42 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 2ee0 s ALA 102 CO 0.57 0.01 0.03 -0.98 0.00 0.00 0.00 175.76 175.39 2ee0 s ARG 103 N 0.64 2.66 -0.12 0.00 1.70 -1.26 -0.63 118.95 121.93 2ee0 s ARG 103 Ca 0.16 -0.80 -0.04 0.00 -0.47 0.00 0.00 55.73 54.58 2ee0 s ARG 103 Cb -0.13 -2.60 0.06 0.00 -0.57 0.00 0.00 34.95 31.71 2ee0 s ARG 103 CO 0.04 0.55 0.25 0.00 -1.08 0.00 0.00 175.30 175.05 2ee0 s ALA 104 N -1.35 -0.48 -0.30 7.88 0.00 -1.12 -4.97 121.76 121.41 2ee0 s ALA 104 Ca 0.27 0.85 -0.26 0.00 0.00 0.00 0.00 51.96 52.82 2ee0 s ALA 104 Cb -0.12 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.02 2ee0 s ALA 104 CO 0.20 -0.64 0.92 0.99 0.00 0.00 0.00 175.76 177.22 2ee0 s THR 105 N 2.40 4.68 -0.04 0.00 2.01 -1.25 -3.17 115.64 120.27 2ee0 s THR 105 Ca 0.02 1.49 -0.01 0.00 0.31 0.00 0.00 61.69 63.50 2ee0 s THR 105 Cb -0.12 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 2ee0 s THR 105 CO -0.08 -0.32 0.03 -0.69 -0.69 0.00 0.00 174.62 172.87 2ee0 s VAL 106 N 3.23 4.45 -0.11 3.82 1.01 -0.11 -3.38 120.40 129.31 2ee0 s VAL 106 Ca 0.38 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2ee0 s VAL 106 Cb -0.14 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.28 2ee0 s VAL 106 CO 0.13 0.46 -0.20 -0.89 0.00 0.00 0.00 175.10 174.60 2ee0 s THR 107 N -1.04 2.42 -0.22 3.92 2.01 -0.08 -2.19 115.64 120.46 2ee0 s THR 107 Ca 0.18 -0.89 -0.00 0.00 0.31 0.00 0.00 61.69 61.29 2ee0 s THR 107 Cb -0.12 -1.96 0.02 0.00 0.01 0.00 0.00 72.50 70.46 2ee0 s THR 107 CO 0.08 0.55 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.80 2ee0 s ILE 108 N 0.34 2.50 -0.05 1.82 1.01 -0.61 -2.24 121.20 123.97 2ee0 s ILE 108 Ca -0.16 -0.99 -0.18 0.00 0.00 0.00 0.00 60.65 59.31 2ee0 s ILE 108 Cb -0.17 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 2ee0 s ILE 108 CO 0.08 0.35 0.51 0.20 0.00 0.00 0.00 174.94 176.08 2ee0 s ASN 109 N 1.30 6.83 -0.52 3.58 0.01 -0.68 -1.92 114.94 123.54 2ee0 s ASN 109 Ca 0.02 0.98 -0.14 0.00 -0.71 0.00 0.00 52.86 53.01 2ee0 s ASN 109 Cb -0.15 -2.31 0.13 0.00 0.41 0.00 0.00 41.25 39.32 2ee0 s ASN 109 CO -0.08 0.10 0.45 -0.69 -1.51 0.00 0.00 177.10 175.37 2ee0 s VAL 110 N -0.04 4.88 0.54 1.60 1.01 -0.86 -2.24 120.40 125.29 2ee0 s VAL 110 Ca 0.28 -1.60 -0.07 0.00 0.00 0.00 0.00 61.98 60.59 2ee0 s VAL 110 Cb -0.17 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 2ee0 s VAL 110 CO 0.14 -0.84 0.87 0.42 0.00 0.00 0.00 175.10 175.69 2ee0 s THR 111 N 1.52 4.63 0.88 3.92 -4.23 -1.01 -4.85 115.64 116.49 2ee0 s THR 111 Ca 0.04 0.33 -0.12 0.00 -1.18 0.00 0.00 61.69 60.76 2ee0 s THR 111 Cb -0.29 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 69.88 2ee0 s THR 111 CO 0.02 -0.86 1.16 -1.81 -0.54 0.00 0.00 174.62 172.59 2ee0 s ASP 112 N -4.16 3.84 -0.04 3.99 1.01 -1.26 -2.19 116.67 117.86 2ee0 s ASP 112 Ca 0.50 0.88 -0.02 0.00 0.71 0.00 0.00 52.55 54.63 2ee0 s ASP 112 Cb -0.10 -1.41 0.03 0.00 1.01 0.00 0.00 42.92 42.45 2ee0 s ASP 112 CO 0.47 -2.33 0.05 0.68 0.21 0.00 0.00 175.17 174.25 2ee0 s VAL 113 N -3.40 -0.04 -2.88 -1.27 -7.23 -1.26 -4.72 120.40 99.59 2ee0 s VAL 113 Ca 0.63 0.36 0.23 0.00 -1.81 0.00 0.00 61.98 61.39 2ee0 s VAL 113 Cb -0.13 -0.18 0.18 0.00 0.56 0.00 0.00 36.38 36.81 2ee0 s VAL 113 CO 0.52 0.17 1.23 -0.46 -0.31 0.00 0.00 175.10 176.25