#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a9v n GLN 2 N 0.00 -0.93 -4.12 -1.46 1.13 -1.26 -4.84 117.38 105.90 1a9v n GLN 2 Ca 0.00 -0.26 -0.13 0.00 -1.94 0.00 0.00 57.00 54.67 1a9v n GLN 2 Cb 0.00 -1.44 -0.07 0.00 0.11 0.00 0.00 30.24 28.85 1a9v n GLN 2 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1a9v s VAL 3 N -2.15 0.00 0.23 5.09 -7.23 -1.24 -3.89 120.40 111.20 1a9v s VAL 3 Ca 0.48 -1.71 -0.29 0.00 -1.81 0.00 0.00 61.98 58.65 1a9v s VAL 3 Cb -0.04 -2.47 -0.09 0.00 0.56 0.00 0.00 36.38 34.34 1a9v s VAL 3 CO 0.67 0.00 0.91 -0.62 -0.31 0.00 0.00 175.10 175.75 1a9v s ASP 4 N -3.18 7.60 0.21 4.85 -1.08 -1.16 -4.70 116.67 119.21 1a9v s ASP 4 Ca 0.32 1.89 -0.18 0.00 -0.52 0.00 0.00 52.55 54.06 1a9v s ASP 4 Cb 0.02 -2.59 0.07 0.00 -1.46 0.00 0.00 42.92 38.96 1a9v s ASP 4 CO 0.16 0.17 0.89 0.55 0.52 0.00 0.00 175.17 177.45 1a9v n VAL 5 N 1.50 0.00 -3.70 1.11 3.14 -1.26 -4.70 118.33 114.42 1a9v n VAL 5 Ca -0.03 -0.61 -0.14 0.00 -2.96 0.00 0.00 64.34 60.61 1a9v n VAL 5 Cb 0.47 0.75 -0.09 0.00 -1.06 0.00 0.00 33.84 33.92 1a9v n VAL 5 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1a9v s LYS 6 N -2.05 0.62 0.43 1.45 1.02 -0.65 -4.99 119.74 115.56 1a9v s LYS 6 Ca 0.19 0.57 -0.21 0.00 0.02 0.00 0.00 55.97 56.54 1a9v s LYS 6 Cb -0.03 0.30 -0.10 0.00 -0.52 0.00 0.00 37.83 37.47 1a9v s LYS 6 CO 0.06 -0.10 0.97 0.34 -0.92 0.00 0.00 175.35 175.70 1a9v s ASP 7 N 0.01 6.87 -0.01 2.83 2.15 -1.26 -0.52 116.67 126.74 1a9v s ASP 7 Ca -0.02 1.75 0.01 0.00 0.43 0.00 0.00 52.55 54.72 1a9v s ASP 7 Cb -0.03 -2.55 0.02 0.00 -0.30 0.00 0.00 42.92 40.06 1a9v s ASP 7 CO 0.02 -0.41 0.76 0.00 -0.17 0.00 0.00 175.17 175.37 1a9v n ALA 9 N -0.12 1.60 -2.83 0.00 0.00 -1.26 -4.96 120.51 112.94 1a9v n ALA 9 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 1a9v n ALA 9 Cb 0.56 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.06 1a9v n ALA 9 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1a9v n ASN 10 N -0.60 -1.98 -2.24 0.00 5.15 -1.26 -4.95 115.26 109.38 1a9v n ASN 10 Ca 0.00 -3.39 -0.08 0.00 -0.60 0.00 0.00 54.58 50.51 1a9v n ASN 10 Cb 0.00 1.38 -0.01 0.00 -0.53 0.00 0.00 39.78 40.62 1a9v n ASN 10 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1a9v n HIS 11 N 0.94 -1.10 -0.33 1.20 8.25 -1.26 -4.67 115.22 118.24 1a9v n HIS 11 Ca 0.11 0.13 -0.00 0.00 -0.26 0.00 0.00 57.72 57.69 1a9v n HIS 11 Cb 0.65 -0.79 0.24 0.00 1.12 0.00 0.00 29.99 31.22 1a9v n HIS 11 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1a9v n GLU 12 N -1.91 3.23 -1.49 -0.41 0.00 -1.26 -4.91 120.64 113.89 1a9v n GLU 12 Ca 0.02 -2.11 0.00 0.00 0.00 0.00 0.00 57.16 55.07 1a9v n GLU 12 Cb 0.31 -1.97 0.00 0.00 0.00 0.00 0.00 31.44 29.78 1a9v n GLU 12 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1a9v n ILE 13 N 0.18 0.00 0.00 6.31 5.41 -1.26 -3.99 119.36 126.01 1a9v n ILE 13 Ca 0.24 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.99 1a9v n ILE 13 Cb 0.99 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.76 1a9v n ILE 13 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1a9v n LYS 14 N -0.13 0.00 -3.77 0.38 2.85 -0.88 -4.80 118.16 111.82 1a9v n LYS 14 Ca 0.00 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.13 1a9v n LYS 14 Cb 0.00 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.26 1a9v n LYS 14 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1a9v s LYS 15 N -1.55 0.25 -0.28 -1.58 2.20 -0.94 -4.98 119.74 112.87 1a9v s LYS 15 Ca 0.00 0.41 -0.01 0.00 -0.36 0.00 0.00 55.97 56.00 1a9v s LYS 15 Cb 0.00 0.04 0.09 0.00 -1.51 0.00 0.00 37.83 36.44 1a9v s LYS 15 CO 0.00 -0.08 0.08 0.14 -0.36 0.00 0.00 175.35 175.12 1a9v s VAL 16 N 0.57 0.78 -0.19 4.02 -7.23 -1.26 -0.78 120.40 116.31 1a9v s VAL 16 Ca -0.04 -1.16 -0.17 0.00 -1.81 0.00 0.00 61.98 58.81 1a9v s VAL 16 Cb -0.05 -1.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 1a9v s VAL 16 CO -0.03 -0.54 0.42 -0.76 -0.31 0.00 0.00 175.10 173.88 1a9v s LEU 17 N 1.69 4.18 -0.01 1.32 1.43 0.73 -4.37 118.68 123.64 1a9v s LEU 17 Ca 0.06 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 53.71 1a9v s LEU 17 Cb -0.17 -2.57 -0.00 0.00 0.03 0.00 0.00 46.19 43.48 1a9v s LEU 17 CO -0.21 -0.07 0.07 -0.69 0.23 0.00 0.00 176.35 175.68 1a9v s VAL 18 N 1.22 0.05 0.23 -1.59 1.01 -1.26 -1.23 120.40 118.83 1a9v s VAL 18 Ca 0.21 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 1a9v s VAL 18 Cb -0.15 -0.25 -0.09 0.00 0.00 0.00 0.00 36.38 35.90 1a9v s VAL 18 CO 0.08 -0.22 1.20 -2.16 0.00 0.00 0.00 175.10 174.00 1a9v s PRO 19 N -0.70 4.50 0.00 2.72 0.04 -1.26 -4.16 135.00 136.15 1a9v s PRO 19 Ca -0.08 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1a9v s PRO 19 Cb -0.05 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1a9v s PRO 19 CO 0.00 -0.04 0.00 0.41 0.04 0.00 0.00 177.00 177.42 1a9v n GLY 20 N 1.73 2.33 3.73 0.56 0.00 -1.26 -4.92 105.19 107.36 1a9v n GLY 20 Ca 0.02 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.97 1a9v n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a9v n HIS 22 N 3.48 0.00 -1.42 0.00 1.44 -1.26 -4.59 115.22 112.86 1a9v n HIS 22 Ca -0.03 -0.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.58 1a9v n HIS 22 Cb 0.51 -0.03 0.00 0.00 0.12 0.00 0.00 29.99 30.59 1a9v n HIS 22 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1a9v n GLY 23 N -0.12 -0.68 0.03 -1.39 0.00 -1.25 -3.73 105.19 98.05 1a9v n GLY 23 Ca 0.01 -0.46 0.05 0.00 0.00 0.00 0.00 46.02 45.62 1a9v n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1a9v n SER 24 N 0.00 0.11 -3.72 1.61 7.64 -1.26 -3.00 113.62 115.00 1a9v n SER 24 Ca 0.00 0.54 -0.30 0.00 1.01 0.00 0.00 58.87 60.12 1a9v n SER 24 Cb 0.00 -0.56 0.27 0.00 -1.01 0.00 0.00 64.21 62.91 1a9v n SER 24 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1a9v s GLU 25 N -3.08 -2.11 -0.30 1.43 2.02 -1.26 -5.01 118.70 110.39 1a9v s GLU 25 Ca 0.03 0.17 -0.09 0.00 0.02 0.00 0.00 54.97 55.11 1a9v s GLU 25 Cb 0.05 -1.47 -0.00 0.00 0.10 0.00 0.00 34.13 32.81 1a9v s GLU 25 CO 0.17 -4.35 0.12 -1.25 0.02 0.00 0.00 175.26 169.97 1a9v s PRO 26 N -5.09 3.27 -0.54 0.39 0.05 -1.26 -4.82 135.00 127.01 1a9v s PRO 26 Ca 0.69 -0.75 -0.19 0.00 0.05 0.00 0.00 61.00 60.80 1a9v s PRO 26 Cb -0.14 -3.49 0.08 0.00 0.05 0.00 0.00 34.50 31.00 1a9v s PRO 26 CO 0.58 -0.41 0.63 0.00 0.05 0.00 0.00 177.00 177.85 1a9v n ILE 28 N 5.55 3.81 -1.54 0.00 2.08 -1.26 -0.70 119.36 127.30 1a9v n ILE 28 Ca -0.08 -3.26 -0.61 0.00 0.56 0.00 0.00 62.75 59.36 1a9v n ILE 28 Cb 0.44 -2.54 -0.10 0.00 -0.75 0.00 0.00 39.64 36.69 1a9v n ILE 28 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a9v n ILE 29 N 4.43 0.10 0.00 1.39 3.06 -1.26 -4.87 119.36 122.21 1a9v n ILE 29 Ca 0.54 -0.05 0.00 0.00 -2.50 0.00 0.00 62.75 60.74 1a9v n ILE 29 Cb 0.36 -0.84 0.00 0.00 0.54 0.00 0.00 39.64 39.70 1a9v n ILE 29 CO 0.00 0.00 0.00 1.41 -2.50 0.00 0.00 176.55 175.46 1a9v n HIS 30 N 6.26 0.00 -3.91 9.51 8.25 -1.26 -5.00 115.22 129.06 1a9v n HIS 30 Ca 0.39 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.75 1a9v n HIS 30 Cb 0.03 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.08 1a9v n HIS 30 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1a9v s ARG 31 N -0.00 1.25 0.00 -0.41 0.52 -1.26 -5.07 118.95 113.98 1a9v s ARG 31 Ca 0.00 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 54.10 1a9v s ARG 31 Cb 0.00 0.42 0.00 0.00 0.52 0.00 0.00 34.95 35.89 1a9v s ARG 31 CO 0.00 -0.49 0.00 0.41 0.02 0.00 0.00 175.30 175.24 1a9v n GLY 32 N -0.26 -2.25 3.05 -3.53 0.00 0.68 -4.96 105.19 97.92 1a9v n GLY 32 Ca -0.07 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.69 1a9v n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a9v s LYS 33 N -3.20 1.90 0.00 1.61 -0.14 0.05 -4.88 119.74 115.08 1a9v s LYS 33 Ca 0.00 -2.11 0.01 0.00 -1.36 0.00 0.00 55.97 52.52 1a9v s LYS 33 Cb 0.00 -3.43 -0.04 0.00 -1.68 0.00 0.00 37.83 32.69 1a9v s LYS 33 CO 0.00 -1.05 0.01 -1.25 -0.76 0.00 0.00 175.35 172.30 1a9v s PRO 34 N 0.59 2.80 -0.39 -1.68 0.04 -1.26 0.61 135.00 135.71 1a9v s PRO 34 Ca 0.12 -0.61 0.02 0.00 0.04 0.00 0.00 61.00 60.57 1a9v s PRO 34 Cb -0.22 -2.68 0.11 0.00 0.04 0.00 0.00 34.50 31.75 1a9v s PRO 34 CO -0.05 0.62 0.14 -0.06 0.04 0.00 0.00 177.00 177.70 1a9v s PHE 35 N -1.10 3.63 -0.54 0.56 0.08 -0.35 -4.93 117.98 115.34 1a9v s PHE 35 Ca 0.20 -2.85 0.02 0.00 0.12 0.00 0.00 56.93 54.42 1a9v s PHE 35 Cb -0.12 -3.01 0.14 0.00 -0.57 0.00 0.00 43.02 39.46 1a9v s PHE 35 CO 0.11 -0.93 0.30 -0.65 -0.10 0.00 0.00 175.22 173.95 1a9v s GLN 36 N 0.78 2.13 -0.11 0.44 1.11 -1.21 -1.40 119.66 121.39 1a9v s GLN 36 Ca 0.11 -2.52 -0.02 0.00 0.01 0.00 0.00 55.36 52.95 1a9v s GLN 36 Cb -0.21 -3.45 -0.03 0.00 -1.01 0.00 0.00 33.01 28.31 1a9v s GLN 36 CO -0.06 -1.12 -0.03 -0.51 0.01 0.00 0.00 175.29 173.59 1a9v s LEU 37 N -0.09 3.38 -0.03 2.90 1.43 0.26 -4.00 118.68 122.54 1a9v s LEU 37 Ca 0.16 0.00 -0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1a9v s LEU 37 Cb -0.23 -1.78 0.03 0.00 0.03 0.00 0.00 46.19 44.23 1a9v s LEU 37 CO -0.02 0.29 0.03 -1.83 0.23 0.00 0.00 176.35 175.04 1a9v s GLU 38 N -0.34 0.06 0.02 1.70 4.04 -0.37 -0.75 118.70 123.06 1a9v s GLU 38 Ca 0.06 0.19 -0.04 0.00 0.04 0.00 0.00 54.97 55.22 1a9v s GLU 38 Cb -0.12 -0.37 -0.01 0.00 0.02 0.00 0.00 34.13 33.64 1a9v s GLU 38 CO 0.02 -0.19 0.06 0.00 -1.84 0.00 0.00 175.26 173.31 1a9v s ALA 39 N 1.26 -0.04 -0.05 -0.84 0.00 -0.48 -0.19 121.76 121.41 1a9v s ALA 39 Ca -0.07 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.42 1a9v s ALA 39 Cb -0.13 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1a9v s ALA 39 CO -0.03 -0.23 -0.07 0.14 0.00 0.00 0.00 175.76 175.57 1a9v s VAL 40 N -1.93 3.66 -0.26 0.00 -7.23 0.04 -0.44 120.40 114.23 1a9v s VAL 40 Ca -0.11 -0.55 -0.10 0.00 -1.81 0.00 0.00 61.98 59.42 1a9v s VAL 40 Cb -0.06 -2.51 0.11 0.00 0.56 0.00 0.00 36.38 34.49 1a9v s VAL 40 CO -0.02 0.56 0.57 0.72 -0.31 0.00 0.00 175.10 176.62 1a9v s PHE 41 N -0.84 -1.12 0.67 2.82 -0.12 -0.06 -2.07 117.98 117.27 1a9v s PHE 41 Ca 0.13 2.02 -0.15 0.00 -0.05 0.00 0.00 56.93 58.89 1a9v s PHE 41 Cb -0.11 0.61 0.01 0.00 -0.63 0.00 0.00 43.02 42.90 1a9v s PHE 41 CO 0.02 -0.58 1.12 -2.00 -0.05 0.00 0.00 175.22 173.73 1a9v s GLU 42 N 2.62 2.68 0.04 1.99 2.12 -1.26 -1.42 118.70 125.46 1a9v s GLU 42 Ca -0.05 1.43 -0.21 0.00 0.36 0.00 0.00 54.97 56.50 1a9v s GLU 42 Cb -0.11 -1.93 -0.06 0.00 0.26 0.00 0.00 34.13 32.29 1a9v s GLU 42 CO -0.17 -1.35 0.62 0.00 -0.54 0.00 0.00 175.26 173.82 1a9v s ALA 43 N -2.32 3.50 -0.48 6.30 0.00 -0.31 -4.83 121.76 123.62 1a9v s ALA 43 Ca 0.68 0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.77 1a9v s ALA 43 Cb -0.21 -2.76 0.41 0.00 0.00 0.00 0.00 23.12 20.56 1a9v s ALA 43 CO 0.43 0.24 1.21 0.27 0.00 0.00 0.00 175.76 177.90 1a9v n ASN 44 N 2.34 5.02 0.00 0.00 2.04 -1.26 -0.14 115.26 123.25 1a9v n ASN 44 Ca -0.07 -3.73 0.00 0.00 -0.44 0.00 0.00 54.58 50.33 1a9v n ASN 44 Cb 0.51 -0.53 0.00 0.00 -2.53 0.00 0.00 39.78 37.23 1a9v n ASN 44 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1a9v n GLN 45 N -0.49 -0.09 -4.16 -3.83 10.64 -1.26 -4.98 117.38 113.22 1a9v n GLN 45 Ca 0.41 0.00 -0.27 0.00 -1.83 0.00 0.00 57.00 55.30 1a9v n GLN 45 Cb 0.61 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.92 1a9v n GLN 45 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 1a9v s ASN 46 N -4.00 5.00 -0.17 2.61 3.84 -1.26 0.16 114.94 121.12 1a9v s ASN 46 Ca 0.00 -0.29 -0.32 0.00 0.21 0.00 0.00 52.86 52.46 1a9v s ASN 46 Cb 0.00 -1.15 0.14 0.00 -0.55 0.00 0.00 41.25 39.69 1a9v s ASN 46 CO 0.00 0.10 1.14 0.28 -2.79 0.00 0.00 177.10 175.83 1a9v s THR 47 N -1.64 0.00 -0.92 -5.21 -1.32 0.26 -4.77 115.64 102.04 1a9v s THR 47 Ca 0.28 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.85 1a9v s THR 47 Cb -0.10 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.07 1a9v s THR 47 CO 0.20 0.00 1.03 0.29 -2.21 0.00 0.00 174.62 173.93 1a9v n LYS 48 N 0.16 1.79 -3.58 7.08 5.02 -1.26 0.72 118.16 128.10 1a9v n LYS 48 Ca -0.03 -1.57 -0.11 0.00 -2.02 0.00 0.00 58.31 54.58 1a9v n LYS 48 Cb 0.59 -1.20 -0.05 0.00 -0.02 0.00 0.00 35.03 34.34 1a9v n LYS 48 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1a9v s THR 49 N -0.90 0.00 -0.29 -0.18 -4.23 -1.26 -4.74 115.64 104.03 1a9v s THR 49 Ca 0.15 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.64 1a9v s THR 49 Cb 0.09 -1.00 0.11 0.00 1.34 0.00 0.00 72.50 73.04 1a9v s THR 49 CO 0.12 0.00 0.20 0.00 -0.54 0.00 0.00 174.62 174.40 1a9v s ALA 50 N -0.99 0.20 1.21 3.99 0.00 -1.26 -1.48 121.76 123.43 1a9v s ALA 50 Ca -0.02 -0.80 -0.17 0.00 0.00 0.00 0.00 51.96 50.97 1a9v s ALA 50 Cb -0.01 -1.56 0.25 0.00 0.00 0.00 0.00 23.12 21.81 1a9v s ALA 50 CO 0.01 -1.69 0.88 1.63 0.00 0.00 0.00 175.76 176.60 1a9v n LYS 51 N 5.25 -2.84 -3.84 0.00 5.02 0.12 -3.48 118.16 118.39 1a9v n LYS 51 Ca -0.04 -1.42 -0.13 0.00 -2.02 0.00 0.00 58.31 54.71 1a9v n LYS 51 Cb 0.44 -1.35 -0.14 0.00 -0.02 0.00 0.00 35.03 33.96 1a9v n LYS 51 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1a9v s ILE 52 N -2.58 -0.01 -0.15 -0.18 1.01 -0.97 -1.85 121.20 116.46 1a9v s ILE 52 Ca 0.58 0.05 -0.04 0.00 0.00 0.00 0.00 60.65 61.23 1a9v s ILE 52 Cb -0.06 -0.07 0.06 0.00 0.01 0.00 0.00 42.46 42.40 1a9v s ILE 52 CO 0.45 0.02 0.12 -0.70 0.00 0.00 0.00 174.94 174.83 1a9v s GLU 53 N 0.26 0.07 -0.15 2.79 2.12 0.08 -4.78 118.70 119.09 1a9v s GLU 53 Ca -0.02 0.10 -0.18 0.00 0.36 0.00 0.00 54.97 55.23 1a9v s GLU 53 Cb -0.03 -1.38 -0.04 0.00 0.26 0.00 0.00 34.13 32.95 1a9v s GLU 53 CO -0.01 -0.59 0.49 -1.50 -0.54 0.00 0.00 175.26 173.11 1a9v s ILE 54 N 2.20 5.16 -0.32 -3.70 1.10 -1.26 -1.41 121.20 122.97 1a9v s ILE 54 Ca 0.04 0.94 0.03 0.00 -0.51 0.00 0.00 60.65 61.15 1a9v s ILE 54 Cb -0.15 -3.82 0.09 0.00 0.15 0.00 0.00 42.46 38.73 1a9v s ILE 54 CO -0.09 0.26 0.04 -0.54 -2.11 0.00 0.00 174.94 172.51 1a9v s LYS 55 N 1.05 1.40 -0.11 3.50 3.01 -0.15 -4.64 119.74 123.79 1a9v s LYS 55 Ca 0.25 -1.60 0.00 0.00 -1.01 0.00 0.00 55.97 53.61 1a9v s LYS 55 Cb -0.15 -2.88 -0.02 0.00 -1.01 0.00 0.00 37.83 33.76 1a9v s LYS 55 CO 0.10 -0.89 -0.11 0.00 0.51 0.00 0.00 175.35 174.96 1a9v s ALA 56 N 1.10 2.74 -0.42 5.17 0.00 -1.22 -1.18 121.76 127.96 1a9v s ALA 56 Ca 0.08 -0.90 -0.07 0.00 0.00 0.00 0.00 51.96 51.08 1a9v s ALA 56 Cb -0.19 -1.22 0.10 0.00 0.00 0.00 0.00 23.12 21.81 1a9v s ALA 56 CO -0.11 0.35 0.24 -1.54 0.00 0.00 0.00 175.76 174.70 1a9v s SER 57 N -0.02 5.47 -0.46 0.00 1.04 -0.51 -0.73 113.70 118.49 1a9v s SER 57 Ca -0.02 -1.77 -0.03 0.00 0.48 0.00 0.00 55.95 54.60 1a9v s SER 57 Cb -0.14 -1.92 0.12 0.00 0.10 0.00 0.00 66.02 64.18 1a9v s SER 57 CO 0.04 -0.56 0.27 0.27 0.98 0.00 0.00 173.24 174.23 1a9v s ILE 58 N 1.30 3.45 -0.97 -1.02 -4.36 -1.24 -0.69 121.20 117.67 1a9v s ILE 58 Ca 0.05 -2.25 -0.16 0.00 -0.26 0.00 0.00 60.65 58.03 1a9v s ILE 58 Cb -0.24 -3.33 0.02 0.00 1.25 0.00 0.00 42.46 40.17 1a9v s ILE 58 CO -0.01 -0.74 0.61 0.47 0.24 0.00 0.00 174.94 175.51 1a9v n ASP 59 N 4.36 -4.27 0.00 4.36 8.00 1.12 -0.21 116.55 129.90 1a9v n ASP 59 Ca -0.00 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1a9v n ASP 59 Cb 0.40 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 39.99 1a9v n ASP 59 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a9v n GLY 60 N -1.82 3.00 2.75 0.44 0.00 -1.26 -4.80 105.19 103.50 1a9v n GLY 60 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 1a9v n GLY 60 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1a9v n LEU 61 N 0.00 6.29 -4.62 0.99 0.00 0.70 -5.01 117.00 115.36 1a9v n LEU 61 Ca 0.00 -5.44 -0.43 0.00 0.00 0.00 0.00 56.01 50.15 1a9v n LEU 61 Cb 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 43.42 42.47 1a9v n LEU 61 CO 0.00 2.14 1.65 -0.70 0.00 0.00 0.00 177.39 180.48 1a9v s GLU 62 N -3.99 3.52 0.35 1.96 2.12 -1.26 -3.69 118.70 117.70 1a9v s GLU 62 Ca 0.44 1.98 -0.27 0.00 0.36 0.00 0.00 54.97 57.48 1a9v s GLU 62 Cb 0.25 -4.23 -0.09 0.00 0.26 0.00 0.00 34.13 30.32 1a9v s GLU 62 CO -0.16 -1.65 1.13 0.14 -0.54 0.00 0.00 175.26 174.17 1a9v s VAL 63 N 6.62 3.37 -0.40 3.70 -7.23 0.10 -4.90 120.40 121.65 1a9v s VAL 63 Ca 0.89 1.23 0.10 0.00 -1.81 0.00 0.00 61.98 62.38 1a9v s VAL 63 Cb -0.32 -3.73 0.30 0.00 0.56 0.00 0.00 36.38 33.20 1a9v s VAL 63 CO 0.35 0.18 0.65 -0.67 -0.31 0.00 0.00 175.10 175.30 1a9v n ASP 64 N 0.54 0.82 -3.54 4.85 2.03 -1.26 -3.37 116.55 116.62 1a9v n ASP 64 Ca 0.02 -2.91 -0.13 0.00 0.52 0.00 0.00 54.79 52.28 1a9v n ASP 64 Cb 0.46 -0.63 -0.05 0.00 -0.72 0.00 0.00 41.12 40.18 1a9v n ASP 64 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1a9v s VAL 65 N -1.96 0.00 0.19 5.18 0.11 -1.26 -5.15 120.40 117.51 1a9v s VAL 65 Ca 0.38 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.16 1a9v s VAL 65 Cb 0.26 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 34.03 1a9v s VAL 65 CO -0.09 0.00 0.85 -2.16 -3.33 0.00 0.00 175.10 170.36 1a9v s PRO 66 N -1.51 4.68 -0.44 1.54 0.04 -1.26 -4.90 135.00 133.16 1a9v s PRO 66 Ca -0.05 1.29 0.10 0.00 0.04 0.00 0.00 61.00 62.38 1a9v s PRO 66 Cb -0.00 -3.28 0.35 0.00 0.04 0.00 0.00 34.50 31.61 1a9v s PRO 66 CO 0.03 0.53 0.80 0.41 0.04 0.00 0.00 177.00 178.81 1a9v n GLY 67 N 1.60 4.27 0.00 0.56 0.00 -1.26 -5.08 105.19 105.28 1a9v n GLY 67 Ca -0.04 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1a9v n GLY 67 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1a9v n ILE 68 N 0.12 0.00 -4.40 -0.61 2.08 -1.26 -4.45 119.36 110.83 1a9v n ILE 68 Ca 0.27 0.00 -0.35 0.00 0.56 0.00 0.00 62.75 63.23 1a9v n ILE 68 Cb 0.57 0.00 -0.10 0.00 -0.75 0.00 0.00 39.64 39.36 1a9v n ILE 68 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1a9v s ASP 69 N -1.02 5.14 0.00 4.38 -1.08 -1.26 -4.99 116.67 117.84 1a9v s ASP 69 Ca 0.00 0.11 0.17 0.00 -0.52 0.00 0.00 52.55 52.30 1a9v s ASP 69 Cb 0.00 -1.41 0.05 0.00 -1.46 0.00 0.00 42.92 40.09 1a9v s ASP 69 CO 0.00 0.37 0.93 -0.81 0.52 0.00 0.00 175.17 176.18 1a9v n PRO 70 N 2.08 1.57 -3.59 4.34 -0.05 -1.26 -4.83 135.00 133.27 1a9v n PRO 70 Ca -0.18 -1.08 -0.40 0.00 -0.05 0.00 0.00 63.50 61.79 1a9v n PRO 70 Cb 0.53 -1.30 -0.08 0.00 -0.05 0.00 0.00 33.50 32.60 1a9v n PRO 70 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 1a9v s ASN 71 N -1.76 5.69 0.00 3.54 -0.87 -1.25 -2.30 114.94 117.98 1a9v s ASN 71 Ca 0.16 -2.24 0.00 0.00 -1.57 0.00 0.00 52.86 49.21 1a9v s ASN 71 Cb 0.14 -1.98 0.00 0.00 -0.02 0.00 0.00 41.25 39.39 1a9v s ASN 71 CO 0.34 -0.59 0.84 0.00 -2.57 0.00 0.00 177.10 175.12 1a9v n ALA 72 N 4.43 2.37 0.16 0.60 0.00 -1.23 -3.00 120.51 123.85 1a9v n ALA 72 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1a9v n ALA 72 Cb 0.41 -1.00 0.15 0.00 0.00 0.00 0.00 19.45 19.01 1a9v n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a9v n HIS 74 N -3.30 0.19 -0.23 0.00 8.25 -1.16 -3.08 115.22 115.89 1a9v n HIS 74 Ca 0.01 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1a9v n HIS 74 Cb 0.65 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1a9v n HIS 74 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1a9v n TYR 75 N -0.10 0.00 -3.64 4.41 4.01 -0.53 -5.07 117.16 116.23 1a9v n TYR 75 Ca 0.04 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.71 1a9v n TYR 75 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.11 1a9v n TYR 75 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1a9v s MET 76 N -0.25 0.69 0.00 -0.72 0.23 -0.20 -5.07 119.30 113.98 1a9v s MET 76 Ca 0.00 1.14 0.00 0.00 -1.03 0.00 0.00 55.69 55.80 1a9v s MET 76 Cb 0.00 0.16 0.00 0.00 -1.53 0.00 0.00 34.83 33.46 1a9v s MET 76 CO 0.00 -0.14 0.00 0.36 -2.03 0.00 0.00 175.02 173.21 1a9v n LYS 77 N 4.04 0.00 -3.83 3.16 2.85 -1.26 -4.59 118.16 118.53 1a9v n LYS 77 Ca -0.19 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.70 1a9v n LYS 77 Cb 0.58 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.90 1a9v n LYS 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1a9v s PRO 79 N -1.07 2.08 -0.16 0.00 0.04 -1.26 -5.10 135.00 129.52 1a9v s PRO 79 Ca 0.17 -0.07 -0.15 0.00 0.04 0.00 0.00 61.00 60.99 1a9v s PRO 79 Cb -0.13 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1a9v s PRO 79 CO 0.06 -1.42 0.33 -0.51 0.04 0.00 0.00 177.00 175.50 1a9v s LEU 80 N -5.42 4.24 -0.09 -3.56 1.02 0.22 -4.94 118.68 110.16 1a9v s LEU 80 Ca 0.61 0.56 -0.01 0.00 0.02 0.00 0.00 54.13 55.31 1a9v s LEU 80 Cb -0.11 -2.44 -0.03 0.00 0.02 0.00 0.00 46.19 43.63 1a9v s LEU 80 CO 0.47 0.07 -0.03 0.54 0.02 0.00 0.00 176.35 177.42 1a9v s VAL 81 N 0.57 4.06 -0.45 -1.59 0.11 -1.26 -0.57 120.40 121.26 1a9v s VAL 81 Ca 0.18 -0.33 -0.44 0.00 -2.93 0.00 0.00 61.98 58.45 1a9v s VAL 81 Cb -0.13 -2.71 -0.19 0.00 -1.53 0.00 0.00 36.38 31.82 1a9v s VAL 81 CO 0.05 0.58 1.77 1.17 -3.33 0.00 0.00 175.10 175.35 1a9v n LYS 82 N 2.41 0.28 0.00 1.54 0.00 0.42 -1.46 118.16 121.34 1a9v n LYS 82 Ca -0.18 0.10 0.00 0.00 0.00 0.00 0.00 58.31 58.23 1a9v n LYS 82 Cb 0.53 -1.67 0.00 0.00 0.00 0.00 0.00 35.03 33.90 1a9v n LYS 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1a9v n GLY 83 N 4.90 2.16 3.69 3.14 0.00 0.80 -4.84 105.19 115.04 1a9v n GLY 83 Ca 0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 1a9v n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a9v s GLN 84 N -0.19 4.33 0.43 1.61 -0.21 -0.54 -4.57 119.66 120.53 1a9v s GLN 84 Ca 0.00 1.86 -0.25 0.00 0.02 0.00 0.00 55.36 56.98 1a9v s GLN 84 Cb 0.00 -3.51 -0.08 0.00 1.00 0.00 0.00 33.01 30.42 1a9v s GLN 84 CO 0.00 -0.48 1.32 -0.65 -2.12 0.00 0.00 175.29 173.37 1a9v s GLN 85 N 2.02 3.82 -0.06 2.91 -0.21 -1.26 -1.16 119.66 125.72 1a9v s GLN 85 Ca 0.61 2.19 -0.02 0.00 0.02 0.00 0.00 55.36 58.15 1a9v s GLN 85 Cb -0.30 -2.66 0.04 0.00 1.00 0.00 0.00 33.01 31.09 1a9v s GLN 85 CO 0.26 -0.63 0.12 0.71 -2.12 0.00 0.00 175.29 173.63 1a9v s TYR 86 N -1.28 -0.10 -0.09 0.91 2.02 -0.51 -4.85 117.35 113.45 1a9v s TYR 86 Ca 0.60 0.43 0.03 0.00 -0.37 0.00 0.00 57.07 57.75 1a9v s TYR 86 Cb -0.39 -0.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.93 1a9v s TYR 86 CO 0.49 -0.19 -0.20 0.16 -1.57 0.00 0.00 175.55 174.25 1a9v s ASP 87 N 1.67 3.49 0.20 2.29 1.47 -1.26 -0.88 116.67 123.66 1a9v s ASP 87 Ca -0.03 -0.43 0.04 0.00 1.18 0.00 0.00 52.55 53.31 1a9v s ASP 87 Cb -0.12 -1.27 -0.03 0.00 -0.34 0.00 0.00 42.92 41.16 1a9v s ASP 87 CO -0.05 0.20 0.29 -0.51 0.68 0.00 0.00 175.17 175.79 1a9v s ILE 88 N 0.09 5.10 -0.09 2.11 2.07 0.41 -4.92 121.20 125.99 1a9v s ILE 88 Ca -0.09 -0.95 -0.09 0.00 -1.41 0.00 0.00 60.65 58.11 1a9v s ILE 88 Cb -0.15 -3.71 0.02 0.00 0.13 0.00 0.00 42.46 38.75 1a9v s ILE 88 CO 0.06 -0.23 0.26 -0.75 -1.91 0.00 0.00 174.94 172.36 1a9v s LYS 89 N -3.63 0.34 -0.17 3.50 2.20 -1.26 -1.38 119.74 119.34 1a9v s LYS 89 Ca 0.34 0.27 -0.04 0.00 -0.36 0.00 0.00 55.97 56.18 1a9v s LYS 89 Cb -0.10 0.16 0.08 0.00 -1.51 0.00 0.00 37.83 36.46 1a9v s LYS 89 CO 0.28 -0.05 0.19 -0.47 -0.36 0.00 0.00 175.35 174.94 1a9v s TYR 90 N -0.07 -0.19 -0.15 4.03 6.14 0.07 -4.77 117.35 122.41 1a9v s TYR 90 Ca -0.02 0.25 -0.01 0.00 0.64 0.00 0.00 57.07 57.93 1a9v s TYR 90 Cb -0.02 -0.38 0.04 0.00 0.42 0.00 0.00 41.96 42.02 1a9v s TYR 90 CO 0.01 -0.51 -0.03 -0.08 0.64 0.00 0.00 175.55 175.58 1a9v s THR 91 N 2.29 0.85 -0.16 4.34 -1.32 -1.20 -0.57 115.64 119.87 1a9v s THR 91 Ca 0.05 -0.43 -0.04 0.00 -1.21 0.00 0.00 61.69 60.05 1a9v s THR 91 Cb -0.15 -1.07 0.07 0.00 -1.51 0.00 0.00 72.50 69.84 1a9v s THR 91 CO -0.10 0.12 0.13 0.86 -2.21 0.00 0.00 174.62 173.42 1a9v s TRP 92 N 1.75 0.00 0.69 9.09 -0.00 -0.49 -4.89 118.94 125.10 1a9v s TRP 92 Ca 0.02 -0.01 -0.11 0.00 -0.00 0.00 0.00 56.10 55.99 1a9v s TRP 92 Cb -0.15 -0.53 0.01 0.00 -0.00 0.00 0.00 33.47 32.80 1a9v s TRP 92 CO -0.07 -0.49 1.06 0.54 -0.00 0.00 0.00 176.95 177.99 1a9v s ASN 93 N 2.21 5.38 0.28 5.86 4.22 -1.26 -1.21 114.94 130.42 1a9v s ASN 93 Ca 0.04 1.65 -0.12 0.00 -2.14 0.00 0.00 52.86 52.28 1a9v s ASN 93 Cb -0.15 -2.50 0.01 0.00 1.28 0.00 0.00 41.25 39.88 1a9v s ASN 93 CO -0.09 -1.45 0.54 -0.69 -2.04 0.00 0.00 177.10 173.37 1a9v s VAL 94 N -2.98 0.00 0.54 3.54 1.01 0.20 -4.87 120.40 117.84 1a9v s VAL 94 Ca 0.59 -1.35 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 1a9v s VAL 94 Cb -0.14 -2.32 -0.13 0.00 0.00 0.00 0.00 36.38 33.79 1a9v s VAL 94 CO 0.53 0.00 -0.25 -0.81 0.00 0.00 0.00 175.10 174.58 1a9v n PRO 95 N -0.43 0.00 0.18 2.72 -0.04 -1.26 -2.77 135.00 133.39 1a9v n PRO 95 Ca -0.02 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.50 1a9v n PRO 95 Cb 0.61 -0.88 0.12 0.00 -0.04 0.00 0.00 33.50 33.32 1a9v n PRO 95 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1a9v h LYS 96 N -0.20 0.00 -0.63 0.54 6.56 -1.89 0.17 116.57 121.11 1a9v h LYS 96 Ca -0.37 0.00 -0.29 0.00 -1.06 0.00 0.00 60.65 58.93 1a9v h LYS 96 Cb 1.24 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 32.50 1a9v h LYS 96 CO 0.33 0.31 -1.12 1.51 -2.06 0.00 0.00 179.45 178.41 1a9v n ILE 97 N -3.20 1.26 0.06 1.86 3.06 -1.26 0.25 119.36 121.39 1a9v n ILE 97 Ca 0.02 -3.05 -0.02 0.00 -2.50 0.00 0.00 62.75 57.20 1a9v n ILE 97 Cb 0.63 0.97 -0.01 0.00 0.54 0.00 0.00 39.64 41.77 1a9v n ILE 97 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1a9v h ALA 98 N 2.70 -0.54 -2.30 1.51 0.00 -1.94 -3.45 119.26 115.24 1a9v h ALA 98 Ca -0.10 -0.04 -0.51 0.00 0.00 0.00 0.00 54.91 54.26 1a9v h ALA 98 Cb 1.25 0.06 0.16 0.00 0.00 0.00 0.00 17.79 19.26 1a9v h ALA 98 CO 0.31 -0.53 0.28 -1.25 0.00 0.00 0.00 179.25 178.06 1a9v s PRO 99 N -2.42 1.74 -0.38 0.00 0.04 -1.26 -4.97 135.00 127.75 1a9v s PRO 99 Ca -0.02 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.22 1a9v s PRO 99 Cb 0.00 -1.83 0.07 0.00 0.04 0.00 0.00 34.50 32.78 1a9v s PRO 99 CO 0.07 -2.04 0.18 0.15 0.04 0.00 0.00 177.00 175.40 1a9v s LYS 100 N -4.81 2.52 -0.87 4.56 -0.14 -1.26 -4.99 119.74 114.75 1a9v s LYS 100 Ca 0.63 -1.39 -0.25 0.00 -1.36 0.00 0.00 55.97 53.60 1a9v s LYS 100 Cb -0.19 -3.59 -0.20 0.00 -1.68 0.00 0.00 37.83 32.16 1a9v s LYS 100 CO 0.57 -0.84 2.51 -1.13 -0.76 0.00 0.00 175.35 175.70 1a9v n SER 101 N 4.81 0.53 0.05 2.83 3.41 -1.26 -3.32 113.62 120.67 1a9v n SER 101 Ca -0.10 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 1a9v n SER 101 Cb 0.43 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1a9v n SER 101 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a9v n GLU 102 N 8.06 0.00 -2.91 4.33 1.02 -1.26 -4.77 120.64 125.11 1a9v n GLU 102 Ca 0.58 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.70 1a9v n GLU 102 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.63 1a9v n GLU 102 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1a9v s ASN 103 N -2.00 -1.43 -0.05 1.62 3.04 -1.21 -4.75 114.94 110.16 1a9v s ASN 103 Ca 0.00 -1.35 -0.03 0.00 0.04 0.00 0.00 52.86 51.52 1a9v s ASN 103 Cb 0.00 1.85 0.03 0.00 -1.54 0.00 0.00 41.25 41.59 1a9v s ASN 103 CO 0.00 -0.09 0.13 -0.69 -3.04 0.00 0.00 177.10 173.41 1a9v s VAL 104 N 1.22 -0.03 -0.03 -5.21 1.01 -1.25 0.36 120.40 116.47 1a9v s VAL 104 Ca 0.25 0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.33 1a9v s VAL 104 Cb -0.01 -0.20 0.03 0.00 0.00 0.00 0.00 36.38 36.20 1a9v s VAL 104 CO -0.06 0.04 0.05 0.54 0.00 0.00 0.00 175.10 175.67 1a9v s VAL 105 N 0.70 -0.05 -0.06 2.92 0.11 0.14 -4.46 120.40 119.69 1a9v s VAL 105 Ca -0.05 0.20 -0.02 0.00 -2.93 0.00 0.00 61.98 59.18 1a9v s VAL 105 Cb -0.07 -0.10 -0.04 0.00 -1.53 0.00 0.00 36.38 34.64 1a9v s VAL 105 CO -0.03 0.08 0.04 0.54 -3.33 0.00 0.00 175.10 172.40 1a9v s VAL 106 N 1.03 4.56 -0.21 2.04 0.11 -0.14 -1.42 120.40 126.36 1a9v s VAL 106 Ca -0.08 -0.27 -0.02 0.00 -2.93 0.00 0.00 61.98 58.68 1a9v s VAL 106 Cb -0.12 -2.98 0.06 0.00 -1.53 0.00 0.00 36.38 31.81 1a9v s VAL 106 CO -0.03 0.52 0.02 -0.89 -3.33 0.00 0.00 175.10 171.39 1a9v s THR 107 N -1.01 0.75 0.01 5.04 2.01 -0.32 0.01 115.64 122.13 1a9v s THR 107 Ca 0.17 -0.76 0.05 0.00 0.31 0.00 0.00 61.69 61.46 1a9v s THR 107 Cb -0.12 -1.24 -0.02 0.00 0.01 0.00 0.00 72.50 71.14 1a9v s THR 107 CO 0.06 -0.23 -0.16 -0.69 -0.69 0.00 0.00 174.62 172.91 1a9v s VAL 108 N 1.75 1.30 0.09 3.82 1.01 -0.62 -0.98 120.40 126.77 1a9v s VAL 108 Ca -0.01 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.19 1a9v s VAL 108 Cb -0.17 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 1a9v s VAL 108 CO -0.09 0.26 -0.13 -1.59 0.00 0.00 0.00 175.10 173.55 1a9v s LYS 109 N -0.66 0.88 -0.23 2.72 0.00 -0.50 -1.15 119.74 120.81 1a9v s LYS 109 Ca 0.06 -1.09 -0.09 0.00 0.00 0.00 0.00 55.97 54.85 1a9v s LYS 109 Cb -0.07 -0.76 -0.04 0.00 0.00 0.00 0.00 37.83 36.96 1a9v s LYS 109 CO 0.00 0.15 0.11 0.08 0.00 0.00 0.00 175.35 175.69 1a9v s VAL 110 N -1.85 4.93 -0.24 1.79 1.01 -0.21 -0.74 120.40 125.09 1a9v s VAL 110 Ca 0.03 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 1a9v s VAL 110 Cb -0.07 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 1a9v s VAL 110 CO 0.02 0.36 0.09 0.00 0.00 0.00 0.00 175.10 175.57 1a9v s MET 111 N 1.09 3.75 0.00 2.72 0.00 -0.77 0.93 119.30 127.02 1a9v s MET 111 Ca 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 55.69 55.31 1a9v s MET 111 Cb -0.14 -3.35 0.00 0.00 0.00 0.00 0.00 34.83 31.34 1a9v s MET 111 CO 0.04 -0.11 0.00 0.41 0.00 0.00 0.00 175.02 175.36 1a9v n GLY 112 N 4.70 0.84 0.00 3.16 0.00 0.84 0.15 105.19 114.88 1a9v n GLY 112 Ca -0.16 -0.98 0.15 0.00 0.00 0.00 0.00 46.02 45.03 1a9v n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a9v n ASP 113 N 0.00 0.00 0.00 1.61 5.75 -0.55 -3.12 116.55 120.24 1a9v n ASP 113 Ca 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 54.79 54.53 1a9v n ASP 113 Cb 0.00 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 1a9v n ASP 113 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1a9v n ASP 114 N -1.25 0.30 -0.99 -1.12 5.68 -1.26 -4.95 116.55 112.96 1a9v n ASP 114 Ca 0.15 -0.67 0.00 0.00 -0.50 0.00 0.00 54.79 53.78 1a9v n ASP 114 Cb 0.22 0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 1a9v n ASP 114 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a9v n GLY 115 N 0.26 -0.90 0.00 6.12 0.00 -1.18 -5.11 105.19 104.37 1a9v n GLY 115 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1a9v n GLY 115 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1a9v n VAL 116 N -0.20 0.00 0.21 1.61 3.14 -1.26 -4.72 118.33 117.12 1a9v n VAL 116 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1a9v n VAL 116 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1a9v n VAL 116 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1a9v n LEU 117 N 0.00 -3.80 -3.63 6.55 -0.00 0.26 -0.11 117.00 116.28 1a9v n LEU 117 Ca 0.00 0.86 -0.03 0.00 -0.00 0.00 0.00 56.01 56.85 1a9v n LEU 117 Cb 0.00 3.57 -0.06 0.00 -0.00 0.00 0.00 43.42 46.93 1a9v n LEU 117 CO 0.00 0.27 0.63 0.00 -0.00 0.00 0.00 177.39 178.30 1a9v s ALA 118 N -2.00 -2.26 0.00 1.96 0.00 -0.90 -4.76 121.76 113.80 1a9v s ALA 118 Ca 0.00 2.22 0.02 0.00 0.00 0.00 0.00 51.96 54.21 1a9v s ALA 118 Cb 0.00 -1.70 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 1a9v s ALA 118 CO 0.00 -0.40 -0.08 0.00 0.00 0.00 0.00 175.76 175.28 1a9v s ALA 120 N -0.33 -0.58 -0.11 0.00 0.00 -0.30 -2.61 121.76 117.83 1a9v s ALA 120 Ca 0.01 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 1a9v s ALA 120 Cb -0.04 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1a9v s ALA 120 CO -0.00 -0.13 -0.10 -1.50 0.00 0.00 0.00 175.76 174.03 1a9v s ILE 121 N 0.43 3.37 0.40 0.00 -1.16 0.32 -1.59 121.20 122.97 1a9v s ILE 121 Ca -0.03 -0.57 0.04 0.00 -0.51 0.00 0.00 60.65 59.59 1a9v s ILE 121 Cb -0.04 -2.41 -0.03 0.00 0.61 0.00 0.00 42.46 40.59 1a9v s ILE 121 CO -0.02 0.54 0.14 0.00 -2.81 0.00 0.00 174.94 172.79 1a9v s ALA 122 N -0.02 2.85 -0.15 1.50 0.00 0.10 -1.63 121.76 124.41 1a9v s ALA 122 Ca -0.02 -1.30 0.10 0.00 0.00 0.00 0.00 51.96 50.74 1a9v s ALA 122 Cb -0.14 0.79 -0.23 0.00 0.00 0.00 0.00 23.12 23.54 1a9v s ALA 122 CO 0.04 -0.36 0.23 0.25 0.00 0.00 0.00 175.76 175.92 1a9v n THR 123 N -0.89 1.53 0.00 0.00 -2.24 -1.26 -0.97 114.28 110.45 1a9v n THR 123 Ca -0.05 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1a9v n THR 123 Cb 0.65 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 1a9v n THR 123 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1a9v n HIS 124 N -3.03 0.00 -3.84 4.78 8.25 -1.26 -4.40 115.22 115.72 1a9v n HIS 124 Ca -0.30 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 56.86 1a9v n HIS 124 Cb 1.08 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 32.04 1a9v n HIS 124 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a9v s ALA 125 N 0.00 1.72 -0.81 -1.41 0.00 -1.26 -4.08 121.76 115.92 1a9v s ALA 125 Ca 0.00 -1.41 0.02 0.00 0.00 0.00 0.00 51.96 50.56 1a9v s ALA 125 Cb 0.00 -1.48 0.20 0.00 0.00 0.00 0.00 23.12 21.84 1a9v s ALA 125 CO 0.00 -1.37 0.67 1.63 0.00 0.00 0.00 175.76 176.69 1a9v n LYS 126 N 4.76 2.33 -2.92 0.00 5.02 0.12 -4.32 118.16 123.15 1a9v n LYS 126 Ca -0.07 -4.50 -0.41 0.00 -2.02 0.00 0.00 58.31 51.31 1a9v n LYS 126 Cb 0.44 -2.35 -0.04 0.00 -0.02 0.00 0.00 35.03 33.05 1a9v n LYS 126 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1a9v s ILE 127 N -1.50 4.90 -0.15 -0.18 2.07 -1.26 -4.42 121.20 120.65 1a9v s ILE 127 Ca 0.27 1.58 -0.30 0.00 -1.41 0.00 0.00 60.65 60.79 1a9v s ILE 127 Cb -0.05 -4.11 0.13 0.00 0.13 0.00 0.00 42.46 38.56 1a9v s ILE 127 CO -0.14 0.04 1.00 -0.60 -1.91 0.00 0.00 174.94 173.34 1a9v s ARG 128 N 2.09 0.59 0.00 3.50 6.06 -1.26 -4.55 118.95 125.37 1a9v s ARG 128 Ca 0.37 0.10 0.00 0.00 -2.50 0.00 0.00 55.73 53.70 1a9v s ARG 128 Cb -0.16 0.28 0.00 0.00 0.06 0.00 0.00 34.95 35.12 1a9v s ARG 128 CO 0.12 -0.19 0.00 -0.25 -2.50 0.00 0.00 175.30 172.48