#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2re7 n ASN 3 N 0.00 1.72 -3.36 6.43 3.02 -1.26 -4.97 115.26 116.84 2re7 n ASN 3 Ca 0.00 -2.90 -0.04 0.00 -0.03 0.00 0.00 54.58 51.61 2re7 n ASN 3 Cb 0.00 -0.54 0.01 0.00 -0.61 0.00 0.00 39.78 38.64 2re7 n ASN 3 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2re7 s GLN 4 N -3.03 1.42 -0.05 3.52 -2.07 -1.26 -5.19 119.66 113.01 2re7 s GLN 4 Ca 0.32 -0.90 0.02 0.00 -1.82 0.00 0.00 55.36 52.98 2re7 s GLN 4 Cb 0.43 0.41 0.02 0.00 -1.09 0.00 0.00 33.01 32.77 2re7 s GLN 4 CO -0.01 -0.66 -0.07 -1.59 -1.32 0.00 0.00 175.29 171.63 2re7 s LYS 5 N -2.36 1.09 -0.17 9.60 0.00 -1.26 -4.82 119.74 121.82 2re7 s LYS 5 Ca 0.19 -0.21 0.17 0.00 0.00 0.00 0.00 55.97 56.12 2re7 s LYS 5 Cb -0.03 -1.00 0.45 0.00 0.00 0.00 0.00 37.83 37.25 2re7 s LYS 5 CO 0.06 -0.03 1.18 0.72 0.00 0.00 0.00 175.35 177.28 2re7 n HIS 6 N 3.89 0.74 -0.02 1.78 8.25 -1.26 -5.04 115.22 123.56 2re7 n HIS 6 Ca -0.24 -1.44 -0.11 0.00 -0.26 0.00 0.00 57.72 55.67 2re7 n HIS 6 Cb 0.51 -0.23 -0.05 0.00 1.12 0.00 0.00 29.99 31.34 2re7 n HIS 6 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2re7 h ILE 7 N 3.87 1.09 -0.11 1.59 2.04 -1.99 -1.08 117.51 122.92 2re7 h ILE 7 Ca -0.03 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.61 2re7 h ILE 7 Cb 1.43 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 2re7 h ILE 7 CO 0.20 0.08 -0.07 -0.90 0.00 0.00 0.00 178.15 177.47 2re7 n ASP 8 N -4.95 -0.12 0.09 1.72 5.68 -1.26 -0.59 116.55 117.13 2re7 n ASP 8 Ca -0.05 0.63 -0.04 0.00 -0.50 0.00 0.00 54.79 54.83 2re7 n ASP 8 Cb 0.07 -0.24 0.14 0.00 -1.14 0.00 0.00 41.12 39.94 2re7 n ASP 8 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2re7 h LYS 9 N 0.00 0.21 -0.06 0.11 3.64 -1.66 -1.99 116.57 116.82 2re7 h LYS 9 Ca 0.02 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2re7 h LYS 9 Cb 0.05 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2re7 h LYS 9 CO -0.10 0.73 0.00 0.82 -2.27 0.00 0.00 179.45 178.63 2re7 h ILE 10 N 0.16 1.24 -0.51 2.00 2.04 -1.16 0.26 117.51 121.53 2re7 h ILE 10 Ca -0.00 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.13 2re7 h ILE 10 Cb 1.07 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 38.73 2re7 h ILE 10 CO 0.09 0.20 0.34 1.56 0.00 0.00 0.00 178.15 180.34 2re7 h GLN 11 N -0.17 0.67 -0.08 2.37 4.20 -0.76 -0.19 115.11 121.15 2re7 h GLN 11 Ca 0.02 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2re7 h GLN 11 Cb 0.31 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2re7 h GLN 11 CO 0.00 0.44 0.05 0.00 -0.67 0.00 0.00 178.83 178.65 2re7 h ALA 12 N 1.68 0.10 -0.91 3.87 0.00 -1.00 -1.53 119.26 121.47 2re7 h ALA 12 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2re7 h ALA 12 Cb -0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2re7 h ALA 12 CO -0.04 -0.38 0.57 0.28 0.00 0.00 0.00 179.25 179.67 2re7 h VAL 13 N 0.07 1.25 -0.52 0.00 2.07 0.42 -2.40 116.25 117.14 2re7 h VAL 13 Ca 0.03 -0.52 -0.10 0.00 0.82 0.00 0.00 66.70 66.93 2re7 h VAL 13 Cb 0.03 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.73 2re7 h VAL 13 CO -0.01 0.25 -0.08 0.40 0.02 0.00 0.00 177.57 178.16 2re7 h ILE 14 N 1.25 1.26 0.00 4.57 2.04 -0.87 -2.66 117.51 123.11 2re7 h ILE 14 Ca 0.33 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 2re7 h ILE 14 Cb -0.08 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2re7 h ILE 14 CO -0.06 0.43 -0.23 0.11 0.00 0.00 0.00 178.15 178.39 2re7 h LYS 15 N 0.86 0.00 0.00 2.37 1.57 -1.00 -2.68 116.57 117.69 2re7 h LYS 15 Ca 0.14 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2re7 h LYS 15 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 2re7 h LYS 15 CO 0.04 0.23 -0.26 0.22 -0.57 0.00 0.00 179.45 179.11 2re7 h ASP 16 N 0.00 0.00 -3.39 0.86 3.58 -1.10 -3.45 116.42 112.92 2re7 h ASP 16 Ca -0.00 0.00 -0.60 0.00 0.42 0.00 0.00 57.03 56.85 2re7 h ASP 16 Cb 0.41 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.35 2re7 h ASP 16 CO 0.03 0.26 -0.37 -0.69 -2.88 0.00 0.00 179.24 175.58 2re7 s VAL 17 N -3.46 5.32 0.16 2.25 1.01 -1.01 -4.91 120.40 119.76 2re7 s VAL 17 Ca 0.02 0.43 -0.12 0.00 0.00 0.00 0.00 61.98 62.31 2re7 s VAL 17 Cb 0.09 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.92 2re7 s VAL 17 CO 0.66 0.36 1.64 0.50 0.00 0.00 0.00 175.10 178.26 2re7 h LYS 18 N 7.00 0.88 -4.12 2.72 3.64 -1.88 -3.43 116.57 121.38 2re7 h LYS 18 Ca -0.39 -0.24 -0.45 0.00 -1.27 0.00 0.00 60.65 58.29 2re7 h LYS 18 Cb 1.16 -0.10 -0.35 0.00 -0.41 0.00 0.00 32.23 32.53 2re7 h LYS 18 CO 0.73 0.86 -0.78 -0.06 -2.27 0.00 0.00 179.45 177.93 2re7 s PHE 19 N -5.18 0.99 0.00 1.91 0.08 -1.26 -4.33 117.98 110.19 2re7 s PHE 19 Ca -0.13 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.58 2re7 s PHE 19 Cb 0.12 -0.85 0.00 0.00 -0.57 0.00 0.00 43.02 41.72 2re7 s PHE 19 CO 0.81 -0.28 0.00 0.00 -0.10 0.00 0.00 175.22 175.66 2re7 n ALA 20 N 4.29 0.00 -3.44 5.36 0.00 -1.26 -4.76 120.51 120.69 2re7 n ALA 20 Ca -0.20 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.25 2re7 n ALA 20 Cb 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 2re7 n ALA 20 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2re7 s ILE 22 N 0.00 -0.36 -0.08 0.00 2.07 -0.41 -4.13 121.20 118.30 2re7 s ILE 22 Ca 0.00 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.22 2re7 s ILE 22 Cb 0.00 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.56 2re7 s ILE 22 CO 0.00 0.00 0.03 -0.44 -1.91 0.00 0.00 174.94 172.62 2re7 s SER 23 N 2.16 5.43 0.09 4.50 0.01 0.97 -1.49 113.70 125.37 2re7 s SER 23 Ca -0.04 0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.41 2re7 s SER 23 Cb -0.05 -1.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.58 2re7 s SER 23 CO -0.17 0.37 -0.04 0.42 0.41 0.00 0.00 173.24 174.23 2re7 s THR 24 N -0.95 0.48 -0.09 1.44 -4.23 -0.26 -1.47 115.64 110.56 2re7 s THR 24 Ca 0.15 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2re7 s THR 24 Cb -0.11 -1.71 -0.03 0.00 1.34 0.00 0.00 72.50 71.99 2re7 s THR 24 CO 0.04 -0.83 -0.08 -0.94 -0.54 0.00 0.00 174.62 172.27 2re7 s SER 25 N -3.02 4.48 0.68 3.99 1.04 -1.26 -1.61 113.70 118.01 2re7 s SER 25 Ca 0.13 -0.11 0.03 0.00 0.48 0.00 0.00 55.95 56.48 2re7 s SER 25 Cb 0.06 -1.30 0.12 0.00 0.10 0.00 0.00 66.02 65.01 2re7 s SER 25 CO -0.05 0.30 0.93 0.54 0.98 0.00 0.00 173.24 175.94 2re7 s ASN 26 N -0.41 4.56 0.41 7.02 2.20 -0.24 -4.73 114.94 123.74 2re7 s ASN 26 Ca 0.06 -0.61 0.13 0.00 -0.94 0.00 0.00 52.86 51.50 2re7 s ASN 26 Cb -0.12 0.22 0.98 0.00 -2.00 0.00 0.00 41.25 40.33 2re7 s ASN 26 CO 0.02 -1.73 1.92 0.11 -2.94 0.00 0.00 177.10 174.48 2re7 h LYS 27 N -0.30 0.48 0.00 3.55 6.56 -1.94 0.53 116.57 125.46 2re7 h LYS 27 Ca -0.33 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.23 2re7 h LYS 27 Cb 1.27 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.82 2re7 h LYS 27 CO 0.39 0.32 0.00 1.17 -2.06 0.00 0.00 179.45 179.27 2re7 n LYS 28 N -4.49 0.74 -0.64 3.15 4.81 -1.26 -4.91 118.16 115.55 2re7 n LYS 28 Ca 0.14 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 2re7 n LYS 28 Cb 0.48 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.03 2re7 n LYS 28 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2re7 n GLY 29 N 0.82 0.79 3.82 3.14 0.00 0.19 -5.05 105.19 108.90 2re7 n GLY 29 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2re7 n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2re7 s ASP 30 N -2.80 6.79 -0.13 1.61 1.01 -1.26 -4.65 116.67 117.24 2re7 s ASP 30 Ca 0.00 1.67 -0.08 0.00 0.71 0.00 0.00 52.55 54.85 2re7 s ASP 30 Cb 0.00 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 2re7 s ASP 30 CO 0.00 -0.47 0.15 -0.63 0.21 0.00 0.00 175.17 174.44 2re7 s ILE 31 N -2.30 5.46 0.03 0.77 1.01 -1.26 -1.08 121.20 123.83 2re7 s ILE 31 Ca 0.61 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.50 2re7 s ILE 31 Cb -0.10 -3.44 -0.02 0.00 0.01 0.00 0.00 42.46 38.91 2re7 s ILE 31 CO 0.19 0.57 -0.01 -1.00 0.00 0.00 0.00 174.94 174.70 2re7 s HIS 32 N -0.70 0.32 0.14 3.97 3.76 -0.63 -4.98 115.29 117.16 2re7 s HIS 32 Ca 0.14 -0.66 0.05 0.00 -0.15 0.00 0.00 55.06 54.44 2re7 s HIS 32 Cb -0.12 -0.24 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 2re7 s HIS 32 CO 0.03 -0.27 -0.12 0.00 -0.85 0.00 0.00 174.74 173.54 2re7 s ALA 33 N -2.29 1.47 0.01 -1.40 0.00 -1.26 -1.10 121.76 117.18 2re7 s ALA 33 Ca -0.08 -1.40 -0.03 0.00 0.00 0.00 0.00 51.96 50.45 2re7 s ALA 33 Cb -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2re7 s ALA 33 CO -0.04 -0.01 0.04 -1.58 0.00 0.00 0.00 175.76 174.17 2re7 s TRP 34 N -2.80 0.14 0.76 0.00 0.51 -0.56 -4.94 118.94 112.05 2re7 s TRP 34 Ca 0.13 -0.30 -0.09 0.00 -2.12 0.00 0.00 56.10 53.72 2re7 s TRP 34 Cb -0.01 -0.11 0.08 0.00 -0.81 0.00 0.00 33.47 32.62 2re7 s TRP 34 CO 0.02 -0.20 1.10 -1.25 -0.51 0.00 0.00 176.95 176.11 2re7 s PRO 35 N -1.22 1.99 -0.07 4.98 0.04 -1.26 -1.29 135.00 138.18 2re7 s PRO 35 Ca -0.13 -0.14 0.04 0.00 0.04 0.00 0.00 61.00 60.81 2re7 s PRO 35 Cb -0.08 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.40 2re7 s PRO 35 CO 0.00 -1.47 -0.20 0.95 0.04 0.00 0.00 177.00 176.33 2re7 s THR 37 N -3.42 1.67 -0.08 1.26 -4.23 -1.26 -4.94 115.64 104.64 2re7 s THR 37 Ca 0.62 -0.83 -0.30 0.00 -1.18 0.00 0.00 61.69 60.00 2re7 s THR 37 Cb -0.10 -1.45 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 2re7 s THR 37 CO 0.47 0.47 1.07 -0.89 -0.54 0.00 0.00 174.62 175.20 2re7 s THR 38 N 0.19 4.60 0.03 3.99 2.01 -1.26 -4.68 115.64 120.52 2re7 s THR 38 Ca -0.10 1.89 -0.02 0.00 0.31 0.00 0.00 61.69 63.77 2re7 s THR 38 Cb -0.15 -4.21 -0.27 0.00 0.01 0.00 0.00 72.50 67.88 2re7 s THR 38 CO 0.05 0.02 0.94 0.28 -0.69 0.00 0.00 174.62 175.21 2re7 h SER 39 N 7.18 0.36 -4.26 3.53 0.02 -1.16 -3.48 113.55 115.75 2re7 h SER 39 Ca -0.33 -0.47 -0.05 0.00 -0.84 0.00 0.00 61.79 60.10 2re7 h SER 39 Cb 1.16 -0.12 -0.21 0.00 0.14 0.00 0.00 62.40 63.37 2re7 h SER 39 CO 0.85 1.38 0.10 -0.70 -1.14 0.00 0.00 176.83 177.33 2re7 s GLU 40 N -2.63 0.86 -0.20 3.45 2.12 -1.06 -4.95 118.70 116.28 2re7 s GLU 40 Ca -0.07 0.75 -0.03 0.00 0.36 0.00 0.00 54.97 55.98 2re7 s GLU 40 Cb 0.07 0.41 0.06 0.00 0.26 0.00 0.00 34.13 34.94 2re7 s GLU 40 CO 0.86 -0.15 0.04 0.54 -0.54 0.00 0.00 175.26 176.00 2re7 s VAL 41 N -0.06 0.51 -0.39 3.70 0.11 -1.26 -0.97 120.40 122.04 2re7 s VAL 41 Ca -0.03 -0.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.45 2re7 s VAL 41 Cb -0.04 -1.04 0.12 0.00 -1.53 0.00 0.00 36.38 33.89 2re7 s VAL 41 CO 0.03 -0.24 0.17 0.21 -3.33 0.00 0.00 175.10 171.94 2re7 s ASN 42 N 1.86 3.93 0.19 3.54 3.84 -0.44 -5.02 114.94 122.84 2re7 s ASN 42 Ca -0.00 -2.24 -0.08 0.00 0.21 0.00 0.00 52.86 50.74 2re7 s ASN 42 Cb -0.17 -1.06 0.10 0.00 -0.55 0.00 0.00 41.25 39.57 2re7 s ASN 42 CO -0.09 -0.33 1.64 -0.07 -2.79 0.00 0.00 177.10 175.46 2re7 h LEU 43 N 7.29 1.00 -0.78 3.21 3.38 -1.96 -0.76 115.31 126.69 2re7 h LEU 43 Ca -0.06 -0.30 0.10 0.00 0.09 0.00 0.00 57.88 57.71 2re7 h LEU 43 Cb 0.97 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 2re7 h LEU 43 CO 0.49 1.08 0.42 0.44 0.09 0.00 0.00 178.44 180.96 2re7 h ASP 44 N 0.92 0.57 0.20 -0.43 5.19 -1.95 -1.30 116.42 119.61 2re7 h ASP 44 Ca 0.15 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2re7 h ASP 44 Cb 0.60 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.07 2re7 h ASP 44 CO 0.04 0.32 -0.08 0.59 -3.12 0.00 0.00 179.24 176.99 2re7 n ASN 45 N -4.81 0.69 -3.08 6.45 4.13 -1.11 -4.97 115.26 112.56 2re7 n ASN 45 Ca 0.13 -0.90 -0.03 0.00 1.68 0.00 0.00 54.58 55.45 2re7 n ASN 45 Cb 0.29 -0.02 0.02 0.00 -1.54 0.00 0.00 39.78 38.52 2re7 n ASN 45 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2re7 n LYS 46 N -0.66 -1.52 -3.56 3.52 5.02 -0.34 -5.02 118.16 115.59 2re7 n LYS 46 Ca 0.17 1.34 -0.03 0.00 -2.02 0.00 0.00 58.31 57.77 2re7 n LYS 46 Cb 0.27 -5.73 -0.05 0.00 -0.02 0.00 0.00 35.03 29.50 2re7 n LYS 46 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2re7 s GLU 47 N -3.32 0.49 -0.10 1.97 2.02 -0.90 -4.48 118.70 114.39 2re7 s GLU 47 Ca 0.11 1.22 0.03 0.00 0.02 0.00 0.00 54.97 56.34 2re7 s GLU 47 Cb -0.01 0.60 0.01 0.00 0.10 0.00 0.00 34.13 34.83 2re7 s GLU 47 CO 0.74 -0.30 -0.18 0.42 0.02 0.00 0.00 175.26 175.96 2re7 s ILE 48 N 2.79 1.65 -0.06 -1.63 1.01 0.42 -1.33 121.20 124.05 2re7 s ILE 48 Ca 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 59.93 2re7 s ILE 48 Cb -0.13 -1.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 2re7 s ILE 48 CO -0.17 0.47 -0.15 0.26 0.00 0.00 0.00 174.94 175.35 2re7 s TRP 49 N 0.70 2.70 0.14 3.97 0.52 -0.14 0.10 118.94 126.92 2re7 s TRP 49 Ca -0.12 -0.25 0.07 0.00 0.02 0.00 0.00 56.10 55.81 2re7 s TRP 49 Cb -0.16 -1.66 -0.04 0.00 -1.15 0.00 0.00 33.47 30.47 2re7 s TRP 49 CO 0.03 0.11 -0.16 -0.06 0.02 0.00 0.00 176.95 176.89 2re7 s PHE 50 N -0.55 1.57 -0.36 -1.98 0.40 -0.17 -0.48 117.98 116.40 2re7 s PHE 50 Ca 0.08 -0.52 -0.10 0.00 -0.60 0.00 0.00 56.93 55.79 2re7 s PHE 50 Cb -0.11 -0.81 0.03 0.00 0.51 0.00 0.00 43.02 42.64 2re7 s PHE 50 CO 0.01 0.22 0.18 0.42 0.70 0.00 0.00 175.22 176.74 2re7 s ILE 51 N -2.06 4.35 0.34 0.64 1.01 -1.26 -0.95 121.20 123.27 2re7 s ILE 51 Ca 0.11 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.87 2re7 s ILE 51 Cb -0.05 -3.43 0.03 0.00 0.01 0.00 0.00 42.46 39.02 2re7 s ILE 51 CO 0.04 -0.21 0.29 0.61 0.00 0.00 0.00 174.94 175.67 2re7 n GLY 52 N 4.95 2.72 3.58 6.18 0.00 0.15 -4.95 105.19 117.82 2re7 n GLY 52 Ca -0.12 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.32 2re7 n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2re7 s ASP 53 N -3.00 4.77 0.39 1.61 2.15 -1.26 0.12 116.67 121.45 2re7 s ASP 53 Ca 0.22 -0.02 0.13 0.00 0.43 0.00 0.00 52.55 53.31 2re7 s ASP 53 Cb -0.02 -1.36 0.80 0.00 -0.30 0.00 0.00 42.92 42.04 2re7 s ASP 53 CO 0.14 0.32 1.88 0.11 -0.17 0.00 0.00 175.17 177.45 2re7 h LYS 54 N 5.55 0.03 0.00 4.34 1.57 -0.65 -2.54 116.57 124.88 2re7 h LYS 54 Ca -0.45 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2re7 h LYS 54 Cb 1.18 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2re7 h LYS 54 CO 0.55 0.33 0.00 0.25 -0.57 0.00 0.00 179.45 180.01 2re7 n THR 55 N -4.18 0.36 -2.16 -0.16 -2.24 -1.26 -4.65 114.28 99.99 2re7 n THR 55 Ca -0.02 0.09 -0.34 0.00 -2.27 0.00 0.00 64.05 61.51 2re7 n THR 55 Cb 0.35 -0.71 0.01 0.00 -2.10 0.00 0.00 70.33 67.88 2re7 n THR 55 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2re7 s SER 56 N -2.76 5.73 0.42 3.42 1.04 -0.96 -4.92 113.70 115.66 2re7 s SER 56 Ca 0.17 2.00 0.09 0.00 0.48 0.00 0.00 55.95 58.69 2re7 s SER 56 Cb 0.15 -2.56 0.89 0.00 0.10 0.00 0.00 66.02 64.60 2re7 s SER 56 CO 0.38 -1.21 2.03 0.44 0.98 0.00 0.00 173.24 175.86 2re7 h ASP 57 N 0.84 0.36 -0.25 7.02 3.32 -1.91 -1.82 116.42 123.99 2re7 h ASP 57 Ca -0.48 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.46 2re7 h ASP 57 Cb 1.24 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2re7 h ASP 57 CO 0.57 0.32 -0.15 1.62 -1.72 0.00 0.00 179.24 179.88 2re7 h VAL 58 N 0.41 1.31 -0.72 -1.35 3.04 -1.93 0.37 116.25 117.38 2re7 h VAL 58 Ca 0.11 -1.25 -0.02 0.00 -1.01 0.00 0.00 66.70 64.52 2re7 h VAL 58 Cb 0.05 1.59 -0.03 0.00 -2.01 0.00 0.00 31.29 30.89 2re7 h VAL 58 CO -0.01 0.39 0.36 0.58 -1.01 0.00 0.00 177.57 177.88 2re7 h VAL 59 N 0.25 1.23 -0.01 1.51 2.07 -1.76 -0.39 116.25 119.16 2re7 h VAL 59 Ca 0.05 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 66.98 2re7 h VAL 59 Cb 0.67 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 2re7 h VAL 59 CO 0.04 0.27 -0.24 0.50 0.02 0.00 0.00 177.57 178.15 2re7 h LYS 60 N 1.00 -0.36 -0.62 1.57 3.64 -1.06 -0.41 116.57 120.32 2re7 h LYS 60 Ca 0.25 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.65 2re7 h LYS 60 Cb 0.09 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2re7 h LYS 60 CO -0.03 -0.24 0.38 -0.44 -2.27 0.00 0.00 179.45 176.84 2re7 h ASP 61 N -0.38 0.74 -0.66 4.20 3.32 -0.72 -2.92 116.42 120.01 2re7 h ASP 61 Ca 0.06 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 2re7 h ASP 61 Cb 0.46 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 2re7 h ASP 61 CO -0.22 0.58 0.36 0.40 -1.72 0.00 0.00 179.24 178.63 2re7 h ILE 62 N 0.84 1.21 -0.78 0.35 2.04 -0.61 -0.41 117.51 120.15 2re7 h ILE 62 Ca 0.22 -0.54 0.18 0.00 1.00 0.00 0.00 64.86 65.72 2re7 h ILE 62 Cb -0.03 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.31 2re7 h ILE 62 CO -0.04 0.23 0.53 1.56 0.00 0.00 0.00 178.15 180.43 2re7 h GLN 63 N 0.94 0.28 0.00 2.37 4.20 -0.88 -2.76 115.11 119.27 2re7 h GLN 63 Ca 0.24 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.91 2re7 h GLN 63 Cb 0.05 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2re7 h GLN 63 CO -0.04 0.19 -1.94 -0.25 -0.67 0.00 0.00 178.83 176.12 2re7 n ASP 64 N -4.44 0.07 -3.33 1.46 8.00 -0.77 -4.89 116.55 112.65 2re7 n ASP 64 Ca 0.16 0.03 -0.09 0.00 0.71 0.00 0.00 54.79 55.59 2re7 n ASP 64 Cb 0.65 1.81 -0.07 0.00 -0.02 0.00 0.00 41.12 43.49 2re7 n ASP 64 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2re7 s ASP 65 N -4.65 0.37 0.00 -2.24 -1.08 -0.24 -5.02 116.67 103.81 2re7 s ASP 65 Ca -0.07 -0.12 0.31 0.00 -0.52 0.00 0.00 52.55 52.15 2re7 s ASP 65 Cb 0.13 1.09 1.78 0.00 -1.46 0.00 0.00 42.92 44.46 2re7 s ASP 65 CO 0.90 -0.33 2.15 0.00 0.52 0.00 0.00 175.17 178.40 2re7 n ALA 66 N 5.36 2.61 -2.64 3.66 0.00 -1.21 -4.01 120.51 124.28 2re7 n ALA 66 Ca -0.01 -0.18 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 2re7 n ALA 66 Cb 0.50 -1.50 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 2re7 n ALA 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2re7 s ARG 67 N -2.11 3.31 0.41 0.00 0.52 -1.26 -0.13 118.95 119.69 2re7 s ARG 67 Ca 0.43 -0.33 0.05 0.00 -0.52 0.00 0.00 55.73 55.35 2re7 s ARG 67 Cb 0.21 -4.03 -0.06 0.00 0.52 0.00 0.00 34.95 31.60 2re7 s ARG 67 CO 0.38 -1.32 0.03 0.96 0.02 0.00 0.00 175.30 175.37 2re7 s ILE 68 N 3.49 1.48 -0.01 1.52 -5.25 -0.41 -4.49 121.20 117.54 2re7 s ILE 68 Ca 0.27 -2.00 0.03 0.00 -0.99 0.00 0.00 60.65 57.96 2re7 s ILE 68 Cb -0.14 -2.70 -0.01 0.00 2.95 0.00 0.00 42.46 42.57 2re7 s ILE 68 CO 0.19 0.00 -0.09 -0.83 -1.79 0.00 0.00 174.94 172.42 2re7 s GLY 69 N -3.69 0.45 -0.01 6.27 0.00 -0.54 -2.20 107.32 107.60 2re7 s GLY 69 Ca 0.28 -0.39 0.07 0.00 0.00 0.00 0.00 44.72 44.68 2re7 s GLY 69 CO 0.14 -0.31 -0.22 1.08 0.00 0.00 0.00 173.10 173.78 2re7 s LEU 70 N -0.20 2.29 0.05 0.66 1.43 -0.27 -0.02 118.68 122.62 2re7 s LEU 70 Ca 0.03 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 2re7 s LEU 70 Cb -0.04 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.75 2re7 s LEU 70 CO -0.00 0.31 -0.10 0.42 0.23 0.00 0.00 176.35 177.21 2re7 s THR 71 N -0.69 0.71 -0.03 5.49 -4.23 -1.26 -0.41 115.64 115.21 2re7 s THR 71 Ca 0.11 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.56 2re7 s THR 71 Cb -0.10 -0.73 0.03 0.00 1.34 0.00 0.00 72.50 73.03 2re7 s THR 71 CO 0.00 -0.28 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.48 2re7 s TYR 72 N -1.22 0.40 -0.08 3.99 2.02 -0.70 -4.48 117.35 117.27 2re7 s TYR 72 Ca -0.06 -0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.62 2re7 s TYR 72 Cb -0.09 -0.45 0.01 0.00 -0.40 0.00 0.00 41.96 41.03 2re7 s TYR 72 CO 0.01 -0.14 -0.15 0.00 -1.57 0.00 0.00 175.55 173.70 2re7 s ALA 73 N 0.96 1.56 0.48 3.71 0.00 -1.26 -1.09 121.76 126.12 2re7 s ALA 73 Ca -0.10 -0.61 -0.19 0.00 0.00 0.00 0.00 51.96 51.05 2re7 s ALA 73 Cb -0.14 -0.69 -0.09 0.00 0.00 0.00 0.00 23.12 22.21 2re7 s ALA 73 CO -0.01 0.10 0.99 0.95 0.00 0.00 0.00 175.76 177.79 2re7 s THR 74 N 0.69 4.17 0.30 0.00 -4.23 -0.66 -4.87 115.64 111.05 2re7 s THR 74 Ca -0.13 1.26 0.34 0.00 -1.18 0.00 0.00 61.69 61.98 2re7 s THR 74 Cb -0.16 -3.55 0.37 0.00 1.34 0.00 0.00 72.50 70.50 2re7 s THR 74 CO 0.03 -0.38 2.08 0.06 -0.54 0.00 0.00 174.62 175.87 2re7 h GLN 75 N 1.47 0.00 0.00 3.99 3.07 -1.91 -0.20 115.11 121.53 2re7 h GLN 75 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.25 2re7 h GLN 75 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.76 2re7 h GLN 75 CO 0.60 0.04 0.00 -0.40 0.09 0.00 0.00 178.83 179.16 2re7 n ASP 76 N -3.22 0.00 -2.05 0.06 5.75 -1.26 -4.89 116.55 110.95 2re7 n ASP 76 Ca -0.01 -0.77 -0.16 0.00 -0.01 0.00 0.00 54.79 53.85 2re7 n ASP 76 Cb 0.25 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.31 2re7 n ASP 76 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2re7 n GLU 77 N -0.94 -1.74 -0.00 0.11 1.02 -0.09 -4.81 120.64 114.19 2re7 n GLU 77 Ca 0.15 0.84 0.05 0.00 -0.02 0.00 0.00 57.16 58.18 2re7 n GLU 77 Cb 0.07 -5.34 -0.07 0.00 -0.02 0.00 0.00 31.44 26.07 2re7 n GLU 77 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2re7 n LYS 78 N -2.57 1.05 -4.18 3.49 3.00 -1.26 -4.99 118.16 112.71 2re7 n LYS 78 Ca -0.18 -0.07 -0.19 0.00 -0.00 0.00 0.00 58.31 57.87 2re7 n LYS 78 Cb 0.60 -1.18 -0.16 0.00 0.00 0.00 0.00 35.03 34.29 2re7 n LYS 78 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 2re7 s ASN 79 N -2.90 0.84 0.01 3.14 0.01 -1.26 -2.57 114.94 112.22 2re7 s ASN 79 Ca -0.02 -0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.03 2re7 s ASN 79 Cb 0.07 -0.32 -0.01 0.00 0.41 0.00 0.00 41.25 41.40 2re7 s ASN 79 CO 0.42 -0.01 -0.06 -0.31 -1.51 0.00 0.00 177.10 175.63 2re7 s TYR 80 N 0.56 0.50 -0.02 2.20 1.51 -0.34 -1.65 117.35 120.11 2re7 s TYR 80 Ca -0.07 -0.19 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 2re7 s TYR 80 Cb -0.11 -0.32 0.01 0.00 -0.11 0.00 0.00 41.96 41.43 2re7 s TYR 80 CO 0.00 -0.03 -0.07 0.08 -1.11 0.00 0.00 175.55 174.43 2re7 s VAL 81 N -0.44 0.60 -0.11 0.71 1.01 -0.25 -0.82 120.40 121.10 2re7 s VAL 81 Ca -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.72 2re7 s VAL 81 Cb -0.04 -0.54 0.02 0.00 0.00 0.00 0.00 36.38 35.81 2re7 s VAL 81 CO -0.00 0.20 -0.13 -0.55 0.00 0.00 0.00 175.10 174.62 2re7 s SER 82 N 0.25 2.35 -0.08 3.32 0.15 0.13 -1.72 113.70 118.09 2re7 s SER 82 Ca -0.03 -0.40 0.03 0.00 0.70 0.00 0.00 55.95 56.25 2re7 s SER 82 Cb -0.08 -1.02 -0.01 0.00 -1.71 0.00 0.00 66.02 63.20 2re7 s SER 82 CO 0.00 -0.02 -0.19 -0.63 1.20 0.00 0.00 173.24 173.60 2re7 s ILE 83 N 1.19 2.61 -0.13 6.45 1.01 0.45 -0.35 121.20 132.44 2re7 s ILE 83 Ca -0.03 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 2re7 s ILE 83 Cb -0.14 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 2re7 s ILE 83 CO -0.04 0.56 -0.03 -0.55 0.00 0.00 0.00 174.94 174.88 2re7 s SER 84 N -0.07 4.91 0.22 3.58 0.15 -0.01 -1.12 113.70 121.37 2re7 s SER 84 Ca -0.04 -0.04 -0.21 0.00 0.70 0.00 0.00 55.95 56.36 2re7 s SER 84 Cb -0.14 -1.62 0.04 0.00 -1.71 0.00 0.00 66.02 62.59 2re7 s SER 84 CO 0.04 0.25 0.64 -0.83 1.20 0.00 0.00 173.24 174.55 2re7 s GLY 85 N -0.11 -0.27 -0.18 9.45 0.00 -0.93 -1.85 107.32 113.43 2re7 s GLY 85 Ca 0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 44.72 44.69 2re7 s GLY 85 CO 0.02 -0.03 -0.04 0.99 0.00 0.00 0.00 173.10 174.04 2re7 s ASP 86 N -2.85 4.58 -0.17 1.64 1.01 -0.48 -1.28 116.67 119.12 2re7 s ASP 86 Ca 0.07 -0.24 -0.13 0.00 0.71 0.00 0.00 52.55 52.96 2re7 s ASP 86 Cb -0.03 -1.76 -0.05 0.00 1.01 0.00 0.00 42.92 42.09 2re7 s ASP 86 CO -0.02 0.10 0.27 0.00 0.21 0.00 0.00 175.17 175.73 2re7 s ALA 87 N 0.80 3.60 0.21 5.23 0.00 0.81 -0.39 121.76 132.03 2re7 s ALA 87 Ca -0.01 -0.49 0.08 0.00 0.00 0.00 0.00 51.96 51.54 2re7 s ALA 87 Cb -0.15 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 2re7 s ALA 87 CO 0.02 0.10 -0.01 -1.21 0.00 0.00 0.00 175.76 174.65 2re7 s GLU 88 N 0.46 2.33 -0.63 0.00 2.02 0.25 -4.72 118.70 118.41 2re7 s GLU 88 Ca 0.15 -1.23 0.06 0.00 0.02 0.00 0.00 54.97 53.97 2re7 s GLU 88 Cb -0.13 -2.27 0.28 0.00 0.10 0.00 0.00 34.13 32.11 2re7 s GLU 88 CO 0.03 0.42 0.81 1.28 0.02 0.00 0.00 175.26 177.82 2re7 n LEU 89 N -0.38 4.00 -4.88 1.80 4.77 -1.26 -0.86 117.00 120.19 2re7 n LEU 89 Ca -0.09 -5.52 -0.30 0.00 -0.03 0.00 0.00 56.01 50.07 2re7 n LEU 89 Cb 0.56 -0.64 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2re7 n LEU 89 CO 0.39 2.14 0.68 -2.16 -1.33 0.00 0.00 177.39 177.11 2re7 s PRO 90 N -2.77 3.43 -0.27 3.23 0.04 -1.25 -4.96 135.00 132.45 2re7 s PRO 90 Ca 0.42 0.60 -0.08 0.00 0.04 0.00 0.00 61.00 61.98 2re7 s PRO 90 Cb 0.19 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 2re7 s PRO 90 CO -0.05 -0.61 0.10 0.99 0.04 0.00 0.00 177.00 177.47 2re7 s THR 91 N -3.15 4.39 -0.33 1.26 2.01 -1.26 -3.98 115.64 114.58 2re7 s THR 91 Ca 0.55 -0.29 0.03 0.00 0.31 0.00 0.00 61.69 62.29 2re7 s THR 91 Cb -0.11 -3.13 0.16 0.00 0.01 0.00 0.00 72.50 69.43 2re7 s THR 91 CO 0.52 0.23 0.44 -0.62 -0.69 0.00 0.00 174.62 174.50 2re7 s ASP 92 N 1.61 0.24 0.10 3.53 -1.08 -1.26 -5.02 116.67 114.79 2re7 s ASP 92 Ca 0.05 -0.77 -0.22 0.00 -0.52 0.00 0.00 52.55 51.09 2re7 s ASP 92 Cb -0.16 1.11 -0.13 0.00 -1.46 0.00 0.00 42.92 42.29 2re7 s ASP 92 CO 0.05 -0.30 1.74 0.11 0.52 0.00 0.00 175.17 177.29 2re7 h LYS 93 N 7.66 0.03 -0.60 4.34 6.56 -1.98 0.21 116.57 132.80 2re7 h LYS 93 Ca -0.02 -0.00 0.12 0.00 -1.06 0.00 0.00 60.65 59.69 2re7 h LYS 93 Cb 1.11 -0.01 -0.11 0.00 -0.57 0.00 0.00 32.23 32.66 2re7 h LYS 93 CO 0.22 0.02 -0.08 0.00 -2.06 0.00 0.00 179.45 177.55 2re7 h ALA 94 N 1.03 0.49 -0.24 3.86 0.00 -2.00 0.75 119.26 123.14 2re7 h ALA 94 Ca 0.02 0.21 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2re7 h ALA 94 Cb 0.01 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2re7 h ALA 94 CO -0.02 -0.42 -0.21 -0.22 0.00 0.00 0.00 179.25 178.38 2re7 h LYS 95 N 0.05 0.57 -0.82 0.00 1.63 -1.83 -2.85 116.57 113.32 2re7 h LYS 95 Ca 0.30 -0.29 0.08 0.00 -0.85 0.00 0.00 60.65 59.89 2re7 h LYS 95 Cb 0.47 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.04 2re7 h LYS 95 CO -0.57 0.88 0.49 1.25 -3.45 0.00 0.00 179.45 178.04 2re7 h LEU 96 N 0.28 0.73 -0.54 5.20 5.85 0.28 -1.01 115.31 126.10 2re7 h LEU 96 Ca 0.04 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.87 2re7 h LEU 96 Cb 0.76 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2re7 h LEU 96 CO 0.05 0.45 0.19 0.44 -0.34 0.00 0.00 178.44 179.24 2re7 h ASP 97 N 0.86 0.19 -0.65 1.25 3.32 -0.85 -2.05 116.42 118.50 2re7 h ASP 97 Ca 0.38 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 2re7 h ASP 97 Cb 0.26 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 2re7 h ASP 97 CO -0.21 0.13 0.37 -0.08 -1.72 0.00 0.00 179.24 177.73 2re7 h GLU 98 N 0.37 0.89 -0.00 3.56 4.81 -0.98 -2.96 114.58 120.28 2re7 h GLU 98 Ca 0.26 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2re7 h GLU 98 Cb 0.30 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2re7 h GLU 98 CO -0.27 0.66 -0.01 1.28 -0.73 0.00 0.00 179.01 179.94 2re7 n LEU 99 N -4.55 0.21 -4.79 1.64 4.77 -0.64 -4.93 117.00 108.70 2re7 n LEU 99 Ca 0.05 -0.02 -0.37 0.00 -0.03 0.00 0.00 56.01 55.64 2re7 n LEU 99 Cb 0.08 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 2re7 n LEU 99 CO 0.37 0.04 0.55 0.86 -1.33 0.00 0.00 177.39 177.87 2re7 s TRP 100 N -2.12 3.69 0.17 -1.77 -0.11 -0.81 -5.06 118.94 112.93 2re7 s TRP 100 Ca 0.43 1.61 0.01 0.00 1.22 0.00 0.00 56.10 59.37 2re7 s TRP 100 Cb 0.21 -2.79 -0.05 0.00 -1.50 0.00 0.00 33.47 29.35 2re7 s TRP 100 CO 0.39 0.28 0.01 -1.12 -4.62 0.00 0.00 176.95 171.89 2re7 s SER 101 N -1.60 1.04 0.21 5.86 0.01 -1.26 -5.04 113.70 112.93 2re7 s SER 101 Ca 0.46 -1.18 0.20 0.00 1.31 0.00 0.00 55.95 56.73 2re7 s SER 101 Cb -0.18 0.15 0.89 0.00 0.21 0.00 0.00 66.02 67.09 2re7 s SER 101 CO 0.23 -0.60 1.60 -2.65 0.41 0.00 0.00 173.24 172.22 2re7 n PRO 102 N -0.22 0.13 0.12 12.44 -0.02 -1.26 -3.10 135.00 143.09 2re7 n PRO 102 Ca -0.06 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 2re7 n PRO 102 Cb 0.63 -1.80 -0.08 0.00 -0.02 0.00 0.00 33.50 32.23 2re7 n PRO 102 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2re7 h VAL 103 N 0.00 0.87 -0.52 -1.45 2.07 -2.00 -3.12 116.25 112.09 2re7 h VAL 103 Ca 0.00 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2re7 h VAL 103 Cb 0.22 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2re7 h VAL 103 CO 0.00 0.11 0.15 1.88 0.02 0.00 0.00 177.57 179.73 2re7 h TYR 104 N -0.54 0.80 -0.52 1.57 0.05 -1.93 -1.75 116.97 114.64 2re7 h TYR 104 Ca -0.03 -0.06 0.05 0.00 0.05 0.00 0.00 58.73 58.74 2re7 h TYR 104 Cb 0.40 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 2re7 h TYR 104 CO 0.01 0.66 0.35 1.03 -1.05 0.00 0.00 178.16 179.15 2re7 h SER 105 N 0.76 0.45 0.00 3.88 0.87 -1.56 -3.01 113.55 114.95 2re7 h SER 105 Ca 0.17 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2re7 h SER 105 Cb 0.25 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2re7 h SER 105 CO -0.01 0.30 0.00 0.00 -0.53 0.00 0.00 176.83 176.60 2re7 n ALA 106 N -2.49 -0.30 -1.61 6.23 0.00 -0.67 -4.20 120.51 117.46 2re7 n ALA 106 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 2re7 n ALA 106 Cb 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.61 2re7 n ALA 106 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2re7 n PHE 107 N -1.49 1.95 -3.15 0.00 3.72 -1.11 -4.47 117.46 112.90 2re7 n PHE 107 Ca 0.00 -2.45 0.04 0.00 -0.05 0.00 0.00 57.45 55.00 2re7 n PHE 107 Cb 0.00 -1.78 -0.00 0.00 -0.94 0.00 0.00 39.48 36.76 2re7 n PHE 107 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2re7 s PHE 108 N -0.51 -1.56 0.35 1.38 0.08 -1.21 -4.98 117.98 111.54 2re7 s PHE 108 Ca 0.60 0.90 0.16 0.00 0.12 0.00 0.00 56.93 58.71 2re7 s PHE 108 Cb 0.26 0.27 1.11 0.00 -0.57 0.00 0.00 43.02 44.08 2re7 s PHE 108 CO -0.11 -0.91 1.67 0.00 -0.10 0.00 0.00 175.22 175.77 2re7 h ALA 109 N 7.82 2.03 -0.36 5.36 0.00 -1.87 -0.72 119.26 131.52 2re7 h ALA 109 Ca -0.03 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2re7 h ALA 109 Cb 1.19 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 2re7 h ALA 109 CO 0.09 -0.62 0.02 0.09 0.00 0.00 0.00 179.25 178.84 2re7 n ASN 110 N -4.99 3.98 0.00 0.00 3.02 -1.26 -5.07 115.26 110.94 2re7 n ASN 110 Ca 0.32 -3.14 0.00 0.00 -0.03 0.00 0.00 54.58 51.73 2re7 n ASN 110 Cb 1.00 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 39.58 2re7 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2re7 n GLY 111 N -0.46 2.50 0.32 7.41 0.00 -0.28 -2.80 105.19 111.87 2re7 n GLY 111 Ca 0.26 -0.44 0.21 0.00 0.00 0.00 0.00 46.02 46.05 2re7 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2re7 h LYS 112 N 0.00 0.00 -0.21 1.61 1.57 -1.94 -1.64 116.57 115.96 2re7 h LYS 112 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2re7 h LYS 112 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2re7 h LYS 112 CO 0.00 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.27 2re7 n GLU 113 N -3.06 1.90 -2.00 3.15 4.71 -1.12 -4.96 120.64 119.26 2re7 n GLU 113 Ca -0.02 -1.35 -0.42 0.00 -0.01 0.00 0.00 57.16 55.36 2re7 n GLU 113 Cb 0.14 -1.42 -0.03 0.00 -1.01 0.00 0.00 31.44 29.12 2re7 n GLU 113 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2re7 s ASP 114 N -1.56 6.66 0.62 1.62 -1.08 -0.62 -4.87 116.67 117.44 2re7 s ASP 114 Ca 0.33 2.49 0.36 0.00 -0.52 0.00 0.00 52.55 55.21 2re7 s ASP 114 Cb 0.18 -2.58 2.04 0.00 -1.46 0.00 0.00 42.92 41.10 2re7 s ASP 114 CO 0.27 -0.80 2.29 0.00 0.52 0.00 0.00 175.17 177.45 2re7 h ALA 115 N 7.23 1.29 0.00 3.66 0.00 -1.93 -2.25 119.26 127.26 2re7 h ALA 115 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2re7 h ALA 115 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2re7 h ALA 115 CO 0.91 0.01 -0.11 0.09 0.00 0.00 0.00 179.25 180.15 2re7 n ASN 116 N -3.52 0.26 -4.75 0.00 3.02 -1.26 -4.83 115.26 104.19 2re7 n ASN 116 Ca -0.03 0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 54.49 2re7 n ASN 116 Cb 0.09 -0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 38.84 2re7 n ASN 116 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2re7 s ILE 117 N -3.03 2.60 -0.14 2.41 1.01 -0.85 0.04 121.20 123.24 2re7 s ILE 117 Ca 0.13 0.51 -0.04 0.00 0.00 0.00 0.00 60.65 61.24 2re7 s ILE 117 Cb 0.17 -3.32 0.05 0.00 0.01 0.00 0.00 42.46 39.37 2re7 s ILE 117 CO 0.58 0.08 0.09 -1.58 0.00 0.00 0.00 174.94 174.11 2re7 s GLN 118 N -0.40 0.03 0.31 2.79 2.00 0.12 -4.60 119.66 119.91 2re7 s GLN 118 Ca 0.60 0.07 -0.29 0.00 -2.00 0.00 0.00 55.36 53.74 2re7 s GLN 118 Cb -0.42 -1.43 -0.10 0.00 0.80 0.00 0.00 33.01 31.86 2re7 s GLN 118 CO 0.44 -0.58 1.20 -0.51 -0.50 0.00 0.00 175.29 175.34 2re7 s LEU 119 N 2.16 4.48 -0.18 3.68 1.43 -1.26 0.34 118.68 129.33 2re7 s LEU 119 Ca 0.03 2.47 0.01 0.00 -1.03 0.00 0.00 54.13 55.61 2re7 s LEU 119 Cb -0.15 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.43 2re7 s LEU 119 CO -0.08 -0.35 -0.20 -0.63 0.23 0.00 0.00 176.35 175.32 2re7 s ILE 120 N -1.17 2.09 -0.29 -0.59 1.01 -0.12 -3.78 121.20 118.35 2re7 s ILE 120 Ca 0.47 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 60.10 2re7 s ILE 120 Cb -0.36 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2re7 s ILE 120 CO 0.47 0.54 0.12 -0.75 0.00 0.00 0.00 174.94 175.31 2re7 s LYS 121 N 1.27 3.43 -0.22 2.79 2.20 -0.04 -1.00 119.74 128.18 2re7 s LYS 121 Ca 0.05 -0.65 -0.14 0.00 -0.36 0.00 0.00 55.97 54.87 2re7 s LYS 121 Cb -0.13 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 2re7 s LYS 121 CO -0.12 -0.34 0.32 0.08 -0.36 0.00 0.00 175.35 174.92 2re7 s VAL 122 N 1.61 5.25 -0.56 4.02 1.01 0.28 0.85 120.40 132.85 2re7 s VAL 122 Ca 0.05 0.52 -0.13 0.00 0.00 0.00 0.00 61.98 62.43 2re7 s VAL 122 Cb -0.16 -3.65 0.14 0.00 0.00 0.00 0.00 36.38 32.71 2re7 s VAL 122 CO 0.05 0.28 0.48 -0.69 0.00 0.00 0.00 175.10 175.22 2re7 s VAL 123 N 1.26 4.85 0.49 2.92 1.01 0.48 -0.44 120.40 130.97 2re7 s VAL 123 Ca 0.15 -1.81 -0.23 0.00 0.00 0.00 0.00 61.98 60.08 2re7 s VAL 123 Cb -0.14 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 32.05 2re7 s VAL 123 CO 0.07 -0.86 1.31 -2.16 0.00 0.00 0.00 175.10 173.46 2re7 s PRO 124 N 1.22 3.50 0.00 2.72 0.04 -1.26 -1.38 135.00 139.84 2re7 s PRO 124 Ca 0.07 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.25 2re7 s PRO 124 Cb -0.25 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 31.85 2re7 s PRO 124 CO -0.00 -0.87 0.00 -2.39 0.04 0.00 0.00 177.00 173.78 2re7 n HIS 125 N -0.58 0.00 -3.80 0.56 1.44 -0.77 -4.92 115.22 107.15 2re7 n HIS 125 Ca 0.08 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.66 2re7 n HIS 125 Cb 0.45 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.46 2re7 n HIS 125 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2re7 s GLY 126 N -1.45 -0.11 -0.06 -1.39 0.00 -0.97 -4.21 107.32 99.13 2re7 s GLY 126 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.07 2re7 s GLY 126 CO 0.00 0.21 -0.04 0.14 0.00 0.00 0.00 173.10 173.41 2re7 s VAL 127 N -0.75 0.56 0.11 1.40 1.01 -1.26 -0.83 120.40 120.63 2re7 s VAL 127 Ca -0.08 -0.08 0.09 0.00 0.00 0.00 0.00 61.98 61.90 2re7 s VAL 127 Cb -0.05 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2re7 s VAL 127 CO 0.02 0.25 -0.19 -1.61 0.00 0.00 0.00 175.10 173.57 2re7 s GLU 128 N 1.26 1.77 0.10 2.72 0.41 0.53 -4.79 118.70 120.70 2re7 s GLU 128 Ca -0.06 -1.18 -0.11 0.00 -0.41 0.00 0.00 54.97 53.21 2re7 s GLU 128 Cb -0.14 -2.10 0.01 0.00 -1.78 0.00 0.00 34.13 30.13 2re7 s GLU 128 CO -0.02 0.48 0.27 0.00 -0.49 0.00 0.00 175.26 175.50 2re7 s TRP 130 N -3.81 1.00 0.22 0.00 0.51 0.00 -4.99 118.94 111.86 2re7 s TRP 130 Ca 0.04 -1.38 0.07 0.00 -2.12 0.00 0.00 56.10 52.70 2re7 s TRP 130 Cb 0.04 -1.28 -0.04 0.00 -0.81 0.00 0.00 33.47 31.38 2re7 s TRP 130 CO -0.11 -0.85 0.14 -0.51 -0.51 0.00 0.00 176.95 175.11 2re7 s LEU 131 N 1.70 3.70 0.02 2.99 1.43 -1.26 -1.20 118.68 126.05 2re7 s LEU 131 Ca 0.11 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 52.98 2re7 s LEU 131 Cb -0.18 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 2re7 s LEU 131 CO -0.26 0.01 -0.13 -0.44 0.23 0.00 0.00 176.35 175.76 2re7 s SER 132 N -3.52 1.52 0.00 2.29 0.01 -1.06 -4.96 113.70 107.98 2re7 s SER 132 Ca 0.32 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.23 2re7 s SER 132 Cb -0.08 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2re7 s SER 132 CO 0.23 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.57