#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 0.56 0.20 1.61 1.04 -1.26 -5.14 113.70 110.71 2ee0 s SER 2 Ca 0.00 -0.32 -0.30 0.00 0.48 0.00 0.00 55.95 55.81 2ee0 s SER 2 Cb 0.00 0.01 -0.08 0.00 0.10 0.00 0.00 66.02 66.05 2ee0 s SER 2 CO 0.00 -0.11 0.99 -0.94 0.98 0.00 0.00 173.24 174.16 2ee0 s SER 3 N -0.87 7.50 0.01 7.02 1.04 -1.26 -4.79 113.70 122.35 2ee0 s SER 3 Ca -0.06 1.96 0.00 0.00 0.48 0.00 0.00 55.95 58.33 2ee0 s SER 3 Cb -0.06 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.46 2ee0 s SER 3 CO -0.00 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 174.83 2ee0 n GLY 4 N 1.77 -0.43 3.77 7.32 0.00 -1.26 -5.13 105.19 111.23 2ee0 n GLY 4 Ca 0.00 0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2ee0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ee0 s SER 5 N -2.00 6.84 -0.14 1.61 0.15 -1.26 -4.98 113.70 113.91 2ee0 s SER 5 Ca 0.00 2.35 -0.27 0.00 0.70 0.00 0.00 55.95 58.73 2ee0 s SER 5 Cb 0.00 -2.62 -0.24 0.00 -1.71 0.00 0.00 66.02 61.45 2ee0 s SER 5 CO 0.00 -0.46 0.69 0.28 1.20 0.00 0.00 173.24 174.95 2ee0 h SER 6 N 3.14 0.00 -3.39 5.45 0.02 -2.03 -3.47 113.55 113.28 2ee0 h SER 6 Ca -0.48 -0.91 -0.22 0.00 -0.84 0.00 0.00 61.79 59.34 2ee0 h SER 6 Cb 1.22 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.46 2ee0 h SER 6 CO 0.64 1.01 -0.54 -0.83 -1.14 0.00 0.00 176.83 175.98 2ee0 s GLY 7 N -4.24 -0.09 -0.08 -3.77 0.00 -1.26 -5.15 107.32 92.73 2ee0 s GLY 7 Ca -0.19 0.84 -0.05 0.00 0.00 0.00 0.00 44.72 45.32 2ee0 s GLY 7 CO 0.65 1.14 0.14 -1.31 0.00 0.00 0.00 173.10 173.72 2ee0 s ASN 8 N 1.23 6.28 0.34 1.64 -0.87 -1.26 -5.11 114.94 117.19 2ee0 s ASN 8 Ca -0.09 0.40 0.02 0.00 -1.57 0.00 0.00 52.86 51.61 2ee0 s ASN 8 Cb -0.11 -1.99 -0.03 0.00 -0.02 0.00 0.00 41.25 39.10 2ee0 s ASN 8 CO -0.07 0.36 0.53 -1.81 -2.57 0.00 0.00 177.10 173.53 2ee0 s ASP 9 N -1.32 6.20 -0.90 -1.22 1.11 -1.26 -5.01 116.67 114.26 2ee0 s ASP 9 Ca 0.19 0.30 -0.03 0.00 0.18 0.00 0.00 52.55 53.19 2ee0 s ASP 9 Cb -0.12 -1.85 0.23 0.00 1.07 0.00 0.00 42.92 42.25 2ee0 s ASP 9 CO 0.09 -0.33 2.22 -0.46 1.18 0.00 0.00 175.17 177.87 2ee0 n ASN 10 N -1.75 7.35 -3.62 0.27 0.23 -1.26 -4.90 115.26 111.58 2ee0 n ASN 10 Ca -0.04 -3.52 -0.15 0.00 -0.53 0.00 0.00 54.58 50.34 2ee0 n ASN 10 Cb 0.57 -1.19 -0.07 0.00 -2.08 0.00 0.00 39.78 37.00 2ee0 n ASN 10 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ee0 s ARG 11 N -3.04 0.84 1.03 -3.83 1.70 -1.26 -4.93 118.95 109.47 2ee0 s ARG 11 Ca 0.50 0.61 -0.13 0.00 -0.47 0.00 0.00 55.73 56.25 2ee0 s ARG 11 Cb 0.31 0.40 0.21 0.00 -0.57 0.00 0.00 34.95 35.30 2ee0 s ARG 11 CO -0.23 -0.17 1.10 -1.25 -1.08 0.00 0.00 175.30 173.66 2ee0 s PRO 12 N -0.27 0.16 -0.13 3.89 0.04 -1.26 -4.95 135.00 132.48 2ee0 s PRO 12 Ca -0.05 0.42 -0.07 0.00 0.04 0.00 0.00 61.00 61.35 2ee0 s PRO 12 Cb -0.03 -1.71 0.05 0.00 0.04 0.00 0.00 34.50 32.85 2ee0 s PRO 12 CO 0.04 -2.89 0.32 0.08 0.04 0.00 0.00 177.00 174.59 2ee0 s VAL 13 N -2.97 -0.03 0.27 -0.36 1.01 -1.26 -4.99 120.40 112.07 2ee0 s VAL 13 Ca 0.66 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 2ee0 s VAL 13 Cb -0.18 -0.48 -0.09 0.00 0.00 0.00 0.00 36.38 35.63 2ee0 s VAL 13 CO 0.57 0.05 1.06 -0.36 0.00 0.00 0.00 175.10 176.42 2ee0 s PHE 14 N 1.24 3.68 0.28 5.22 0.08 -1.26 -4.62 117.98 122.59 2ee0 s PHE 14 Ca -0.09 1.75 -0.04 0.00 0.12 0.00 0.00 56.93 58.68 2ee0 s PHE 14 Cb -0.09 -3.21 0.56 0.00 -0.57 0.00 0.00 43.02 39.71 2ee0 s PHE 14 CO -0.10 -0.30 1.59 -0.22 -0.10 0.00 0.00 175.22 176.10 2ee0 h LYS 15 N 3.91 0.04 -2.31 0.44 1.63 -1.95 -3.38 116.57 114.96 2ee0 h LYS 15 Ca -0.46 -0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.21 2ee0 h LYS 15 Cb 1.21 -0.01 -0.29 0.00 -0.60 0.00 0.00 32.23 32.54 2ee0 h LYS 15 CO 0.67 0.03 -0.42 -1.21 -3.45 0.00 0.00 179.45 175.07 2ee0 s GLU 16 N -6.10 0.32 0.02 1.90 2.02 -1.26 -5.07 118.70 110.52 2ee0 s GLU 16 Ca -0.14 0.82 -0.05 0.00 0.02 0.00 0.00 54.97 55.62 2ee0 s GLU 16 Cb 0.26 -0.00 -0.02 0.00 0.10 0.00 0.00 34.13 34.47 2ee0 s GLU 16 CO 0.77 -0.40 1.09 0.78 0.02 0.00 0.00 175.26 177.52 2ee0 h GLY 17 N 8.19 -2.11 -5.50 -1.39 0.00 -1.92 -3.40 103.07 96.94 2ee0 h GLY 17 Ca -0.17 0.97 -0.66 0.00 0.00 0.00 0.00 47.33 47.47 2ee0 h GLY 17 CO 0.18 -0.75 -0.69 1.62 0.00 0.00 0.00 176.54 176.90 2ee0 s GLN 18 N -3.43 3.24 -0.05 4.80 0.74 -1.26 -3.22 119.66 120.48 2ee0 s GLN 18 Ca -0.02 -0.55 -0.08 0.00 0.05 0.00 0.00 55.36 54.75 2ee0 s GLN 18 Cb 0.02 -2.74 0.02 0.00 1.10 0.00 0.00 33.01 31.40 2ee0 s GLN 18 CO 0.10 0.42 0.20 0.08 -0.55 0.00 0.00 175.29 175.55 2ee0 s VAL 19 N -0.15 0.03 -0.14 1.34 1.01 -1.25 -5.05 120.40 116.19 2ee0 s VAL 19 Ca 0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 2ee0 s VAL 19 Cb -0.13 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 2ee0 s VAL 19 CO 0.03 -0.14 -0.05 -0.70 0.00 0.00 0.00 175.10 174.24 2ee0 s GLU 20 N -0.47 3.54 0.08 2.72 2.12 -1.26 -1.60 118.70 123.84 2ee0 s GLU 20 Ca -0.06 -0.53 0.09 0.00 0.36 0.00 0.00 54.97 54.83 2ee0 s GLU 20 Cb -0.04 -2.86 -0.03 0.00 0.26 0.00 0.00 34.13 31.46 2ee0 s GLU 20 CO 0.01 0.30 -0.24 0.14 -0.54 0.00 0.00 175.26 174.92 2ee0 s VAL 21 N 0.20 1.99 -0.25 3.70 -7.23 -0.77 -5.03 120.40 113.02 2ee0 s VAL 21 Ca -0.03 -1.49 -0.02 0.00 -1.81 0.00 0.00 61.98 58.64 2ee0 s VAL 21 Cb -0.14 -1.75 0.03 0.00 0.56 0.00 0.00 36.38 35.08 2ee0 s VAL 21 CO 0.03 0.17 -0.05 -1.38 -0.31 0.00 0.00 175.10 173.56 2ee0 s HIS 22 N -0.95 3.08 -0.01 2.82 -3.43 -1.26 -1.38 115.29 114.17 2ee0 s HIS 22 Ca 0.11 -1.57 0.00 0.00 -0.80 0.00 0.00 55.06 52.80 2ee0 s HIS 22 Cb -0.10 -2.07 0.01 0.00 -1.43 0.00 0.00 32.58 29.00 2ee0 s HIS 22 CO 0.04 -0.73 -0.00 -1.50 -2.00 0.00 0.00 174.74 170.54 2ee0 s ILE 23 N 1.32 0.06 0.67 -5.38 2.07 -0.82 -5.00 121.20 114.13 2ee0 s ILE 23 Ca -0.00 0.03 -0.14 0.00 -1.41 0.00 0.00 60.65 59.12 2ee0 s ILE 23 Cb -0.17 -0.10 0.01 0.00 0.13 0.00 0.00 42.46 42.32 2ee0 s ILE 23 CO -0.04 0.05 1.11 -2.16 -1.91 0.00 0.00 174.94 171.99 2ee0 s PRO 24 N 0.35 2.74 0.17 3.50 0.04 -1.26 -2.22 135.00 138.32 2ee0 s PRO 24 Ca -0.03 1.36 -0.06 0.00 0.04 0.00 0.00 61.00 62.31 2ee0 s PRO 24 Cb -0.05 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.61 2ee0 s PRO 24 CO -0.01 -1.29 1.50 1.05 0.04 0.00 0.00 177.00 178.29 2ee0 h GLU 25 N -0.10 0.71 0.00 4.56 4.11 -1.80 -2.67 114.58 119.39 2ee0 h GLU 25 Ca -0.46 -0.41 0.00 0.00 0.07 0.00 0.00 59.36 58.55 2ee0 h GLU 25 Cb 1.24 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2ee0 h GLU 25 CO 0.54 1.03 0.00 -1.71 0.07 0.00 0.00 179.01 178.94 2ee0 n ASN 26 N -4.00 0.00 -3.59 3.06 5.15 -1.26 -2.34 115.26 112.28 2ee0 n ASN 26 Ca -0.03 -0.85 -0.37 0.00 -0.60 0.00 0.00 54.58 52.73 2ee0 n ASN 26 Cb 0.58 -0.02 -0.01 0.00 -0.53 0.00 0.00 39.78 39.80 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 -1.02 -2.64 -2.16 5.20 0.00 -1.01 -4.81 120.51 114.07 2ee0 n ALA 27 Ca 0.21 0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.45 2ee0 n ALA 27 Cb 0.11 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.26 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 -0.83 4.35 0.02 0.00 0.04 -1.26 -4.81 135.00 132.51 2ee0 s PRO 28 Ca 0.51 2.04 -0.34 0.00 0.04 0.00 0.00 61.00 63.24 2ee0 s PRO 28 Cb -0.64 -3.25 -0.13 0.00 0.04 0.00 0.00 34.50 30.53 2ee0 s PRO 28 CO 0.49 -0.38 1.73 0.28 0.04 0.00 0.00 177.00 179.16 2ee0 n VAL 29 N 3.69 0.31 0.00 -0.36 0.31 -1.26 -2.00 118.33 119.02 2ee0 n VAL 29 Ca 0.10 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 2ee0 n VAL 29 Cb 0.43 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 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 3.92 0.92 3.76 2.92 0.00 0.66 -4.97 105.19 112.39 2ee0 n GLY 30 Ca 0.20 0.00 -0.39 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 2.10 -0.51 2.61 2.01 -0.85 -4.57 115.64 114.43 2ee0 s THR 31 Ca 0.00 0.08 -0.25 0.00 0.31 0.00 0.00 61.69 61.83 2ee0 s THR 31 Cb 0.00 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.50 2ee0 s THR 31 CO 0.00 0.01 0.96 -0.94 -0.69 0.00 0.00 174.62 173.95 2ee0 s SER 32 N -0.71 6.42 0.00 3.53 1.04 -1.26 -1.29 113.70 121.43 2ee0 s SER 32 Ca 0.65 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2ee0 s SER 32 Cb -0.42 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.25 2ee0 s SER 32 CO 0.52 -1.17 0.32 0.52 0.98 0.00 0.00 173.24 174.42 2ee0 n VAL 33 N 6.35 0.00 -3.97 5.02 0.31 0.11 -4.95 118.33 121.20 2ee0 n VAL 33 Ca 0.04 0.76 -0.13 0.00 -0.01 0.00 0.00 64.34 65.00 2ee0 n VAL 33 Cb 0.48 -1.62 -0.14 0.00 -0.91 0.00 0.00 33.84 31.65 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 -1.44 0.14 -0.15 2.52 -1.16 -1.20 -5.01 121.20 114.90 2ee0 s ILE 34 Ca 0.00 -0.17 0.02 0.00 -0.51 0.00 0.00 60.65 59.99 2ee0 s ILE 34 Cb 0.00 -0.15 0.01 0.00 0.61 0.00 0.00 42.46 42.94 2ee0 s ILE 34 CO 0.00 -0.02 -0.21 -1.58 -2.81 0.00 0.00 174.94 170.32 2ee0 s GLN 35 N -0.20 2.99 -0.24 3.50 2.00 -1.26 -1.85 119.66 124.59 2ee0 s GLN 35 Ca -0.01 -0.84 -0.10 0.00 -2.00 0.00 0.00 55.36 52.41 2ee0 s GLN 35 Cb -0.02 -2.44 -0.05 0.00 0.80 0.00 0.00 33.01 31.30 2ee0 s GLN 35 CO -0.00 -0.06 0.14 -0.51 -0.50 0.00 0.00 175.29 174.36 2ee0 s LEU 36 N 0.92 3.94 -0.40 3.68 1.43 -1.14 -4.99 118.68 122.13 2ee0 s LEU 36 Ca -0.04 0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.00 2ee0 s LEU 36 Cb -0.15 -2.06 0.06 0.00 0.03 0.00 0.00 46.19 44.08 2ee0 s LEU 36 CO -0.04 0.04 0.23 -1.00 0.23 0.00 0.00 176.35 175.81 2ee0 s HIS 37 N 1.17 3.31 -0.25 0.29 3.76 -1.26 -4.80 115.29 117.50 2ee0 s HIS 37 Ca 0.06 -1.38 0.03 0.00 -0.15 0.00 0.00 55.06 53.63 2ee0 s HIS 37 Cb -0.14 -2.77 0.06 0.00 1.11 0.00 0.00 32.58 30.84 2ee0 s HIS 37 CO 0.05 -0.79 -0.12 0.00 -0.85 0.00 0.00 174.74 173.04 2ee0 s ALA 38 N 1.46 2.55 -0.13 -1.40 0.00 -1.26 -4.01 121.76 118.96 2ee0 s ALA 38 Ca 0.02 -1.71 -0.02 0.00 0.00 0.00 0.00 51.96 50.25 2ee0 s ALA 38 Cb -0.22 -1.56 0.04 0.00 0.00 0.00 0.00 23.12 21.39 2ee0 s ALA 38 CO 0.03 -1.11 0.02 0.95 0.00 0.00 0.00 175.76 175.65 2ee0 s THR 39 N 1.13 0.45 0.02 0.00 -4.23 -1.26 -4.88 115.64 106.86 2ee0 s THR 39 Ca -0.07 -0.21 -0.18 0.00 -1.18 0.00 0.00 61.69 60.05 2ee0 s THR 39 Cb -0.19 -0.78 -0.28 0.00 1.34 0.00 0.00 72.50 72.59 2ee0 s THR 39 CO -0.06 0.03 1.06 -0.78 -0.54 0.00 0.00 174.62 174.33 2ee0 h ASP 40 N 8.29 0.70 -3.18 3.99 3.58 -1.95 -3.45 116.42 124.40 2ee0 h ASP 40 Ca -0.18 -0.83 -0.53 0.00 0.42 0.00 0.00 57.03 55.91 2ee0 h ASP 40 Cb 1.12 -0.22 -0.37 0.00 1.72 0.00 0.00 39.33 41.58 2ee0 h ASP 40 CO 0.30 1.47 -0.80 0.00 -2.88 0.00 0.00 179.24 177.32 2ee0 s ALA 41 N -2.92 1.32 -1.65 -0.78 0.00 -1.26 -4.98 121.76 111.49 2ee0 s ALA 41 Ca -0.11 -0.55 0.15 0.00 0.00 0.00 0.00 51.96 51.45 2ee0 s ALA 41 Cb 0.04 -0.91 0.07 0.00 0.00 0.00 0.00 23.12 22.31 2ee0 s ALA 41 CO 0.88 -0.42 0.90 -0.40 0.00 0.00 0.00 175.76 176.72 2ee0 n ASP 42 N 4.95 1.94 -4.62 0.00 5.75 -1.26 -4.32 116.55 118.98 2ee0 n ASP 42 Ca -0.12 -1.47 -0.42 0.00 -0.01 0.00 0.00 54.79 52.77 2ee0 n ASP 42 Cb 0.50 0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 40.75 2ee0 n ASP 42 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 2ee0 s ILE 43 N -1.48 4.82 0.00 2.12 -5.25 -1.26 -4.71 121.20 115.44 2ee0 s ILE 43 Ca 0.15 1.27 0.00 0.00 -0.99 0.00 0.00 60.65 61.08 2ee0 s ILE 43 Cb 0.12 -4.12 0.00 0.00 2.95 0.00 0.00 42.46 41.42 2ee0 s ILE 43 CO 0.26 -0.18 0.00 0.61 -1.79 0.00 0.00 174.94 173.85 2ee0 n GLY 44 N 4.09 1.74 3.49 6.27 0.00 -1.26 -4.77 105.19 114.75 2ee0 n GLY 44 Ca 0.04 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2ee0 n GLY 44 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ee0 n SER 45 N 5.11 3.03 -3.83 1.61 3.41 -1.26 -5.17 113.62 116.52 2ee0 n SER 45 Ca 0.00 -3.15 -0.09 0.00 -0.26 0.00 0.00 58.87 55.36 2ee0 n SER 45 Cb 0.00 0.45 -0.04 0.00 -0.26 0.00 0.00 64.21 64.35 2ee0 n SER 45 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ee0 s ASN 46 N -3.67 -0.18 0.53 4.04 4.22 -1.26 -4.44 114.94 114.19 2ee0 s ASN 46 Ca 0.03 -0.63 0.02 0.00 -2.14 0.00 0.00 52.86 50.14 2ee0 s ASN 46 Cb 0.00 0.56 0.03 0.00 1.28 0.00 0.00 41.25 43.12 2ee0 s ASN 46 CO 0.02 -1.05 0.75 0.00 -2.04 0.00 0.00 177.10 174.78 2ee0 s ALA 47 N -3.91 3.92 -0.50 3.54 0.00 -1.26 -5.06 121.76 118.48 2ee0 s ALA 47 Ca 0.13 -1.32 -0.12 0.00 0.00 0.00 0.00 51.96 50.65 2ee0 s ALA 47 Cb -0.00 -2.05 0.12 0.00 0.00 0.00 0.00 23.12 21.19 2ee0 s ALA 47 CO 0.00 -0.67 0.41 -1.21 0.00 0.00 0.00 175.76 174.30 2ee0 s GLU 48 N -4.70 2.71 -0.11 0.00 8.01 -1.26 -5.02 118.70 118.32 2ee0 s GLU 48 Ca 0.56 -1.73 -0.25 0.00 0.01 0.00 0.00 54.97 53.56 2ee0 s GLU 48 Cb -0.10 -4.09 -0.03 0.00 -4.31 0.00 0.00 34.13 25.60 2ee0 s GLU 48 CO 0.38 -1.25 0.78 0.42 0.01 0.00 0.00 175.26 175.60 2ee0 s ILE 49 N 1.47 4.96 -0.08 -1.63 1.01 -1.26 -4.96 121.20 120.70 2ee0 s ILE 49 Ca 0.04 1.58 -0.16 0.00 0.00 0.00 0.00 60.65 62.11 2ee0 s ILE 49 Cb -0.28 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 38.04 2ee0 s ILE 49 CO 0.01 0.14 0.43 -0.13 0.00 0.00 0.00 174.94 175.39 2ee0 s ARG 50 N 1.46 4.19 -0.38 2.79 0.52 -1.25 -4.82 118.95 121.47 2ee0 s ARG 50 Ca 0.39 0.39 -0.13 0.00 -0.52 0.00 0.00 55.73 55.86 2ee0 s ARG 50 Cb -0.17 -3.36 0.01 0.00 0.52 0.00 0.00 34.95 31.94 2ee0 s ARG 50 CO 0.16 0.35 0.25 0.71 0.02 0.00 0.00 175.30 176.80 2ee0 s TYR 51 N 0.01 3.23 0.49 -0.53 1.51 -1.24 -3.97 117.35 116.85 2ee0 s TYR 51 Ca 0.24 -0.58 0.06 0.00 -1.01 0.00 0.00 57.07 55.78 2ee0 s TYR 51 Cb -0.15 -2.51 0.00 0.00 -0.11 0.00 0.00 41.96 39.19 2ee0 s TYR 51 CO 0.11 -0.54 0.32 0.96 -1.11 0.00 0.00 175.55 175.29 2ee0 s ILE 52 N 1.65 1.98 0.27 2.71 -4.36 -1.22 -3.88 121.20 118.35 2ee0 s ILE 52 Ca 0.05 -1.54 -0.29 0.00 -0.26 0.00 0.00 60.65 58.60 2ee0 s ILE 52 Cb -0.18 -2.52 -0.09 0.00 1.25 0.00 0.00 42.46 40.92 2ee0 s ILE 52 CO 0.09 0.00 1.02 -0.36 0.24 0.00 0.00 174.94 175.93 2ee0 s PHE 53 N -2.68 3.75 0.00 1.37 0.08 -1.26 -2.45 117.98 116.79 2ee0 s PHE 53 Ca 0.37 1.80 0.00 0.00 0.12 0.00 0.00 56.93 59.22 2ee0 s PHE 53 Cb -0.01 -3.14 0.00 0.00 -0.57 0.00 0.00 43.02 39.30 2ee0 s PHE 53 CO 0.22 -0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.65 2ee0 n GLY 54 N 1.27 -3.21 3.82 4.36 0.00 0.31 -4.81 105.19 106.94 2ee0 n GLY 54 Ca -0.01 -1.10 -0.27 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 -2.04 3.65 -1.47 4.61 0.00 -1.26 -4.55 121.76 120.71 2ee0 s ALA 55 Ca 0.00 -1.14 -0.05 0.00 0.00 0.00 0.00 51.96 50.77 2ee0 s ALA 55 Cb 0.00 -1.46 0.04 0.00 0.00 0.00 0.00 23.12 21.70 2ee0 s ALA 55 CO 0.00 0.55 0.54 1.04 0.00 0.00 0.00 175.76 177.90 2ee0 n GLN 56 N -0.25 -3.50 -3.61 0.00 6.02 -1.26 -4.93 117.38 109.85 2ee0 n GLN 56 Ca -0.08 0.42 -0.39 0.00 -0.01 0.00 0.00 57.00 56.95 2ee0 n GLN 56 Cb 0.54 -4.74 -0.11 0.00 1.02 0.00 0.00 30.24 26.95 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 -3.77 5.01 0.58 5.09 1.01 -1.26 -5.07 120.40 121.99 2ee0 s VAL 57 Ca 0.20 -0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.86 2ee0 s VAL 57 Cb -0.11 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2ee0 s VAL 57 CO 0.89 0.15 1.22 0.00 0.00 0.00 0.00 175.10 177.36 2ee0 n ALA 58 N 5.04 1.03 -0.09 5.51 0.00 -1.26 -4.94 120.51 125.80 2ee0 n ALA 58 Ca -0.14 0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.24 2ee0 n ALA 58 Cb 0.51 -2.27 -0.04 0.00 0.00 0.00 0.00 19.45 17.65 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 0.97 0.71 -0.72 0.00 0.13 -1.99 -3.21 132.00 127.90 2ee0 h PRO 59 Ca -0.50 -0.37 0.16 0.00 -0.87 0.00 0.00 66.00 64.42 2ee0 h PRO 59 Cb 1.33 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.35 2ee0 h PRO 59 CO 0.54 0.99 0.04 0.00 -0.23 0.00 0.00 178.00 179.34 2ee0 h ALA 60 N 0.71 0.78 -0.11 -0.56 0.00 -2.00 0.47 119.26 118.55 2ee0 h ALA 60 Ca 0.05 0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2ee0 h ALA 60 Cb 0.86 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2ee0 h ALA 60 CO 0.07 -0.40 -0.11 1.15 0.00 0.00 0.00 179.25 179.96 2ee0 h THR 61 N 0.13 1.14 0.00 0.00 2.02 -1.95 -1.33 112.91 112.93 2ee0 h THR 61 Ca 0.39 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.95 2ee0 h THR 61 Cb 0.68 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 2ee0 h THR 61 CO -0.61 0.19 0.00 0.11 0.37 0.00 0.00 175.52 175.58 2ee0 h LYS 62 N 0.16 0.00 0.18 6.66 1.57 -0.18 -2.91 116.57 122.06 2ee0 h LYS 62 Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2ee0 h LYS 62 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2ee0 h LYS 62 CO 0.02 0.00 -0.09 -0.09 -0.57 0.00 0.00 179.45 178.72 2ee0 h ARG 63 N 0.00 -0.23 -0.16 3.15 9.65 0.29 -3.37 114.38 123.71 2ee0 h ARG 63 Ca 0.00 0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.90 2ee0 h ARG 63 Cb 0.81 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.44 2ee0 h ARG 63 CO 0.00 -0.08 0.10 -0.07 2.80 0.00 0.00 179.97 182.72 2ee0 h LEU 64 N -1.05 0.18 -9.52 3.80 4.07 -1.63 -3.39 115.31 107.78 2ee0 h LEU 64 Ca -0.02 -0.04 -0.66 0.00 0.08 0.00 0.00 57.88 57.24 2ee0 h LEU 64 Cb 0.26 -0.05 -0.09 0.00 1.08 0.00 0.00 40.66 41.87 2ee0 h LEU 64 CO 0.04 0.17 -0.51 -0.36 -1.08 0.00 0.00 178.44 176.70 2ee0 s PHE 65 N -6.05 3.50 -0.14 1.13 0.40 -1.10 0.14 117.98 115.86 2ee0 s PHE 65 Ca -0.13 0.44 0.02 0.00 -0.60 0.00 0.00 56.93 56.65 2ee0 s PHE 65 Cb 0.08 -1.95 0.01 0.00 0.51 0.00 0.00 43.02 41.66 2ee0 s PHE 65 CO 0.69 0.62 -0.20 0.00 0.70 0.00 0.00 175.22 177.03 2ee0 s ALA 66 N -0.78 2.32 -0.24 5.36 0.00 0.35 -4.34 121.76 124.43 2ee0 s ALA 66 Ca 0.13 -1.07 -0.11 0.00 0.00 0.00 0.00 51.96 50.91 2ee0 s ALA 66 Cb -0.12 -1.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.89 2ee0 s ALA 66 CO 0.03 -0.02 0.18 -1.17 0.00 0.00 0.00 175.76 174.79 2ee0 s LEU 67 N 0.79 4.11 -0.33 0.00 2.96 -1.26 -0.61 118.68 124.33 2ee0 s LEU 67 Ca -0.07 0.13 -0.29 0.00 -0.22 0.00 0.00 54.13 53.68 2ee0 s LEU 67 Cb -0.16 -2.14 0.01 0.00 0.50 0.00 0.00 46.19 44.41 2ee0 s LEU 67 CO -0.01 0.04 1.14 0.20 -1.32 0.00 0.00 176.35 176.39 2ee0 s ASN 68 N 1.15 6.84 0.00 3.68 -0.87 0.62 -4.88 114.94 121.48 2ee0 s ASN 68 Ca 0.08 1.02 0.02 0.00 -1.57 0.00 0.00 52.86 52.42 2ee0 s ASN 68 Cb -0.14 -2.54 0.14 0.00 -0.02 0.00 0.00 41.25 38.68 2ee0 s ASN 68 CO 0.06 -0.97 1.04 0.59 -2.57 0.00 0.00 177.10 175.25 2ee0 n ASN 69 N 7.16 0.00 -0.02 -1.22 4.13 -1.25 0.25 115.26 124.31 2ee0 n ASN 69 Ca 0.13 -1.83 -0.01 0.00 1.68 0.00 0.00 54.58 54.54 2ee0 n ASN 69 Cb 0.47 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.68 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 -0.54 0.23 -1.20 3.41 -2.24 -1.26 -3.70 114.28 108.99 2ee0 n THR 70 Ca 0.02 -0.15 0.03 0.00 -2.27 0.00 0.00 64.05 61.67 2ee0 n THR 70 Cb 0.01 -0.72 0.04 0.00 -2.10 0.00 0.00 70.33 67.56 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 -2.08 0.75 -4.30 4.28 -2.24 -1.18 -4.98 114.28 104.53 2ee0 n THR 71 Ca -0.06 -0.87 -0.38 0.00 -2.27 0.00 0.00 64.05 60.48 2ee0 n THR 71 Cb 0.56 0.36 -0.08 0.00 -2.10 0.00 0.00 70.33 69.07 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 -0.53 -0.33 3.36 3.38 0.00 0.14 -4.77 105.19 106.44 2ee0 n GLY 72 Ca 0.05 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -6.84 2.61 -0.29 0.99 2.96 -1.21 -2.88 118.68 114.01 2ee0 s LEU 73 Ca 0.65 -0.35 -0.12 0.00 -0.22 0.00 0.00 54.13 54.08 2ee0 s LEU 73 Cb -0.38 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2ee0 s LEU 73 CO 0.95 0.19 0.25 -0.63 -1.32 0.00 0.00 176.35 175.78 2ee0 s ILE 74 N 0.22 5.27 0.31 6.68 1.01 -0.77 -0.28 121.20 133.64 2ee0 s ILE 74 Ca -0.10 0.20 0.10 0.00 0.00 0.00 0.00 60.65 60.86 2ee0 s ILE 74 Cb -0.16 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 2ee0 s ILE 74 CO 0.06 0.18 -0.09 0.42 0.00 0.00 0.00 174.94 175.50 2ee0 s THR 75 N 1.84 2.57 -0.56 2.92 -4.23 0.22 0.06 115.64 118.47 2ee0 s THR 75 Ca 0.09 -2.18 -0.28 0.00 -1.18 0.00 0.00 61.69 58.14 2ee0 s THR 75 Cb -0.16 -2.59 0.03 0.00 1.34 0.00 0.00 72.50 71.12 2ee0 s THR 75 CO 0.11 -0.29 1.19 -0.69 -0.54 0.00 0.00 174.62 174.40 2ee0 s VAL 76 N -2.52 4.05 -0.02 2.29 1.01 -0.41 -0.50 120.40 124.31 2ee0 s VAL 76 Ca 0.32 0.97 -0.24 0.00 0.00 0.00 0.00 61.98 63.03 2ee0 s VAL 76 Cb -0.02 -4.69 -0.18 0.00 0.00 0.00 0.00 36.38 31.49 2ee0 s VAL 76 CO 0.17 -1.26 1.16 -0.61 0.00 0.00 0.00 175.10 174.56 2ee0 h GLN 77 N 9.53 -0.19 -4.51 2.72 4.15 0.10 0.19 115.11 127.10 2ee0 h GLN 77 Ca -0.25 0.01 -0.23 0.00 0.77 0.00 0.00 58.65 58.96 2ee0 h GLN 77 Cb 1.06 0.04 -0.14 0.00 0.21 0.00 0.00 27.48 28.65 2ee0 h GLN 77 CO 1.17 0.22 -0.57 1.03 -1.93 0.00 0.00 178.83 178.76 2ee0 s ARG 78 N -4.20 1.24 0.70 1.69 0.52 -0.86 -4.73 118.95 113.31 2ee0 s ARG 78 Ca -0.14 -1.60 -0.17 0.00 -0.52 0.00 0.00 55.73 53.30 2ee0 s ARG 78 Cb 0.02 0.29 -0.08 0.00 0.52 0.00 0.00 34.95 35.70 2ee0 s ARG 78 CO 0.58 -0.42 0.21 -1.13 0.02 0.00 0.00 175.30 174.56 2ee0 n SER 79 N -0.30 -2.38 -4.76 0.23 3.41 -1.26 -4.81 113.62 103.74 2ee0 n SER 79 Ca 0.02 0.56 -0.30 0.00 -0.26 0.00 0.00 58.87 58.88 2ee0 n SER 79 Cb 0.66 -1.07 -0.07 0.00 -0.26 0.00 0.00 64.21 63.47 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 2.07 3.76 0.17 1.04 1.43 -0.99 -4.88 118.68 121.28 2ee0 s LEU 80 Ca 0.60 -0.03 0.11 0.00 -1.03 0.00 0.00 54.13 53.78 2ee0 s LEU 80 Cb -0.36 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 2ee0 s LEU 80 CO 0.63 0.17 -0.24 -1.81 0.23 0.00 0.00 176.35 175.33 2ee0 s ASP 81 N -2.38 3.30 -0.04 2.29 1.01 -1.26 -4.74 116.67 114.84 2ee0 s ASP 81 Ca 0.29 -0.82 0.00 0.00 0.71 0.00 0.00 52.55 52.73 2ee0 s ASP 81 Cb -0.12 -0.23 -0.03 0.00 1.01 0.00 0.00 42.92 43.55 2ee0 s ASP 81 CO 0.22 0.12 -0.04 0.54 0.21 0.00 0.00 175.17 176.22 2ee0 n ARG 82 N 0.49 0.11 -0.35 8.23 1.74 -1.25 -4.23 116.66 121.39 2ee0 n ARG 82 Ca -0.14 0.03 0.35 0.00 -0.77 0.00 0.00 57.85 57.31 2ee0 n ARG 82 Cb 0.55 -1.08 0.56 0.00 -1.02 0.00 0.00 32.46 31.47 2ee0 n ARG 82 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 2ee0 h GLU 83 N -0.00 0.00 0.00 5.56 -0.00 -2.02 -1.47 114.58 116.65 2ee0 h GLU 83 Ca -0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.24 2ee0 h GLU 83 Cb 1.15 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.90 2ee0 h GLU 83 CO -0.02 0.00 -1.01 -1.91 -0.00 0.00 0.00 179.01 176.07 2ee0 n GLU 84 N -3.47 0.52 -4.00 1.06 0.00 -1.26 -5.03 120.64 108.46 2ee0 n GLU 84 Ca 0.29 0.25 -0.15 0.00 0.00 0.00 0.00 57.16 57.55 2ee0 n GLU 84 Cb 1.65 -1.46 -0.15 0.00 0.00 0.00 0.00 31.44 31.48 2ee0 n GLU 84 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2ee0 s THR 85 N -2.82 0.21 -0.25 6.31 -1.32 -0.55 -5.05 115.64 112.16 2ee0 s THR 85 Ca -0.28 -0.07 -0.04 0.00 -1.21 0.00 0.00 61.69 60.09 2ee0 s THR 85 Cb 0.04 -0.21 -0.16 0.00 -1.51 0.00 0.00 72.50 70.66 2ee0 s THR 85 CO 0.41 0.08 -0.20 0.00 -2.21 0.00 0.00 174.62 172.70 2ee0 n ALA 86 N 3.30 1.30 -2.85 11.08 0.00 -1.26 -3.89 120.51 128.18 2ee0 n ALA 86 Ca -0.16 -1.04 -0.37 0.00 0.00 0.00 0.00 53.44 51.87 2ee0 n ALA 86 Cb 0.57 -0.09 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 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 -2.51 5.42 -0.18 0.00 -1.09 -1.26 -3.42 121.20 118.15 2ee0 s ILE 87 Ca -0.35 0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.26 2ee0 s ILE 87 Cb 0.10 -3.37 0.03 0.00 -1.58 0.00 0.00 42.46 37.65 2ee0 s ILE 87 CO 0.58 0.60 -0.13 -1.00 -1.23 0.00 0.00 174.94 173.76 2ee0 s HIS 88 N -0.86 2.40 -0.39 3.97 3.76 -0.82 -4.98 115.29 118.37 2ee0 s HIS 88 Ca 0.14 -1.50 -0.07 0.00 -0.15 0.00 0.00 55.06 53.48 2ee0 s HIS 88 Cb -0.12 -1.66 0.07 0.00 1.11 0.00 0.00 32.58 31.98 2ee0 s HIS 88 CO 0.03 -0.73 0.20 0.15 -0.85 0.00 0.00 174.74 173.55 2ee0 s LYS 89 N 1.40 2.50 -0.13 1.40 1.02 -1.26 -1.34 119.74 123.32 2ee0 s LYS 89 Ca 0.01 -1.46 -0.02 0.00 0.02 0.00 0.00 55.97 54.52 2ee0 s LYS 89 Cb -0.15 -3.65 -0.02 0.00 -0.52 0.00 0.00 37.83 33.49 2ee0 s LYS 89 CO -0.09 -0.90 -0.06 0.08 -0.92 0.00 0.00 175.35 173.45 2ee0 s VAL 90 N 1.36 3.67 -0.31 3.17 1.01 -1.09 -4.93 120.40 123.28 2ee0 s VAL 90 Ca 0.02 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 2ee0 s VAL 90 Cb -0.22 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.60 2ee0 s VAL 90 CO 0.01 0.52 0.09 -0.89 0.00 0.00 0.00 175.10 174.83 2ee0 s THR 91 N 0.15 3.93 -0.03 3.92 2.01 -1.26 -2.35 115.64 122.02 2ee0 s THR 91 Ca -0.03 -0.80 -0.06 0.00 0.31 0.00 0.00 61.69 61.11 2ee0 s THR 91 Cb -0.14 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2ee0 s THR 91 CO 0.03 0.01 0.22 -0.69 -0.69 0.00 0.00 174.62 173.50 2ee0 s VAL 92 N 1.48 5.38 0.19 3.82 1.01 -1.12 -0.53 120.40 130.63 2ee0 s VAL 92 Ca 0.02 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.18 2ee0 s VAL 92 Cb -0.18 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2ee0 s VAL 92 CO 0.03 0.43 0.03 -0.76 0.00 0.00 0.00 175.10 174.82 2ee0 s LEU 93 N -1.60 3.41 -0.05 3.92 1.43 -1.03 -2.72 118.68 122.04 2ee0 s LEU 93 Ca 0.24 -0.37 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2ee0 s LEU 93 Cb -0.13 -2.03 0.04 0.00 0.03 0.00 0.00 46.19 44.09 2ee0 s LEU 93 CO 0.14 0.07 0.10 0.00 0.23 0.00 0.00 176.35 176.88 2ee0 s ALA 94 N -1.82 0.02 0.10 4.21 0.00 -0.74 -3.44 121.76 120.09 2ee0 s ALA 94 Ca 0.29 0.39 0.08 0.00 0.00 0.00 0.00 51.96 52.72 2ee0 s ALA 94 Cb -0.09 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 2ee0 s ALA 94 CO 0.20 -0.39 -0.20 0.45 0.00 0.00 0.00 175.76 175.82 2ee0 s SER 95 N 1.85 2.41 -0.09 0.00 0.15 -1.25 -1.18 113.70 115.59 2ee0 s SER 95 Ca -0.00 -0.68 0.21 0.00 0.70 0.00 0.00 55.95 56.17 2ee0 s SER 95 Cb -0.12 -0.13 0.43 0.00 -1.71 0.00 0.00 66.02 64.49 2ee0 s SER 95 CO -0.04 0.03 1.18 -0.90 1.20 0.00 0.00 173.24 174.71 2ee0 n ASP 96 N 1.08 1.35 0.00 5.45 5.68 -1.26 -3.89 116.55 124.95 2ee0 n ASP 96 Ca -0.19 -2.67 0.00 0.00 -0.50 0.00 0.00 54.79 51.43 2ee0 n ASP 96 Cb 0.54 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 2ee0 n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ee0 n GLY 97 N -0.11 1.00 0.41 6.12 0.00 -1.26 -4.86 105.19 106.49 2ee0 n GLY 97 Ca 0.11 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 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 1.38 -3.25 1.61 7.64 -1.26 -5.01 113.62 114.73 2ee0 n SER 98 Ca 0.00 0.21 -0.42 0.00 1.01 0.00 0.00 58.87 59.67 2ee0 n SER 98 Cb 0.00 -0.53 -0.05 0.00 -1.01 0.00 0.00 64.21 62.62 2ee0 n SER 98 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ee0 n SER 99 N -3.78 -0.09 -4.44 6.43 3.41 -1.26 -4.71 113.62 109.17 2ee0 n SER 99 Ca -0.36 0.84 -0.44 0.00 -0.26 0.00 0.00 58.87 58.64 2ee0 n SER 99 Cb 0.76 -0.67 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 2ee0 n SER 99 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2ee0 n THR 100 N 0.99 1.74 -2.15 6.66 -2.24 -1.26 -4.57 114.28 113.44 2ee0 n THR 100 Ca 0.14 -0.50 -0.42 0.00 -2.27 0.00 0.00 64.05 61.00 2ee0 n THR 100 Cb 0.07 -0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 67.89 2ee0 n THR 100 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2ee0 s PRO 101 N -1.30 4.22 0.36 -0.78 0.04 -1.26 -4.89 135.00 131.39 2ee0 s PRO 101 Ca 0.62 2.02 -0.27 0.00 0.04 0.00 0.00 61.00 63.40 2ee0 s PRO 101 Cb -0.74 -3.83 -0.09 0.00 0.04 0.00 0.00 34.50 29.88 2ee0 s PRO 101 CO 0.58 -0.75 1.28 0.00 0.04 0.00 0.00 177.00 178.16 2ee0 s ALA 102 N 3.50 3.37 0.09 8.56 0.00 -0.33 -4.69 121.76 132.26 2ee0 s ALA 102 Ca 0.67 1.21 0.06 0.00 0.00 0.00 0.00 51.96 53.89 2ee0 s ALA 102 Cb -0.30 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.31 2ee0 s ALA 102 CO 0.25 -0.68 -0.06 -0.98 0.00 0.00 0.00 175.76 174.29 2ee0 s ARG 103 N -2.00 2.31 -0.16 0.00 1.70 -1.26 -1.80 118.95 117.74 2ee0 s ARG 103 Ca 0.52 -0.93 -0.06 0.00 -0.47 0.00 0.00 55.73 54.79 2ee0 s ARG 103 Cb -0.38 -2.40 0.07 0.00 -0.57 0.00 0.00 34.95 31.67 2ee0 s ARG 103 CO 0.49 0.53 0.35 0.00 -1.08 0.00 0.00 175.30 175.59 2ee0 s ALA 104 N -1.22 -0.87 0.01 7.88 0.00 -1.10 -4.97 121.76 121.48 2ee0 s ALA 104 Ca 0.22 1.25 -0.20 0.00 0.00 0.00 0.00 51.96 53.23 2ee0 s ALA 104 Cb -0.11 -1.10 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 2ee0 s ALA 104 CO 0.15 -0.61 0.59 0.99 0.00 0.00 0.00 175.76 176.88 2ee0 s THR 105 N 2.28 4.89 -0.06 0.00 2.01 -1.20 -2.79 115.64 120.77 2ee0 s THR 105 Ca -0.02 1.25 0.04 0.00 0.31 0.00 0.00 61.69 63.26 2ee0 s THR 105 Cb -0.11 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.47 2ee0 s THR 105 CO -0.11 0.43 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.39 2ee0 s VAL 106 N -0.29 1.48 -0.31 3.82 1.01 -0.99 -3.87 120.40 121.26 2ee0 s VAL 106 Ca 0.31 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 2ee0 s VAL 106 Cb -0.18 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.91 2ee0 s VAL 106 CO 0.17 0.43 0.11 -0.89 0.00 0.00 0.00 175.10 174.93 2ee0 s THR 107 N 0.29 4.21 -0.16 3.92 2.01 -0.63 -2.68 115.64 122.61 2ee0 s THR 107 Ca -0.10 -0.62 -0.05 0.00 0.31 0.00 0.00 61.69 61.23 2ee0 s THR 107 Cb -0.14 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 2ee0 s THR 107 CO 0.04 0.05 0.02 -0.63 -0.69 0.00 0.00 174.62 173.41 2ee0 s ILE 108 N 1.54 4.41 -0.10 1.82 1.01 -0.45 -1.84 121.20 127.59 2ee0 s ILE 108 Ca 0.03 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.52 2ee0 s ILE 108 Cb -0.17 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 2ee0 s ILE 108 CO 0.04 0.50 -0.15 0.20 0.00 0.00 0.00 174.94 175.53 2ee0 s ASN 109 N 0.14 3.91 -0.34 3.58 0.01 -0.48 -1.94 114.94 119.82 2ee0 s ASN 109 Ca 0.02 -0.31 -0.14 0.00 -0.71 0.00 0.00 52.86 51.72 2ee0 s ASN 109 Cb -0.13 -1.31 -0.01 0.00 0.41 0.00 0.00 41.25 40.21 2ee0 s ASN 109 CO 0.02 0.23 0.31 -0.69 -1.51 0.00 0.00 177.10 175.45 2ee0 s VAL 110 N -0.02 5.22 0.14 1.60 1.01 -1.22 -1.94 120.40 125.19 2ee0 s VAL 110 Ca -0.04 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.88 2ee0 s VAL 110 Cb -0.14 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2ee0 s VAL 110 CO 0.04 -0.06 0.26 0.42 0.00 0.00 0.00 175.10 175.76 2ee0 s THR 111 N 1.88 5.25 1.40 3.92 -4.23 -0.94 -4.91 115.64 118.02 2ee0 s THR 111 Ca 0.09 -0.69 -0.23 0.00 -1.18 0.00 0.00 61.69 59.69 2ee0 s THR 111 Cb -0.17 -3.68 0.35 0.00 1.34 0.00 0.00 72.50 70.34 2ee0 s THR 111 CO 0.11 -0.06 0.80 -0.67 -0.54 0.00 0.00 174.62 174.26 2ee0 n ASP 112 N -0.42 -3.99 -3.67 3.99 2.03 -1.26 -2.95 116.55 110.29 2ee0 n ASP 112 Ca -0.07 -0.79 -0.20 0.00 0.52 0.00 0.00 54.79 54.25 2ee0 n ASP 112 Cb 0.54 -0.97 -0.18 0.00 -0.72 0.00 0.00 41.12 39.79 2ee0 n ASP 112 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2ee0 s VAL 113 N -2.11 -0.12 -2.00 5.18 -7.23 -1.26 -4.67 120.40 108.20 2ee0 s VAL 113 Ca 0.62 0.41 0.16 0.00 -1.81 0.00 0.00 61.98 61.36 2ee0 s VAL 113 Cb -0.11 -0.17 0.44 0.00 0.56 0.00 0.00 36.38 37.10 2ee0 s VAL 113 CO 0.52 0.17 1.34 -0.46 -0.31 0.00 0.00 175.10 176.36