#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 -3.27 -4.10 1.43 3.00 -1.26 -4.88 117.38 108.30 1a9v n GLN 2 Ca 0.00 2.63 -0.15 0.00 -0.01 0.00 0.00 57.00 59.47 1a9v n GLN 2 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 30.24 26.60 1a9v n GLN 2 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 1a9v s VAL 3 N -4.53 0.00 0.17 5.09 -7.23 -1.24 -3.95 120.40 108.71 1a9v s VAL 3 Ca 0.00 -1.63 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 1a9v s VAL 3 Cb 0.00 -2.63 -0.07 0.00 0.56 0.00 0.00 36.38 34.24 1a9v s VAL 3 CO 0.00 0.00 0.95 -0.62 -0.31 0.00 0.00 175.10 175.12 1a9v s ASP 4 N -3.25 7.57 0.20 4.85 2.15 -0.90 -4.67 116.67 122.62 1a9v s ASP 4 Ca 0.31 1.87 -0.22 0.00 0.43 0.00 0.00 52.55 54.94 1a9v s ASP 4 Cb -0.00 -2.60 0.07 0.00 -0.30 0.00 0.00 42.92 40.09 1a9v s ASP 4 CO 0.21 0.04 1.01 0.54 -0.17 0.00 0.00 175.17 176.80 1a9v s VAL 5 N -0.56 0.00 -0.19 1.11 0.11 -1.26 -4.76 120.40 114.85 1a9v s VAL 5 Ca 0.44 -0.63 -0.12 0.00 -2.93 0.00 0.00 61.98 58.74 1a9v s VAL 5 Cb -0.25 -2.88 0.06 0.00 -1.53 0.00 0.00 36.38 31.78 1a9v s VAL 5 CO 0.31 0.00 0.47 -0.54 -3.33 0.00 0.00 175.10 172.01 1a9v s LYS 6 N -2.19 0.49 0.44 1.54 1.02 -0.38 -4.96 119.74 115.70 1a9v s LYS 6 Ca 0.21 0.82 -0.23 0.00 0.02 0.00 0.00 55.97 56.79 1a9v s LYS 6 Cb -0.03 0.08 -0.08 0.00 -0.52 0.00 0.00 37.83 37.28 1a9v s LYS 6 CO 0.06 -0.13 1.12 0.34 -0.92 0.00 0.00 175.35 175.81 1a9v s ASP 7 N 1.13 6.38 -0.01 2.83 2.15 -1.26 -0.75 116.67 127.14 1a9v s ASP 7 Ca -0.07 2.19 0.02 0.00 0.43 0.00 0.00 52.55 55.11 1a9v s ASP 7 Cb -0.07 -2.59 0.02 0.00 -0.30 0.00 0.00 42.92 39.98 1a9v s ASP 7 CO -0.10 -0.76 0.84 0.00 -0.17 0.00 0.00 175.17 174.98 1a9v n ALA 9 N -0.14 1.51 -2.77 0.00 0.00 -1.26 -4.94 120.51 112.91 1a9v n ALA 9 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 1a9v n ALA 9 Cb 0.60 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.12 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 -0.51 -2.44 -2.29 0.00 5.15 -1.26 -4.94 115.26 108.97 1a9v n ASN 10 Ca 0.00 -3.46 -0.03 0.00 -0.60 0.00 0.00 54.58 50.49 1a9v n ASN 10 Cb 0.00 1.73 -0.01 0.00 -0.53 0.00 0.00 39.78 40.98 1a9v n ASN 10 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 1a9v n HIS 11 N 1.01 -1.59 -0.19 1.20 -0.00 -1.26 -4.68 115.22 109.70 1a9v n HIS 11 Ca 0.08 0.04 0.01 0.00 -0.00 0.00 0.00 57.72 57.85 1a9v n HIS 11 Cb 0.66 -0.88 0.22 0.00 -0.00 0.00 0.00 29.99 29.99 1a9v n HIS 11 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1a9v n GLU 12 N -2.16 3.06 -2.09 1.57 0.00 -1.26 -4.91 120.64 114.85 1a9v n GLU 12 Ca 0.01 -1.90 -0.01 0.00 0.00 0.00 0.00 57.16 55.26 1a9v n GLU 12 Cb 0.41 -1.92 -0.00 0.00 0.00 0.00 0.00 31.44 29.93 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 0.21 0.00 0.00 6.31 5.41 -1.26 -4.00 119.36 126.03 1a9v n ILE 13 Ca 0.21 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1a9v n ILE 13 Cb 0.91 0.02 0.00 0.00 -0.71 0.00 0.00 39.64 39.85 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 -0.04 0.00 -3.81 0.38 2.85 -0.91 -4.77 118.16 111.86 1a9v n LYS 14 Ca -0.01 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.12 1a9v n LYS 14 Cb 0.02 0.00 -0.14 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 -1.81 0.07 -0.28 -1.58 2.20 -0.95 -4.98 119.74 112.41 1a9v s LYS 15 Ca 0.00 0.20 -0.02 0.00 -0.36 0.00 0.00 55.97 55.79 1a9v s LYS 15 Cb 0.00 -0.06 0.09 0.00 -1.51 0.00 0.00 37.83 36.35 1a9v s LYS 15 CO 0.00 -0.08 0.08 0.14 -0.36 0.00 0.00 175.35 175.13 1a9v s VAL 16 N 0.51 0.72 -0.18 4.02 -7.23 -1.26 -0.84 120.40 116.13 1a9v s VAL 16 Ca -0.04 -1.13 -0.18 0.00 -1.81 0.00 0.00 61.98 58.83 1a9v s VAL 16 Cb -0.05 -1.45 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 1a9v s VAL 16 CO -0.02 -0.55 0.47 -0.22 -0.31 0.00 0.00 175.10 174.47 1a9v s LEU 17 N 1.72 4.18 -0.03 1.32 0.20 0.88 -4.41 118.68 122.53 1a9v s LEU 17 Ca 0.07 0.66 -0.04 0.00 0.69 0.00 0.00 54.13 55.51 1a9v s LEU 17 Cb -0.17 -2.64 0.01 0.00 -0.43 0.00 0.00 46.19 42.95 1a9v s LEU 17 CO -0.22 -0.10 0.10 -0.69 -0.29 0.00 0.00 176.35 175.15 1a9v s VAL 18 N 1.26 0.01 0.15 1.68 1.01 -1.26 -1.18 120.40 122.07 1a9v s VAL 18 Ca 0.23 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.83 1a9v s VAL 18 Cb -0.15 -0.17 -0.08 0.00 0.00 0.00 0.00 36.38 35.98 1a9v s VAL 18 CO 0.09 -0.04 1.29 -2.16 0.00 0.00 0.00 175.10 174.28 1a9v s PRO 19 N -0.09 4.40 0.00 2.72 0.04 -1.26 -4.06 135.00 136.75 1a9v s PRO 19 Ca -0.01 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1a9v s PRO 19 Cb -0.01 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1a9v s PRO 19 CO 0.00 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1a9v n GLY 20 N 2.75 2.36 3.82 0.56 0.00 -1.26 -5.02 105.19 108.39 1a9v n GLY 20 Ca 0.08 -0.74 -0.38 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 1.90 0.00 -2.01 0.00 1.44 -1.26 -4.64 115.22 110.65 1a9v n HIS 22 Ca -0.12 -0.01 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 1a9v n HIS 22 Cb 0.51 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 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 -0.01 1.47 0.00 -1.39 0.00 -1.25 -3.65 105.19 100.36 1a9v n GLY 23 Ca 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 -3.72 1.61 7.64 -1.26 -2.13 113.62 115.76 1a9v n SER 24 Ca 0.00 0.46 -0.30 0.00 1.01 0.00 0.00 58.87 60.04 1a9v n SER 24 Cb 0.00 -0.47 0.27 0.00 -1.01 0.00 0.00 64.21 62.99 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 -2.95 -2.12 -0.31 1.43 2.02 -1.26 -4.99 118.70 110.53 1a9v s GLU 25 Ca 0.04 0.17 -0.09 0.00 0.02 0.00 0.00 54.97 55.12 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 0.14 -4.35 0.13 -1.25 0.02 0.00 0.00 175.26 169.95 1a9v s PRO 26 N -5.09 3.22 -0.51 0.39 0.05 -1.26 -4.85 135.00 126.95 1a9v s PRO 26 Ca 0.69 -0.79 -0.13 0.00 0.05 0.00 0.00 61.00 60.82 1a9v s PRO 26 Cb -0.14 -3.51 0.12 0.00 0.05 0.00 0.00 34.50 31.02 1a9v s PRO 26 CO 0.58 -0.44 0.43 0.00 0.05 0.00 0.00 177.00 177.62 1a9v n ILE 28 N 5.12 3.85 -1.71 0.00 2.08 -1.26 -2.37 119.36 125.06 1a9v n ILE 28 Ca -0.12 -3.76 -0.67 0.00 0.56 0.00 0.00 62.75 58.76 1a9v n ILE 28 Cb 0.40 -2.48 -0.10 0.00 -0.75 0.00 0.00 39.64 36.72 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 5.03 0.02 -0.32 1.39 3.06 -1.26 -4.67 119.36 122.62 1a9v n ILE 29 Ca 0.47 -0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.68 1a9v n ILE 29 Cb 0.41 -0.55 -0.05 0.00 0.54 0.00 0.00 39.64 39.99 1a9v n ILE 29 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1a9v n HIS 30 N 4.33 0.00 -1.33 9.51 1.44 -1.26 -3.76 115.22 124.15 1a9v n HIS 30 Ca 0.32 -0.49 0.17 0.00 -2.01 0.00 0.00 57.72 55.72 1a9v n HIS 30 Cb -0.05 -0.74 -0.06 0.00 0.12 0.00 0.00 29.99 29.26 1a9v n HIS 30 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1a9v n ARG 31 N 2.68 -2.88 -0.51 -1.40 1.74 -1.26 -5.02 116.66 110.01 1a9v n ARG 31 Ca 0.12 2.16 0.00 0.00 -0.77 0.00 0.00 57.85 59.36 1a9v n ARG 31 Cb 0.29 -3.44 0.00 0.00 -1.02 0.00 0.00 32.46 28.29 1a9v n ARG 31 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a9v n GLY 32 N -4.17 -3.67 3.03 -0.13 0.00 0.80 -4.94 105.19 96.10 1a9v n GLY 32 Ca -0.04 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 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 -3.00 1.76 -0.01 1.61 -0.14 -0.15 -4.88 119.74 114.93 1a9v s LYS 33 Ca 0.00 -2.09 0.00 0.00 -1.36 0.00 0.00 55.97 52.53 1a9v s LYS 33 Cb 0.00 -3.34 -0.04 0.00 -1.68 0.00 0.00 37.83 32.78 1a9v s LYS 33 CO 0.00 -1.02 0.04 -1.25 -0.76 0.00 0.00 175.35 172.36 1a9v s PRO 34 N 0.60 2.93 -0.53 -1.68 0.04 -1.26 0.32 135.00 135.43 1a9v s PRO 34 Ca 0.12 -0.53 0.00 0.00 0.04 0.00 0.00 61.00 60.64 1a9v s PRO 34 Cb -0.21 -2.77 0.14 0.00 0.04 0.00 0.00 34.50 31.69 1a9v s PRO 34 CO -0.05 0.64 0.30 -0.06 0.04 0.00 0.00 177.00 177.88 1a9v s PHE 35 N -1.11 3.39 -0.61 0.56 0.08 -0.32 -4.92 117.98 115.04 1a9v s PHE 35 Ca 0.20 -2.88 0.01 0.00 0.12 0.00 0.00 56.93 54.38 1a9v s PHE 35 Cb -0.12 -3.04 0.15 0.00 -0.57 0.00 0.00 43.02 39.45 1a9v s PHE 35 CO 0.11 -0.83 0.39 -0.65 -0.10 0.00 0.00 175.22 174.14 1a9v s GLN 36 N 0.10 2.37 -0.09 0.44 1.11 -1.16 -1.47 119.66 120.97 1a9v s GLN 36 Ca 0.15 -2.68 -0.01 0.00 0.01 0.00 0.00 55.36 52.83 1a9v s GLN 36 Cb -0.22 -3.56 -0.03 0.00 -1.01 0.00 0.00 33.01 28.18 1a9v s GLN 36 CO -0.03 -1.16 -0.04 -0.51 0.01 0.00 0.00 175.29 173.56 1a9v s LEU 37 N -0.35 3.34 -0.02 2.90 1.43 -0.18 -4.02 118.68 121.78 1a9v s LEU 37 Ca 0.18 0.03 -0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1a9v s LEU 37 Cb -0.21 -1.75 0.03 0.00 0.03 0.00 0.00 46.19 44.29 1a9v s LEU 37 CO -0.03 0.34 0.03 -1.83 0.23 0.00 0.00 176.35 175.09 1a9v s GLU 38 N -0.66 -0.01 0.02 1.70 4.04 -0.33 -0.62 118.70 122.85 1a9v s GLU 38 Ca 0.10 0.21 -0.05 0.00 0.04 0.00 0.00 54.97 55.27 1a9v s GLU 38 Cb -0.12 -0.32 -0.01 0.00 0.02 0.00 0.00 34.13 33.71 1a9v s GLU 38 CO 0.02 -0.19 0.09 0.00 -1.84 0.00 0.00 175.26 173.33 1a9v s ALA 39 N 1.24 -0.14 -0.05 -0.84 0.00 -0.45 -0.08 121.76 121.44 1a9v s ALA 39 Ca -0.07 -0.37 0.03 0.00 0.00 0.00 0.00 51.96 51.55 1a9v s ALA 39 Cb -0.13 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 1a9v s ALA 39 CO -0.03 -0.23 -0.11 0.14 0.00 0.00 0.00 175.76 175.53 1a9v s VAL 40 N -1.78 3.35 -0.25 0.00 -7.23 -0.02 -0.62 120.40 113.85 1a9v s VAL 40 Ca -0.12 -0.65 -0.10 0.00 -1.81 0.00 0.00 61.98 59.30 1a9v s VAL 40 Cb -0.06 -2.36 0.10 0.00 0.56 0.00 0.00 36.38 34.62 1a9v s VAL 40 CO -0.01 0.57 0.56 0.72 -0.31 0.00 0.00 175.10 176.62 1a9v s PHE 41 N -0.80 -1.04 0.68 2.82 -0.12 -0.10 -2.15 117.98 117.27 1a9v s PHE 41 Ca 0.12 1.92 -0.15 0.00 -0.05 0.00 0.00 56.93 58.78 1a9v s PHE 41 Cb -0.11 0.56 0.01 0.00 -0.63 0.00 0.00 43.02 42.85 1a9v s PHE 41 CO 0.02 -0.55 1.13 -2.00 -0.05 0.00 0.00 175.22 173.77 1a9v s GLU 42 N 2.40 2.64 -0.08 1.99 2.12 -1.26 -1.45 118.70 125.07 1a9v s GLU 42 Ca -0.06 1.47 -0.19 0.00 0.36 0.00 0.00 54.97 56.55 1a9v s GLU 42 Cb -0.10 -1.92 -0.04 0.00 0.26 0.00 0.00 34.13 32.32 1a9v s GLU 42 CO -0.16 -1.39 0.53 0.00 -0.54 0.00 0.00 175.26 173.70 1a9v s ALA 43 N -2.26 3.47 -0.57 6.30 0.00 -0.30 -4.84 121.76 123.56 1a9v s ALA 43 Ca 0.69 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.58 1a9v s ALA 43 Cb -0.22 -2.70 0.40 0.00 0.00 0.00 0.00 23.12 20.59 1a9v s ALA 43 CO 0.42 0.05 1.40 0.27 0.00 0.00 0.00 175.76 177.90 1a9v n ASN 44 N 3.39 5.61 0.00 0.00 2.04 -1.26 0.73 115.26 125.76 1a9v n ASN 44 Ca -0.06 -3.76 0.00 0.00 -0.44 0.00 0.00 54.58 50.32 1a9v n ASN 44 Cb 0.51 -0.65 0.00 0.00 -2.53 0.00 0.00 39.78 37.11 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 -0.50 0.00 -4.19 -3.83 10.64 -1.26 -4.98 117.38 113.26 1a9v n GLN 45 Ca 0.44 0.00 -0.26 0.00 -1.83 0.00 0.00 57.00 55.35 1a9v n GLN 45 Cb 0.53 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.84 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 4.89 -0.17 2.61 3.84 -1.26 0.19 114.94 121.04 1a9v s ASN 46 Ca 0.00 -0.38 -0.31 0.00 0.21 0.00 0.00 52.86 52.38 1a9v s ASN 46 Cb 0.00 -1.07 0.14 0.00 -0.55 0.00 0.00 41.25 39.76 1a9v s ASN 46 CO 0.00 0.07 1.11 0.28 -2.79 0.00 0.00 177.10 175.77 1a9v s THR 47 N -1.83 0.00 -0.92 -5.21 -1.32 0.32 -4.76 115.64 101.92 1a9v s THR 47 Ca 0.29 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.86 1a9v s THR 47 Cb -0.09 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.08 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 0.29 1.79 -3.59 7.08 5.02 -1.26 0.79 118.16 128.28 1a9v n LYS 48 Ca -0.05 -1.57 -0.11 0.00 -2.02 0.00 0.00 58.31 54.56 1a9v n LYS 48 Cb 0.59 -1.20 -0.06 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 -0.31 -0.18 -4.23 -1.26 -4.75 115.64 104.01 1a9v s THR 49 Ca 0.16 0.00 -0.03 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 0.14 0.00 -0.54 0.00 0.00 174.62 174.34 1a9v s ALA 50 N -0.82 0.85 1.26 3.99 0.00 -1.26 -2.13 121.76 123.65 1a9v s ALA 50 Ca -0.01 -1.34 -0.21 0.00 0.00 0.00 0.00 51.96 50.40 1a9v s ALA 50 Cb -0.01 -1.47 0.31 0.00 0.00 0.00 0.00 23.12 21.94 1a9v s ALA 50 CO 0.00 -1.74 1.07 1.63 0.00 0.00 0.00 175.76 176.72 1a9v n LYS 51 N 4.94 -3.22 -3.82 0.00 5.02 0.17 -3.65 118.16 117.61 1a9v n LYS 51 Ca -0.02 -1.72 -0.13 0.00 -2.02 0.00 0.00 58.31 54.42 1a9v n LYS 51 Cb 0.41 -1.63 -0.14 0.00 -0.02 0.00 0.00 35.03 33.64 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 -2.92 -0.02 -0.15 -0.18 1.01 -1.00 -1.73 121.20 116.22 1a9v s ILE 52 Ca 0.70 0.07 -0.04 0.00 0.00 0.00 0.00 60.65 61.38 1a9v s ILE 52 Cb -0.07 -0.11 0.07 0.00 0.01 0.00 0.00 42.46 42.35 1a9v s ILE 52 CO 0.54 0.03 0.15 -0.70 0.00 0.00 0.00 174.94 174.96 1a9v s GLU 53 N 0.39 0.09 -0.14 2.79 2.56 0.08 -4.76 118.70 119.71 1a9v s GLU 53 Ca -0.03 0.22 -0.21 0.00 0.00 0.00 0.00 54.97 54.95 1a9v s GLU 53 Cb -0.04 -1.11 -0.03 0.00 2.00 0.00 0.00 34.13 34.95 1a9v s GLU 53 CO -0.01 -0.54 0.62 -1.50 -0.56 0.00 0.00 175.26 173.26 1a9v s ILE 54 N 2.24 5.07 -0.39 -3.70 2.07 -1.26 -1.42 121.20 123.82 1a9v s ILE 54 Ca 0.04 1.22 0.04 0.00 -1.41 0.00 0.00 60.65 60.54 1a9v s ILE 54 Cb -0.15 -3.95 0.11 0.00 0.13 0.00 0.00 42.46 38.61 1a9v s ILE 54 CO -0.09 0.20 0.11 -0.75 -1.91 0.00 0.00 174.94 172.50 1a9v s LYS 55 N 1.28 1.62 -0.17 3.50 2.20 -0.10 -4.28 119.74 123.78 1a9v s LYS 55 Ca 0.31 -2.07 -0.03 0.00 -0.36 0.00 0.00 55.97 53.81 1a9v s LYS 55 Cb -0.16 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 32.89 1a9v s LYS 55 CO 0.13 -0.99 -0.04 0.00 -0.36 0.00 0.00 175.35 174.09 1a9v s ALA 56 N 0.60 2.92 -0.44 3.13 0.00 -1.13 -1.23 121.76 125.61 1a9v s ALA 56 Ca 0.12 -0.92 -0.09 0.00 0.00 0.00 0.00 51.96 51.07 1a9v s ALA 56 Cb -0.21 -1.57 0.10 0.00 0.00 0.00 0.00 23.12 21.43 1a9v s ALA 56 CO -0.06 0.05 0.30 -1.54 0.00 0.00 0.00 175.76 174.51 1a9v s SER 57 N 0.66 5.69 -0.50 0.00 1.04 -0.43 -0.18 113.70 119.98 1a9v s SER 57 Ca -0.03 -1.67 -0.01 0.00 0.48 0.00 0.00 55.95 54.72 1a9v s SER 57 Cb -0.15 -2.01 0.13 0.00 0.10 0.00 0.00 66.02 64.10 1a9v s SER 57 CO 0.02 -0.61 0.29 0.27 0.98 0.00 0.00 173.24 174.19 1a9v s ILE 58 N 1.41 3.28 -0.72 -1.02 -4.36 -1.25 -0.76 121.20 117.78 1a9v s ILE 58 Ca 0.04 -2.58 -0.03 0.00 -0.26 0.00 0.00 60.65 57.82 1a9v s ILE 58 Cb -0.24 -3.21 0.00 0.00 1.25 0.00 0.00 42.46 40.25 1a9v s ILE 58 CO 0.01 -0.77 0.51 0.47 0.24 0.00 0.00 174.94 175.40 1a9v n ASP 59 N 3.96 -3.94 0.00 4.36 9.92 1.13 -0.75 116.55 131.22 1a9v n ASP 59 Ca 0.03 -0.85 0.00 0.00 -0.53 0.00 0.00 54.79 53.44 1a9v n ASP 59 Cb 0.39 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.54 1a9v n ASP 59 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1a9v n GLY 60 N -1.50 3.04 2.76 0.44 0.00 -1.26 -4.70 105.19 103.96 1a9v n GLY 60 Ca -0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 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 6.27 -4.62 0.99 0.00 0.07 -5.00 117.00 114.70 1a9v n LEU 61 Ca 0.00 -5.40 -0.43 0.00 0.00 0.00 0.00 56.01 50.18 1a9v n LEU 61 Cb 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 43.42 42.49 1a9v n LEU 61 CO 0.00 2.13 1.46 -0.70 0.00 0.00 0.00 177.39 180.28 1a9v s GLU 62 N -3.97 3.65 0.36 1.96 2.12 -1.26 -3.74 118.70 117.82 1a9v s GLU 62 Ca 0.45 1.69 -0.25 0.00 0.36 0.00 0.00 54.97 57.22 1a9v s GLU 62 Cb 0.27 -4.11 -0.10 0.00 0.26 0.00 0.00 34.13 30.45 1a9v s GLU 62 CO -0.18 -1.47 0.97 0.14 -0.54 0.00 0.00 175.26 174.18 1a9v s VAL 63 N 5.80 4.13 -0.39 3.70 -7.23 0.75 -4.92 120.40 122.24 1a9v s VAL 63 Ca 0.77 1.66 0.12 0.00 -1.81 0.00 0.00 61.98 62.71 1a9v s VAL 63 Cb -0.26 -3.87 0.36 0.00 0.56 0.00 0.00 36.38 33.17 1a9v s VAL 63 CO 0.32 0.04 0.77 -0.67 -0.31 0.00 0.00 175.10 175.24 1a9v n ASP 64 N 0.23 1.26 -3.58 4.85 2.03 -1.26 -2.82 116.55 117.25 1a9v n ASP 64 Ca 0.03 -3.06 -0.17 0.00 0.52 0.00 0.00 54.79 52.12 1a9v n ASP 64 Cb 0.51 -0.61 -0.07 0.00 -0.72 0.00 0.00 41.12 40.23 1a9v n ASP 64 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1a9v s VAL 65 N -2.70 0.02 0.12 5.18 1.01 -1.26 -5.10 120.40 117.67 1a9v s VAL 65 Ca 0.40 -0.13 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 1a9v s VAL 65 Cb 0.35 -0.91 -0.07 0.00 0.00 0.00 0.00 36.38 35.75 1a9v s VAL 65 CO -0.08 -0.07 0.62 -2.16 0.00 0.00 0.00 175.10 173.41 1a9v s PRO 66 N -1.33 4.23 -0.63 2.72 0.04 -1.26 -4.71 135.00 134.06 1a9v s PRO 66 Ca -0.11 0.79 0.02 0.00 0.04 0.00 0.00 61.00 61.73 1a9v s PRO 66 Cb -0.01 -3.13 0.39 0.00 0.04 0.00 0.00 34.50 31.78 1a9v s PRO 66 CO 0.08 0.56 1.53 0.41 0.04 0.00 0.00 177.00 179.62 1a9v n GLY 67 N 1.39 5.79 0.00 0.56 0.00 -1.26 -5.01 105.19 106.66 1a9v n GLY 67 Ca -0.07 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.31 1a9v n GLY 67 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1a9v n ILE 68 N -0.49 0.00 -3.76 -0.61 0.13 -1.26 -4.35 119.36 109.02 1a9v n ILE 68 Ca 0.46 0.00 -0.34 0.00 -1.10 0.00 0.00 62.75 61.77 1a9v n ILE 68 Cb 0.46 0.00 -0.10 0.00 -0.84 0.00 0.00 39.64 39.16 1a9v n ILE 68 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1a9v s ASP 69 N 0.58 5.27 0.00 9.51 -1.08 -1.26 -4.93 116.67 124.77 1a9v s ASP 69 Ca 0.00 -3.37 0.00 0.00 -0.52 0.00 0.00 52.55 48.66 1a9v s ASP 69 Cb 0.00 -1.80 0.00 0.00 -1.46 0.00 0.00 42.92 39.66 1a9v s ASP 69 CO 0.00 -0.23 0.45 -0.81 0.52 0.00 0.00 175.17 175.10 1a9v n PRO 70 N 2.75 0.00 -3.63 4.34 -0.04 -1.26 -4.10 135.00 133.06 1a9v n PRO 70 Ca 0.14 0.10 -0.39 0.00 -0.04 0.00 0.00 63.50 63.31 1a9v n PRO 70 Cb 0.36 -1.66 -0.08 0.00 -0.04 0.00 0.00 33.50 32.08 1a9v n PRO 70 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1a9v s ASN 71 N -1.90 5.58 0.00 3.54 6.03 -1.25 -2.37 114.94 124.56 1a9v s ASN 71 Ca 0.00 -2.58 0.00 0.00 -1.03 0.00 0.00 52.86 49.25 1a9v s ASN 71 Cb 0.00 -1.94 0.00 0.00 -3.03 0.00 0.00 41.25 36.28 1a9v s ASN 71 CO 0.00 -0.48 0.81 0.00 -2.03 0.00 0.00 177.10 175.40 1a9v n ALA 72 N 3.93 2.40 0.16 3.54 0.00 -1.24 -3.24 120.51 126.06 1a9v n ALA 72 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.53 1a9v n ALA 72 Cb 0.40 -1.00 0.16 0.00 0.00 0.00 0.00 19.45 19.02 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 -3.33 0.00 -0.76 0.00 -0.00 -1.20 -2.70 115.22 107.22 1a9v n HIS 74 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1a9v n HIS 74 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.63 1a9v n HIS 74 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1a9v n TYR 75 N -0.79 0.00 -3.69 4.41 4.01 -0.56 -5.05 117.16 115.49 1a9v n TYR 75 Ca 0.13 -0.09 -0.12 0.00 -0.16 0.00 0.00 57.90 57.67 1a9v n TYR 75 Cb 0.06 -0.01 -0.12 0.00 -0.31 0.00 0.00 39.34 38.96 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 -0.17 0.23 -0.61 -0.72 0.23 0.70 -5.04 119.30 113.92 1a9v s MET 76 Ca 0.00 0.71 -0.08 0.00 -1.03 0.00 0.00 55.69 55.29 1a9v s MET 76 Cb 0.00 -0.02 -0.19 0.00 -1.53 0.00 0.00 34.83 33.08 1a9v s MET 76 CO 0.00 -0.21 1.37 0.36 -2.03 0.00 0.00 175.02 174.51 1a9v n LYS 77 N 4.73 0.00 -3.44 3.16 -0.00 -1.26 -4.61 118.16 116.74 1a9v n LYS 77 Ca -0.17 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.77 1a9v n LYS 77 Cb 0.52 -0.67 -0.06 0.00 -0.00 0.00 0.00 35.03 34.82 1a9v n LYS 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a9v s PRO 79 N -1.48 2.61 -0.14 0.00 0.04 -1.26 -5.10 135.00 129.67 1a9v s PRO 79 Ca 0.30 0.16 -0.16 0.00 0.04 0.00 0.00 61.00 61.34 1a9v s PRO 79 Cb -0.16 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1a9v s PRO 79 CO 0.17 -1.08 0.40 -0.51 0.04 0.00 0.00 177.00 176.02 1a9v s LEU 80 N -5.28 4.26 -0.06 -3.56 1.02 0.24 -4.92 118.68 110.37 1a9v s LEU 80 Ca 0.58 0.68 -0.02 0.00 0.02 0.00 0.00 54.13 55.39 1a9v s LEU 80 Cb -0.11 -2.56 -0.04 0.00 0.02 0.00 0.00 46.19 43.51 1a9v s LEU 80 CO 0.48 0.03 0.03 -0.69 0.02 0.00 0.00 176.35 176.23 1a9v s VAL 81 N 0.61 4.49 -0.28 -1.59 1.01 -1.26 -0.52 120.40 122.86 1a9v s VAL 81 Ca 0.22 -0.27 -0.42 0.00 0.00 0.00 0.00 61.98 61.50 1a9v s VAL 81 Cb -0.14 -2.94 -0.18 0.00 0.00 0.00 0.00 36.38 33.12 1a9v s VAL 81 CO 0.08 0.53 1.55 1.17 0.00 0.00 0.00 175.10 178.43 1a9v n LYS 82 N 1.86 0.55 0.00 2.72 0.00 0.51 -1.62 118.16 122.19 1a9v n LYS 82 Ca -0.17 0.20 0.00 0.00 0.00 0.00 0.00 58.31 58.34 1a9v n LYS 82 Cb 0.53 -1.79 0.00 0.00 0.00 0.00 0.00 35.03 33.78 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 3.55 1.48 3.69 3.14 0.00 0.22 -4.85 105.19 112.42 1a9v n GLY 83 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.57 4.44 0.41 1.61 -0.21 -0.64 -4.61 119.66 120.09 1a9v s GLN 84 Ca 0.00 1.48 -0.26 0.00 0.02 0.00 0.00 55.36 56.59 1a9v s GLN 84 Cb 0.00 -3.51 -0.09 0.00 1.00 0.00 0.00 33.01 30.41 1a9v s GLN 84 CO 0.00 -0.27 1.36 1.14 -2.12 0.00 0.00 175.29 175.40 1a9v s GLN 85 N 1.74 3.95 -0.06 2.91 -2.07 -1.26 -1.15 119.66 123.72 1a9v s GLN 85 Ca 0.51 2.28 -0.03 0.00 -1.82 0.00 0.00 55.36 56.31 1a9v s GLN 85 Cb -0.21 -2.79 0.04 0.00 -1.09 0.00 0.00 33.01 28.97 1a9v s GLN 85 CO 0.22 -0.56 0.13 0.71 -1.32 0.00 0.00 175.29 174.47 1a9v s TYR 86 N -1.22 -0.13 -0.06 9.60 2.02 -0.53 -4.86 117.35 122.18 1a9v s TYR 86 Ca 0.57 0.46 0.05 0.00 -0.37 0.00 0.00 57.07 57.78 1a9v s TYR 86 Cb -0.41 -0.19 -0.02 0.00 -0.40 0.00 0.00 41.96 40.95 1a9v s TYR 86 CO 0.53 -0.19 -0.21 0.16 -1.57 0.00 0.00 175.55 174.27 1a9v s ASP 87 N 1.59 3.41 0.27 2.29 -4.77 -1.26 -0.92 116.67 117.28 1a9v s ASP 87 Ca -0.04 -0.41 0.10 0.00 -3.30 0.00 0.00 52.55 48.90 1a9v s ASP 87 Cb -0.12 -0.86 -0.04 0.00 -1.09 0.00 0.00 42.92 40.80 1a9v s ASP 87 CO -0.05 0.27 -0.02 -0.51 0.70 0.00 0.00 175.17 175.55 1a9v s ILE 88 N -0.30 3.30 0.03 2.11 1.10 0.21 -4.95 121.20 122.71 1a9v s ILE 88 Ca 0.01 -1.97 -0.08 0.00 -0.51 0.00 0.00 60.65 58.10 1a9v s ILE 88 Cb -0.13 -2.78 0.00 0.00 0.15 0.00 0.00 42.46 39.70 1a9v s ILE 88 CO 0.02 -0.37 0.16 -0.54 -2.11 0.00 0.00 174.94 172.11 1a9v s LYS 89 N -3.66 0.62 -0.29 3.50 1.02 -1.26 -1.34 119.74 118.33 1a9v s LYS 89 Ca 0.31 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.73 1a9v s LYS 89 Cb -0.06 0.25 0.16 0.00 -0.52 0.00 0.00 37.83 37.66 1a9v s LYS 89 CO 0.19 -0.17 0.40 -0.47 -0.92 0.00 0.00 175.35 174.38 1a9v s TYR 90 N -2.26 -0.95 -0.21 3.18 5.04 0.21 -4.85 117.35 117.51 1a9v s TYR 90 Ca -0.08 0.29 0.01 0.00 -2.44 0.00 0.00 57.07 54.86 1a9v s TYR 90 Cb -0.03 -0.18 0.04 0.00 0.35 0.00 0.00 41.96 42.15 1a9v s TYR 90 CO -0.02 -0.97 -0.12 -0.08 -1.34 0.00 0.00 175.55 173.01 1a9v s THR 91 N 2.53 1.83 -0.16 4.34 -1.32 -1.17 -1.01 115.64 120.69 1a9v s THR 91 Ca 0.10 -1.14 -0.04 0.00 -1.21 0.00 0.00 61.69 59.39 1a9v s THR 91 Cb -0.13 -1.87 0.07 0.00 -1.51 0.00 0.00 72.50 69.06 1a9v s THR 91 CO -0.30 0.18 0.16 0.86 -2.21 0.00 0.00 174.62 173.32 1a9v s TRP 92 N 1.31 -0.11 0.64 9.09 -0.00 -0.54 -4.88 118.94 124.45 1a9v s TRP 92 Ca -0.02 0.16 -0.13 0.00 -0.00 0.00 0.00 56.10 56.11 1a9v s TRP 92 Cb -0.17 -0.44 -0.02 0.00 -0.00 0.00 0.00 33.47 32.85 1a9v s TRP 92 CO -0.08 -0.49 1.05 0.54 -0.00 0.00 0.00 176.95 177.98 1a9v s ASN 93 N 2.26 5.64 0.29 5.86 4.22 -1.26 -1.17 114.94 130.77 1a9v s ASN 93 Ca 0.05 1.71 -0.13 0.00 -2.14 0.00 0.00 52.86 52.34 1a9v s ASN 93 Cb -0.15 -2.51 0.01 0.00 1.28 0.00 0.00 41.25 39.88 1a9v s ASN 93 CO -0.09 -1.26 0.57 0.68 -2.04 0.00 0.00 177.10 174.96 1a9v s VAL 94 N -2.74 0.00 0.39 3.54 -7.23 0.15 -4.89 120.40 109.62 1a9v s VAL 94 Ca 0.61 -1.29 -0.15 0.00 -1.81 0.00 0.00 61.98 59.34 1a9v s VAL 94 Cb -0.15 -2.33 -0.12 0.00 0.56 0.00 0.00 36.38 34.34 1a9v s VAL 94 CO 0.45 0.00 -0.07 -0.81 -0.31 0.00 0.00 175.10 174.36 1a9v n PRO 95 N -0.45 0.00 0.13 4.82 -0.04 -1.26 -2.82 135.00 135.38 1a9v n PRO 95 Ca -0.03 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.44 1a9v n PRO 95 Cb 0.61 -0.80 0.00 0.00 -0.04 0.00 0.00 33.50 33.27 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 0.04 0.00 -0.57 0.54 6.56 -1.90 -0.37 116.57 120.88 1a9v h LYS 96 Ca -0.32 0.00 -0.28 0.00 -1.06 0.00 0.00 60.65 58.98 1a9v h LYS 96 Cb 1.17 0.00 -0.33 0.00 -0.57 0.00 0.00 32.23 32.49 1a9v h LYS 96 CO 0.34 0.56 -0.94 1.51 -2.06 0.00 0.00 179.45 178.86 1a9v n ILE 97 N -3.23 0.81 -0.03 1.86 3.06 -1.26 0.28 119.36 120.85 1a9v n ILE 97 Ca 0.01 -2.55 -0.15 0.00 -2.50 0.00 0.00 62.75 57.57 1a9v n ILE 97 Cb 0.77 0.95 -0.10 0.00 0.54 0.00 0.00 39.64 41.79 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 2.51 0.08 -2.30 1.51 0.00 -1.96 -3.45 119.26 115.65 1a9v h ALA 98 Ca -0.18 -0.43 -0.51 0.00 0.00 0.00 0.00 54.91 53.79 1a9v h ALA 98 Cb 1.24 -0.00 0.15 0.00 0.00 0.00 0.00 17.79 19.17 1a9v h ALA 98 CO 0.24 0.09 0.29 -1.25 0.00 0.00 0.00 179.25 178.63 1a9v s PRO 99 N -3.51 1.95 -0.39 0.00 0.04 -1.26 -4.98 135.00 126.85 1a9v s PRO 99 Ca -0.15 1.24 -0.08 0.00 0.04 0.00 0.00 61.00 62.05 1a9v s PRO 99 Cb 0.02 -1.86 0.06 0.00 0.04 0.00 0.00 34.50 32.77 1a9v s PRO 99 CO 0.75 -1.88 0.20 0.15 0.04 0.00 0.00 177.00 176.25 1a9v s LYS 100 N -4.85 2.60 -0.97 4.56 -0.14 -1.26 -4.98 119.74 114.70 1a9v s LYS 100 Ca 0.62 -1.34 -0.18 0.00 -1.36 0.00 0.00 55.97 53.72 1a9v s LYS 100 Cb -0.18 -3.66 -0.28 0.00 -1.68 0.00 0.00 37.83 32.03 1a9v s LYS 100 CO 0.57 -0.83 2.36 -1.13 -0.76 0.00 0.00 175.35 175.56 1a9v n SER 101 N 4.87 -0.52 0.05 2.83 3.41 -1.26 -3.30 113.62 119.70 1a9v n SER 101 Ca -0.11 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 1a9v n SER 101 Cb 0.44 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 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 6.86 0.00 -3.10 4.33 1.02 -1.26 -5.04 120.64 123.44 1a9v n GLU 102 Ca 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 1a9v n GLU 102 Cb 0.14 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.55 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 -1.37 -0.03 1.62 3.04 -1.21 -4.99 114.94 110.00 1a9v s ASN 103 Ca 0.00 -0.82 -0.04 0.00 0.04 0.00 0.00 52.86 52.05 1a9v s ASN 103 Cb 0.00 1.76 0.01 0.00 -1.54 0.00 0.00 41.25 41.48 1a9v s ASN 103 CO 0.00 -0.14 0.10 -0.69 -3.04 0.00 0.00 177.10 173.33 1a9v s VAL 104 N 1.73 0.01 -0.18 -5.21 1.01 -1.25 0.36 120.40 116.87 1a9v s VAL 104 Ca 0.18 -0.10 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 1a9v s VAL 104 Cb -0.02 -0.18 0.06 0.00 0.00 0.00 0.00 36.38 36.23 1a9v s VAL 104 CO -0.08 -0.06 0.46 -0.69 0.00 0.00 0.00 175.10 174.74 1a9v s VAL 105 N -0.14 -0.01 -0.07 2.92 1.01 0.06 -4.52 120.40 119.65 1a9v s VAL 105 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1a9v s VAL 105 Cb -0.02 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 1a9v s VAL 105 CO 0.00 0.02 -0.05 0.54 0.00 0.00 0.00 175.10 175.61 1a9v s VAL 106 N 0.95 3.85 -0.19 2.92 0.11 -0.33 -1.31 120.40 126.40 1a9v s VAL 106 Ca -0.06 -0.43 -0.02 0.00 -2.93 0.00 0.00 61.98 58.55 1a9v s VAL 106 Cb -0.06 -2.59 0.06 0.00 -1.53 0.00 0.00 36.38 32.26 1a9v s VAL 106 CO -0.08 0.60 0.01 -0.89 -3.33 0.00 0.00 175.10 171.41 1a9v s THR 107 N -0.83 0.68 0.01 5.04 2.01 -0.37 0.03 115.64 122.21 1a9v s THR 107 Ca 0.13 -0.59 0.06 0.00 0.31 0.00 0.00 61.69 61.60 1a9v s THR 107 Cb -0.11 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.28 1a9v s THR 107 CO 0.02 -0.13 -0.19 -0.69 -0.69 0.00 0.00 174.62 172.94 1a9v s VAL 108 N 1.79 1.49 0.09 3.82 1.01 -0.58 -0.93 120.40 127.09 1a9v s VAL 108 Ca -0.01 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.07 1a9v s VAL 108 Cb -0.17 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1a9v s VAL 108 CO -0.07 0.31 -0.11 -1.59 0.00 0.00 0.00 175.10 173.63 1a9v s LYS 109 N -0.73 0.81 -0.24 2.72 0.00 -0.50 -1.06 119.74 120.74 1a9v s LYS 109 Ca 0.07 -1.06 -0.09 0.00 0.00 0.00 0.00 55.97 54.89 1a9v s LYS 109 Cb -0.08 -0.60 -0.04 0.00 0.00 0.00 0.00 37.83 37.11 1a9v s LYS 109 CO 0.00 0.11 0.12 0.08 0.00 0.00 0.00 175.35 175.66 1a9v s VAL 110 N -2.00 4.92 -0.21 1.79 1.01 -0.20 -0.74 120.40 124.98 1a9v s VAL 110 Ca 0.02 0.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.94 1a9v s VAL 110 Cb -0.06 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1a9v s VAL 110 CO 0.01 0.35 0.11 -0.32 0.00 0.00 0.00 175.10 175.25 1a9v s MET 111 N 1.20 4.04 0.00 2.72 0.00 -0.70 -0.55 119.30 126.00 1a9v s MET 111 Ca 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 55.69 55.45 1a9v s MET 111 Cb -0.14 -3.37 0.00 0.00 0.00 0.00 0.00 34.83 31.32 1a9v s MET 111 CO 0.05 0.19 0.00 0.41 0.00 0.00 0.00 175.02 175.67 1a9v n GLY 112 N 3.83 0.81 1.16 2.11 0.00 -1.20 0.43 105.19 112.32 1a9v n GLY 112 Ca -0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 3.41 0.00 1.61 5.75 -0.91 -4.34 116.55 122.08 1a9v n ASP 113 Ca 0.00 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 1a9v n ASP 113 Cb 0.00 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.75 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 1.41 0.00 0.00 -1.12 5.68 -1.26 -4.89 116.55 116.36 1a9v n ASP 114 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.50 1a9v n ASP 114 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 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 0.00 -0.80 3.31 6.12 0.00 -1.26 -5.15 105.19 107.40 1a9v n GLY 115 Ca 0.00 0.36 -0.17 0.00 0.00 0.00 0.00 46.02 46.21 1a9v n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a9v s VAL 116 N 0.00 0.00 0.22 1.61 0.11 -1.26 -4.43 120.40 116.64 1a9v s VAL 116 Ca 0.00 -1.93 0.00 0.00 -2.93 0.00 0.00 61.98 57.12 1a9v s VAL 116 Cb 0.00 -2.52 0.00 0.00 -1.53 0.00 0.00 36.38 32.33 1a9v s VAL 116 CO 0.00 0.00 0.00 -0.11 -3.33 0.00 0.00 175.10 171.66 1a9v n LEU 117 N -0.55 -0.88 -3.62 2.54 -0.00 0.28 -3.24 117.00 111.53 1a9v n LEU 117 Ca 0.05 0.39 -0.04 0.00 -0.00 0.00 0.00 56.01 56.41 1a9v n LEU 117 Cb 0.63 0.98 -0.06 0.00 -0.00 0.00 0.00 43.42 44.96 1a9v n LEU 117 CO 0.32 -0.47 0.49 0.00 -0.00 0.00 0.00 177.39 177.72 1a9v s ALA 118 N -1.88 -2.13 0.01 1.96 0.00 -0.88 -4.66 121.76 114.18 1a9v s ALA 118 Ca 0.00 2.30 0.02 0.00 0.00 0.00 0.00 51.96 54.28 1a9v s ALA 118 Cb 0.00 -1.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 1a9v s ALA 118 CO 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 175.76 175.19 1a9v s ALA 120 N -0.42 -0.44 -0.02 0.00 0.00 -0.23 -2.44 121.76 118.22 1a9v s ALA 120 Ca 0.00 0.56 0.04 0.00 0.00 0.00 0.00 51.96 52.57 1a9v s ALA 120 Cb -0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1a9v s ALA 120 CO -0.00 -0.10 -0.12 -1.50 0.00 0.00 0.00 175.76 174.04 1a9v s ILE 121 N 0.30 3.28 0.26 0.00 -1.16 0.07 -1.53 121.20 122.42 1a9v s ILE 121 Ca -0.02 -0.80 0.03 0.00 -0.51 0.00 0.00 60.65 59.36 1a9v s ILE 121 Cb -0.03 -2.36 -0.05 0.00 0.61 0.00 0.00 42.46 40.63 1a9v s ILE 121 CO -0.01 0.48 0.03 0.00 -2.81 0.00 0.00 174.94 172.63 1a9v s ALA 122 N -0.86 1.94 0.00 1.50 0.00 0.10 -1.25 121.76 123.20 1a9v s ALA 122 Ca 0.14 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.23 1a9v s ALA 122 Cb -0.11 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1a9v s ALA 122 CO 0.04 -0.31 0.00 0.25 0.00 0.00 0.00 175.76 175.74 1a9v n THR 123 N -0.50 0.00 0.00 0.00 -2.24 -1.26 -1.19 114.28 109.09 1a9v n THR 123 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1a9v n THR 123 Cb 0.65 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 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 0.00 0.00 -1.42 4.78 8.25 -1.26 -4.79 115.22 120.78 1a9v n HIS 124 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1a9v n HIS 124 Cb 0.00 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 30.98 1a9v n HIS 124 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a9v n ALA 125 N 0.00 0.72 -2.57 -1.41 0.00 -1.00 -4.63 120.51 111.62 1a9v n ALA 125 Ca 0.00 -1.14 -0.33 0.00 0.00 0.00 0.00 53.44 51.96 1a9v n ALA 125 Cb 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1a9v n ALA 125 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1a9v n LYS 126 N 6.37 3.81 0.00 0.00 2.85 -1.25 -4.76 118.16 125.18 1a9v n LYS 126 Ca 0.46 -4.49 0.00 0.00 -1.05 0.00 0.00 58.31 53.24 1a9v n LYS 126 Cb 0.32 -2.31 0.00 0.00 -0.65 0.00 0.00 35.03 32.39 1a9v n LYS 126 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 1a9v n ILE 127 N -0.30 0.00 -3.59 0.58 3.06 -1.26 -4.73 119.36 113.12 1a9v n ILE 127 Ca 0.41 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.55 1a9v n ILE 127 Cb 0.38 0.00 -0.06 0.00 0.54 0.00 0.00 39.64 40.50 1a9v n ILE 127 CO 0.00 0.00 0.00 -0.60 -2.50 0.00 0.00 176.55 173.45 1a9v s ARG 128 N 0.00 0.62 0.00 9.51 6.06 -1.25 -4.59 118.95 129.31 1a9v s ARG 128 Ca 0.00 0.30 0.00 0.00 -2.50 0.00 0.00 55.73 53.53 1a9v s ARG 128 Cb 0.00 0.30 0.00 0.00 0.06 0.00 0.00 34.95 35.31 1a9v s ARG 128 CO 0.00 -0.16 0.00 -0.25 -2.50 0.00 0.00 175.30 172.39