#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0v s PRO 5 N 0.00 2.85 -0.11 1.97 0.04 -1.26 -4.85 135.00 133.64 2b0v s PRO 5 Ca 0.00 1.66 -0.24 0.00 0.04 0.00 0.00 61.00 62.46 2b0v s PRO 5 Cb 0.00 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 2b0v s PRO 5 CO 0.00 -1.27 0.73 -0.80 0.04 0.00 0.00 177.00 175.70 2b0v s ASN 6 N -1.96 6.94 -0.14 6.66 0.01 0.38 -4.86 114.94 121.97 2b0v s ASN 6 Ca 0.73 1.14 -0.21 0.00 -0.71 0.00 0.00 52.86 53.82 2b0v s ASN 6 Cb -0.26 -2.42 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 2b0v s ASN 6 CO 0.36 -0.21 0.60 -0.69 -1.51 0.00 0.00 177.10 175.65 2b0v s VAL 7 N 1.29 5.08 0.30 1.60 1.01 -1.26 -0.84 120.40 127.57 2b0v s VAL 7 Ca 0.37 1.17 0.04 0.00 0.00 0.00 0.00 61.98 63.56 2b0v s VAL 7 Cb -0.17 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 2b0v s VAL 7 CO 0.16 0.21 0.04 0.42 0.00 0.00 0.00 175.10 175.93 2b0v s THR 8 N 1.27 1.12 0.08 3.92 -4.23 0.03 -0.90 115.64 116.93 2b0v s THR 8 Ca 0.30 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 58.81 2b0v s THR 8 Cb -0.16 -2.67 -0.03 0.00 1.34 0.00 0.00 72.50 70.98 2b0v s THR 8 CO 0.12 -0.08 -0.08 0.68 -0.54 0.00 0.00 174.62 174.72 2b0v s VAL 9 N -3.35 0.68 -0.02 2.29 -7.23 0.03 -0.82 120.40 111.98 2b0v s VAL 9 Ca 0.35 -1.55 -0.19 0.00 -1.81 0.00 0.00 61.98 58.77 2b0v s VAL 9 Cb 0.08 -1.21 0.04 0.00 0.56 0.00 0.00 36.38 35.84 2b0v s VAL 9 CO 0.14 -0.63 0.41 0.00 -0.31 0.00 0.00 175.10 174.71 2b0v s ALA 10 N -2.54 -1.05 -0.11 1.32 0.00 -0.72 -1.58 121.76 117.07 2b0v s ALA 10 Ca 0.02 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.58 2b0v s ALA 10 Cb -0.02 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2b0v s ALA 10 CO -0.02 -0.31 -0.22 0.00 0.00 0.00 0.00 175.76 175.21 2b0v s ALA 11 N -1.41 2.25 -0.42 0.00 0.00 -0.75 -1.20 121.76 120.23 2b0v s ALA 11 Ca -0.12 -0.99 -0.17 0.00 0.00 0.00 0.00 51.96 50.67 2b0v s ALA 11 Cb -0.03 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2b0v s ALA 11 CO 0.05 0.20 0.44 0.08 0.00 0.00 0.00 175.76 176.53 2b0v s VAL 12 N 0.47 5.09 -0.29 0.00 1.01 0.56 -4.25 120.40 122.99 2b0v s VAL 12 Ca -0.15 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.48 2b0v s VAL 12 Cb -0.17 -4.05 0.07 0.00 0.00 0.00 0.00 36.38 32.23 2b0v s VAL 12 CO 0.06 -0.44 -0.05 -0.63 0.00 0.00 0.00 175.10 174.04 2b0v s ILE 13 N 2.13 2.34 -0.11 2.22 1.01 -1.26 -3.12 121.20 124.41 2b0v s ILE 13 Ca 0.12 -1.78 0.03 0.00 0.00 0.00 0.00 60.65 59.02 2b0v s ILE 13 Cb -0.17 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.84 2b0v s ILE 13 CO 0.13 -0.19 -0.22 -0.70 0.00 0.00 0.00 174.94 173.97 2b0v s GLU 14 N 1.08 3.10 -0.09 2.79 -6.30 -1.26 -1.16 118.70 116.86 2b0v s GLU 14 Ca -0.04 -0.84 -0.03 0.00 -2.50 0.00 0.00 54.97 51.56 2b0v s GLU 14 Cb -0.20 -2.38 0.05 0.00 0.00 0.00 0.00 34.13 31.60 2b0v s GLU 14 CO -0.05 0.15 0.11 -1.14 0.02 0.00 0.00 175.26 174.35 2b0v s GLN 15 N 0.43 0.00 -1.42 4.30 0.74 -0.03 -4.88 119.66 118.79 2b0v s GLN 15 Ca -0.16 0.35 -0.03 0.00 0.05 0.00 0.00 55.36 55.58 2b0v s GLN 15 Cb -0.17 -0.70 0.02 0.00 1.10 0.00 0.00 33.01 33.26 2b0v s GLN 15 CO 0.07 -0.40 0.53 -0.25 -0.55 0.00 0.00 175.29 174.68 2b0v n ASP 16 N 5.31 -0.97 -0.43 6.67 8.00 -1.26 -1.92 116.55 131.94 2b0v n ASP 16 Ca -0.04 -0.96 -0.06 0.00 0.71 0.00 0.00 54.79 54.44 2b0v n ASP 16 Cb 0.50 -3.24 -0.02 0.00 -0.02 0.00 0.00 41.12 38.33 2b0v n ASP 16 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2b0v n ASP 17 N -2.96 -4.48 -4.44 -2.24 8.00 -1.26 -5.01 116.55 104.16 2b0v n ASP 17 Ca -0.25 0.14 -0.28 0.00 0.71 0.00 0.00 54.79 55.10 2b0v n ASP 17 Cb 0.66 -2.48 -0.12 0.00 -0.02 0.00 0.00 41.12 39.16 2b0v n ASP 17 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2b0v s LYS 18 N -2.02 1.59 -0.06 -1.24 1.02 -0.81 -4.12 119.74 114.10 2b0v s LYS 18 Ca 0.00 -1.36 0.05 0.00 0.02 0.00 0.00 55.97 54.68 2b0v s LYS 18 Cb 0.00 -1.96 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 2b0v s LYS 18 CO 0.00 0.44 -0.22 0.71 -0.92 0.00 0.00 175.35 175.36 2b0v s TYR 19 N -1.34 2.53 -0.36 3.18 2.02 0.16 -0.85 117.35 122.69 2b0v s TYR 19 Ca 0.18 -0.60 -0.29 0.00 -0.37 0.00 0.00 57.07 55.99 2b0v s TYR 19 Cb -0.09 -1.63 0.02 0.00 -0.40 0.00 0.00 41.96 39.85 2b0v s TYR 19 CO 0.09 -0.14 1.14 -1.17 -1.57 0.00 0.00 175.55 173.90 2b0v s LEU 20 N -0.22 3.83 0.30 -1.29 2.96 -0.31 -0.77 118.68 123.18 2b0v s LEU 20 Ca -0.01 0.90 0.05 0.00 -0.22 0.00 0.00 54.13 54.85 2b0v s LEU 20 Cb -0.13 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.95 2b0v s LEU 20 CO 0.03 -1.03 0.01 -0.76 -1.32 0.00 0.00 176.35 173.28 2b0v s LEU 21 N 4.04 2.31 0.02 -0.68 1.43 -0.40 -4.45 118.68 120.96 2b0v s LEU 21 Ca 0.48 -1.29 0.08 0.00 -1.03 0.00 0.00 54.13 52.37 2b0v s LEU 21 Cb -0.11 -0.47 -0.03 0.00 0.03 0.00 0.00 46.19 45.61 2b0v s LEU 21 CO 0.22 -0.50 -0.23 0.68 0.23 0.00 0.00 176.35 176.75 2b0v s VAL 22 N -3.20 2.40 -0.19 -1.59 -7.23 0.19 -1.33 120.40 109.44 2b0v s VAL 22 Ca 0.33 -1.21 -0.14 0.00 -1.81 0.00 0.00 61.98 59.14 2b0v s VAL 22 Cb 0.07 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 2b0v s VAL 22 CO 0.13 0.42 0.33 -1.61 -0.31 0.00 0.00 175.10 174.07 2b0v s GLU 23 N -1.12 4.19 0.04 4.82 2.02 -0.05 -1.33 118.70 127.28 2b0v s GLU 23 Ca 0.12 0.10 -0.02 0.00 0.02 0.00 0.00 54.97 55.19 2b0v s GLU 23 Cb -0.10 -3.50 -0.03 0.00 0.10 0.00 0.00 34.13 30.60 2b0v s GLU 23 CO 0.02 0.07 0.01 -1.83 0.02 0.00 0.00 175.26 173.55 2b0v s GLU 24 N 0.99 0.54 -0.44 1.61 -1.05 0.55 -0.05 118.70 120.86 2b0v s GLU 24 Ca 0.17 -0.96 0.02 0.00 -0.15 0.00 0.00 54.97 54.05 2b0v s GLU 24 Cb -0.14 0.20 0.12 0.00 -0.44 0.00 0.00 34.13 33.86 2b0v s GLU 24 CO 0.06 -0.11 0.18 0.42 0.95 0.00 0.00 175.26 176.76 2b0v s ILE 25 N -3.02 2.74 0.28 1.83 1.01 0.63 -0.05 121.20 124.62 2b0v s ILE 25 Ca -0.01 -2.62 0.09 0.00 0.00 0.00 0.00 60.65 58.11 2b0v s ILE 25 Cb 0.01 -2.92 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 2b0v s ILE 25 CO -0.07 -0.70 1.65 -0.65 0.00 0.00 0.00 174.94 175.17 2b0v h PRO 26 N 7.34 0.08 -3.06 2.79 0.11 -1.85 -3.45 132.00 133.97 2b0v h PRO 26 Ca -0.07 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.96 2b0v h PRO 26 Cb 0.98 0.01 -0.13 0.00 0.11 0.00 0.00 31.00 31.97 2b0v h PRO 26 CO 0.62 0.61 0.12 -0.98 -0.21 0.00 0.00 178.00 178.16 2b0v s ARG 27 N -3.80 1.20 6.95 1.05 1.70 -1.26 -5.11 118.95 119.68 2b0v s ARG 27 Ca -0.03 -0.49 0.00 0.00 -0.47 0.00 0.00 55.73 54.74 2b0v s ARG 27 Cb 0.13 0.54 0.00 0.00 -0.57 0.00 0.00 34.95 35.05 2b0v s ARG 27 CO 0.77 -0.50 0.00 0.41 -1.08 0.00 0.00 175.30 174.90 2b0v n GLY 28 N -0.23 3.59 0.00 3.88 0.00 -1.26 -3.92 105.19 107.24 2b0v n GLY 28 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2b0v n GLY 28 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2b0v n THR 29 N 0.00 0.00 -2.31 2.61 5.66 -1.26 -5.04 114.28 113.94 2b0v n THR 29 Ca 0.00 -0.24 -0.42 0.00 -3.05 0.00 0.00 64.05 60.34 2b0v n THR 29 Cb 0.00 0.79 -0.03 0.00 -1.55 0.00 0.00 70.33 69.54 2b0v n THR 29 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b0v s ALA 30 N -0.92 3.49 0.06 1.79 0.00 -1.25 -4.97 121.76 119.96 2b0v s ALA 30 Ca 0.00 0.93 -0.30 0.00 0.00 0.00 0.00 51.96 52.59 2b0v s ALA 30 Cb 0.00 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2b0v s ALA 30 CO 0.00 -0.58 1.03 0.42 0.00 0.00 0.00 175.76 176.63 2b0v s ILE 31 N 1.34 4.52 0.11 0.00 1.01 -1.26 -4.37 121.20 122.54 2b0v s ILE 31 Ca 0.61 1.91 0.08 0.00 0.00 0.00 0.00 60.65 63.25 2b0v s ILE 31 Cb -0.32 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 37.90 2b0v s ILE 31 CO 0.29 0.20 -0.21 -0.54 0.00 0.00 0.00 174.94 174.68 2b0v s LYS 32 N 0.63 1.14 -0.10 2.79 -0.14 0.93 -4.93 119.74 120.06 2b0v s LYS 32 Ca 0.52 -1.19 -0.08 0.00 -1.36 0.00 0.00 55.97 53.86 2b0v s LYS 32 Cb -0.24 -1.39 -0.04 0.00 -1.68 0.00 0.00 37.83 34.48 2b0v s LYS 32 CO 0.29 0.32 0.17 -1.17 -0.76 0.00 0.00 175.35 174.21 2b0v s LEU 33 N -1.99 4.40 0.14 3.17 2.96 -1.26 -0.33 118.68 125.77 2b0v s LEU 33 Ca 0.07 0.52 -0.21 0.00 -0.22 0.00 0.00 54.13 54.30 2b0v s LEU 33 Cb -0.10 -2.15 0.06 0.00 0.50 0.00 0.00 46.19 44.50 2b0v s LEU 33 CO 0.04 0.39 0.53 0.21 -1.32 0.00 0.00 176.35 176.21 2b0v s ASN 34 N -1.07 -0.46 0.81 3.68 2.47 -0.44 -0.59 114.94 119.34 2b0v s ASN 34 Ca 0.17 -0.09 -0.12 0.00 0.42 0.00 0.00 52.86 53.24 2b0v s ASN 34 Cb -0.13 0.55 0.08 0.00 -1.45 0.00 0.00 41.25 40.31 2b0v s ASN 34 CO 0.06 -0.92 1.15 -1.10 -3.72 0.00 0.00 177.10 172.56 2b0v s GLN 35 N -3.69 1.79 0.06 0.43 1.11 -1.26 -0.64 119.66 117.46 2b0v s GLN 35 Ca 0.01 1.49 -0.33 0.00 0.01 0.00 0.00 55.36 56.55 2b0v s GLN 35 Cb -0.00 -1.82 -0.12 0.00 -1.01 0.00 0.00 33.01 30.06 2b0v s GLN 35 CO -0.12 -2.05 1.78 -2.30 0.01 0.00 0.00 175.29 172.61 2b0v n PRO 36 N -3.49 2.40 -3.53 2.91 -0.02 -1.26 -4.69 135.00 127.32 2b0v n PRO 36 Ca 0.11 0.87 -0.09 0.00 -2.02 0.00 0.00 63.50 62.38 2b0v n PRO 36 Cb 0.52 -2.72 -0.02 0.00 -0.02 0.00 0.00 33.50 31.26 2b0v n PRO 36 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b0v s ALA 37 N 2.69 -1.70 0.00 3.55 0.00 -1.26 -1.81 121.76 123.23 2b0v s ALA 37 Ca 0.85 0.66 0.00 0.00 0.00 0.00 0.00 51.96 53.47 2b0v s ALA 37 Cb -0.61 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2b0v s ALA 37 CO 0.42 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.82 2b0v n GLY 38 N -0.33 -1.52 3.77 0.00 0.00 -0.61 -4.98 105.19 101.51 2b0v n GLY 38 Ca -0.11 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.48 2b0v n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b0v s HIS 39 N -2.35 3.91 0.30 1.61 3.76 -1.26 -0.79 115.29 120.47 2b0v s HIS 39 Ca 0.00 1.78 -0.30 0.00 -0.15 0.00 0.00 55.06 56.39 2b0v s HIS 39 Cb 0.00 -2.88 -0.12 0.00 1.11 0.00 0.00 32.58 30.69 2b0v s HIS 39 CO 0.00 0.45 1.47 -0.11 -0.85 0.00 0.00 174.74 175.70 2b0v n LEU 40 N 1.39 3.88 -4.69 0.89 7.94 -0.07 -4.89 117.00 121.45 2b0v n LEU 40 Ca -0.03 1.17 -0.26 0.00 -1.11 0.00 0.00 56.01 55.78 2b0v n LEU 40 Cb 0.48 -1.53 -0.07 0.00 0.53 0.00 0.00 43.42 42.83 2b0v n LEU 40 CO 0.48 -0.16 -0.30 -1.61 -1.11 0.00 0.00 177.39 174.68 2b0v s GLU 41 N -0.92 2.51 0.76 1.96 2.02 -1.26 -4.93 118.70 118.83 2b0v s GLU 41 Ca 0.62 -1.07 -0.15 0.00 0.02 0.00 0.00 54.97 54.39 2b0v s GLU 41 Cb -0.55 -2.41 0.05 0.00 0.10 0.00 0.00 34.13 31.32 2b0v s GLU 41 CO 0.53 0.45 1.23 -2.30 0.02 0.00 0.00 175.26 175.19 2b0v n PRO 42 N -0.23 0.49 -0.90 0.39 -0.02 -1.26 -3.65 135.00 129.82 2b0v n PRO 42 Ca -0.09 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2b0v n PRO 42 Cb 0.55 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2b0v n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b0v n GLY 43 N 0.69 0.49 3.06 -1.23 0.00 -1.26 -5.03 105.19 101.91 2b0v n GLY 43 Ca 0.14 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.53 2b0v n GLY 43 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b0v s GLU 44 N -1.05 0.51 0.74 1.61 -1.05 -1.24 -5.15 118.70 113.08 2b0v s GLU 44 Ca 0.00 -0.86 -0.12 0.00 -0.15 0.00 0.00 54.97 53.84 2b0v s GLU 44 Cb 0.00 0.19 0.04 0.00 -0.44 0.00 0.00 34.13 33.91 2b0v s GLU 44 CO 0.00 -0.10 1.10 -1.54 0.95 0.00 0.00 175.26 175.67 2b0v s SER 45 N -2.18 5.07 0.13 0.83 1.04 -1.26 -4.89 113.70 112.44 2b0v s SER 45 Ca -0.04 1.16 -0.14 0.00 0.48 0.00 0.00 55.95 57.40 2b0v s SER 45 Cb -0.01 -1.91 -0.02 0.00 0.10 0.00 0.00 66.02 64.18 2b0v s SER 45 CO -0.05 -1.59 1.57 0.40 0.98 0.00 0.00 173.24 174.55 2b0v h ILE 46 N -0.83 1.26 -0.61 -1.02 2.04 -1.99 -0.68 117.51 115.68 2b0v h ILE 46 Ca -0.46 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.36 2b0v h ILE 46 Cb 1.26 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2b0v h ILE 46 CO 0.63 0.35 0.37 0.40 0.00 0.00 0.00 178.15 179.89 2b0v h ILE 47 N 0.54 1.18 -0.13 -0.67 2.04 -1.99 -1.60 117.51 116.88 2b0v h ILE 47 Ca 0.11 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 2b0v h ILE 47 Cb 0.50 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2b0v h ILE 47 CO 0.02 0.19 -0.27 1.56 0.00 0.00 0.00 178.15 179.65 2b0v h GLN 48 N 0.83 0.25 -0.83 2.37 1.08 -1.91 -2.01 115.11 114.89 2b0v h GLN 48 Ca 0.22 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2b0v h GLN 48 Cb -0.02 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.35 2b0v h GLN 48 CO -0.04 0.51 0.52 0.00 -0.95 0.00 0.00 178.83 178.87 2b0v h ALA 49 N 1.50 1.06 -0.25 3.87 0.00 -0.57 0.55 119.26 125.42 2b0v h ALA 49 Ca 0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b0v h ALA 49 Cb 0.60 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2b0v h ALA 49 CO 0.04 0.50 0.14 0.00 0.00 0.00 0.00 179.25 179.93 2b0v h SER 51 N 0.30 0.93 -0.36 0.00 0.02 -0.90 -1.99 113.55 111.55 2b0v h SER 51 Ca 0.09 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 2b0v h SER 51 Cb 0.05 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 2b0v h SER 51 CO -0.02 0.92 0.20 -0.09 -1.14 0.00 0.00 176.83 176.71 2b0v h ARG 52 N 0.93 0.51 -0.70 3.45 2.43 -0.62 -1.84 114.38 118.54 2b0v h ARG 52 Ca 0.19 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2b0v h ARG 52 Cb 0.38 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2b0v h ARG 52 CO 0.01 0.42 0.28 0.93 -1.51 0.00 0.00 179.97 180.09 2b0v h GLU 53 N 0.46 1.05 -0.35 0.20 4.39 -0.75 0.89 114.58 120.47 2b0v h GLU 53 Ca 0.13 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.67 2b0v h GLU 53 Cb 0.06 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.51 2b0v h GLU 53 CO -0.02 0.87 0.16 0.28 -1.16 0.00 0.00 179.01 179.13 2b0v h VAL 54 N 1.00 0.95 -0.24 3.13 2.07 -1.16 -0.95 116.25 121.05 2b0v h VAL 54 Ca 0.23 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 2b0v h VAL 54 Cb 0.21 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2b0v h VAL 54 CO -0.02 0.06 0.08 0.25 0.02 0.00 0.00 177.57 177.96 2b0v h LEU 55 N 0.33 0.35 -1.21 2.57 5.85 -0.96 -0.86 115.31 121.39 2b0v h LEU 55 Ca 0.15 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 2b0v h LEU 55 Cb 0.09 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2b0v h LEU 55 CO -0.12 0.45 -0.40 -0.33 -0.34 0.00 0.00 178.44 177.69 2b0v h GLU 56 N 0.23 0.00 0.00 1.25 5.08 -0.65 -0.26 114.58 120.22 2b0v h GLU 56 Ca 0.08 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 2b0v h GLU 56 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 2b0v h GLU 56 CO -0.00 0.40 -1.85 0.39 -1.00 0.00 0.00 179.01 176.95 2b0v n GLU 57 N -4.05 0.65 0.00 2.33 1.02 -0.38 -0.73 120.64 119.49 2b0v n GLU 57 Ca -0.02 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 2b0v n GLU 57 Cb 0.43 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 2b0v n GLU 57 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2b0v n THR 58 N -2.52 0.00 -0.96 2.62 -2.24 -0.33 -4.73 114.28 106.12 2b0v n THR 58 Ca -0.10 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2b0v n THR 58 Cb 0.73 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 2b0v n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b0v n GLY 59 N 1.28 0.42 3.83 3.38 0.00 -0.11 -4.93 105.19 109.06 2b0v n GLY 59 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2b0v n GLY 59 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b0v s HIS 60 N -2.02 3.47 0.25 1.61 3.76 -1.26 -2.75 115.29 118.36 2b0v s HIS 60 Ca 0.00 0.42 -0.25 0.00 -0.15 0.00 0.00 55.06 55.09 2b0v s HIS 60 Cb 0.00 -1.89 -0.09 0.00 1.11 0.00 0.00 32.58 31.71 2b0v s HIS 60 CO 0.00 0.66 0.85 0.45 -0.85 0.00 0.00 174.74 175.85 2b0v s SER 61 N -1.08 7.30 -0.01 1.40 0.15 -0.66 -2.93 113.70 117.88 2b0v s SER 61 Ca 0.16 1.69 0.05 0.00 0.70 0.00 0.00 55.95 58.55 2b0v s SER 61 Cb -0.12 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.64 2b0v s SER 61 CO 0.05 0.04 -0.14 0.12 1.20 0.00 0.00 173.24 174.51 2b0v s PHE 62 N -1.45 2.68 -0.39 3.44 5.36 -1.26 -1.23 117.98 125.13 2b0v s PHE 62 Ca 0.44 -0.17 -0.00 0.00 -0.96 0.00 0.00 56.93 56.24 2b0v s PHE 62 Cb -0.20 -1.57 0.11 0.00 -0.34 0.00 0.00 43.02 41.02 2b0v s PHE 62 CO 0.24 0.23 0.15 -1.17 -1.46 0.00 0.00 175.22 173.21 2b0v s LEU 63 N -1.06 5.06 0.43 6.12 2.96 0.72 -4.92 118.68 128.00 2b0v s LEU 63 Ca 0.13 -2.10 -0.25 0.00 -0.22 0.00 0.00 54.13 51.69 2b0v s LEU 63 Cb -0.11 -1.75 -0.08 0.00 0.50 0.00 0.00 46.19 44.75 2b0v s LEU 63 CO 0.03 -0.48 1.27 -2.84 -1.32 0.00 0.00 176.35 173.02 2b0v s PRO 64 N 1.02 3.85 -0.01 0.98 0.02 -1.26 -1.72 135.00 137.87 2b0v s PRO 64 Ca 0.10 2.07 -0.00 0.00 0.02 0.00 0.00 61.00 63.18 2b0v s PRO 64 Cb -0.21 -2.64 -0.01 0.00 0.02 0.00 0.00 34.50 31.66 2b0v s PRO 64 CO -0.06 -0.56 -0.01 0.39 -0.33 0.00 0.00 177.00 176.43 2b0v n GLU 65 N -0.10 0.03 -3.96 5.54 1.02 0.21 -4.91 120.64 118.47 2b0v n GLU 65 Ca 0.05 0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.12 2b0v n GLU 65 Cb 0.45 -0.75 -0.09 0.00 -0.02 0.00 0.00 31.44 31.03 2b0v n GLU 65 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2b0v s VAL 66 N -2.02 0.17 0.06 2.62 -7.23 -0.91 -4.47 120.40 108.62 2b0v s VAL 66 Ca -0.02 -1.39 -0.23 0.00 -1.81 0.00 0.00 61.98 58.53 2b0v s VAL 66 Cb 0.01 -1.31 -0.06 0.00 0.56 0.00 0.00 36.38 35.57 2b0v s VAL 66 CO 0.02 -0.77 0.68 -0.22 -0.31 0.00 0.00 175.10 174.50 2b0v s LEU 67 N -2.72 4.49 -0.06 1.32 2.96 0.51 -0.82 118.68 124.35 2b0v s LEU 67 Ca 0.04 1.37 0.12 0.00 -0.22 0.00 0.00 54.13 55.44 2b0v s LEU 67 Cb 0.05 -3.09 -0.18 0.00 0.50 0.00 0.00 46.19 43.46 2b0v s LEU 67 CO -0.09 0.13 0.18 0.35 -1.32 0.00 0.00 176.35 175.60 2b0v n THR 68 N 2.31 0.38 0.00 3.68 -2.24 0.25 0.42 114.28 119.08 2b0v n THR 68 Ca -0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2b0v n THR 68 Cb 0.50 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2b0v n THR 68 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b0v n GLY 69 N 1.96 1.17 3.06 3.38 0.00 -1.18 -4.70 105.19 108.87 2b0v n GLY 69 Ca -0.10 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 2b0v n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b0v s ILE 70 N -2.00 1.63 -0.15 -0.61 1.01 -1.26 -1.00 121.20 118.81 2b0v s ILE 70 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 60.65 59.95 2b0v s ILE 70 Cb 0.00 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 2b0v s ILE 70 CO 0.00 0.47 -0.13 -0.31 0.00 0.00 0.00 174.94 174.97 2b0v s TYR 71 N 1.20 2.81 -0.29 3.97 2.02 -0.27 -4.92 117.35 121.88 2b0v s TYR 71 Ca -0.01 -0.88 0.00 0.00 -0.37 0.00 0.00 57.07 55.81 2b0v s TYR 71 Cb -0.14 -1.90 0.06 0.00 -0.40 0.00 0.00 41.96 39.58 2b0v s TYR 71 CO -0.06 -0.38 -0.03 -1.58 -1.57 0.00 0.00 175.55 171.92 2b0v s HIS 72 N 0.72 3.29 0.18 2.71 5.65 -1.26 -0.50 115.29 126.08 2b0v s HIS 72 Ca -0.06 -2.08 -0.10 0.00 0.25 0.00 0.00 55.06 53.07 2b0v s HIS 72 Cb -0.15 -2.10 -0.00 0.00 -1.18 0.00 0.00 32.58 29.15 2b0v s HIS 72 CO 0.02 -0.84 0.34 1.67 -0.65 0.00 0.00 174.74 175.27 2b0v s TRP 73 N 1.19 0.36 -0.14 3.88 -2.14 -0.68 -4.98 118.94 116.42 2b0v s TRP 73 Ca -0.06 -0.72 0.01 0.00 2.66 0.00 0.00 56.10 57.99 2b0v s TRP 73 Cb -0.20 0.02 -0.01 0.00 -3.10 0.00 0.00 33.47 30.18 2b0v s TRP 73 CO -0.03 -0.78 -0.16 0.99 -2.66 0.00 0.00 176.95 174.31 2b0v s THR 74 N -3.97 2.72 -0.44 0.66 2.01 -1.26 -0.22 115.64 115.13 2b0v s THR 74 Ca 0.18 -0.77 -0.29 0.00 0.31 0.00 0.00 61.69 61.13 2b0v s THR 74 Cb 0.02 -2.13 0.03 0.00 0.01 0.00 0.00 72.50 70.43 2b0v s THR 74 CO 0.02 0.52 1.11 0.00 -0.69 0.00 0.00 174.62 175.58 2b0v h ALA 76 N 8.97 1.53 -0.15 0.00 0.00 -1.94 0.20 119.26 127.86 2b0v h ALA 76 Ca -0.23 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 2b0v h ALA 76 Cb 1.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2b0v h ALA 76 CO 1.10 0.36 -0.28 0.66 0.00 0.00 0.00 179.25 181.08 2b0v h SER 77 N 0.49 0.29 -0.05 0.00 4.64 -1.98 -3.21 113.55 113.75 2b0v h SER 77 Ca 0.12 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2b0v h SER 77 Cb 0.17 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2b0v h SER 77 CO -0.01 0.58 0.00 -0.46 -0.87 0.00 0.00 176.83 176.07 2b0v n ASN 78 N -4.12 1.79 0.00 4.97 0.23 -1.13 -5.00 115.26 112.00 2b0v n ASN 78 Ca -0.01 -1.62 0.00 0.00 -0.53 0.00 0.00 54.58 52.42 2b0v n ASN 78 Cb 0.40 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 38.06 2b0v n ASN 78 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2b0v n GLY 79 N -0.09 0.19 3.75 4.83 0.00 0.69 -4.95 105.19 109.60 2b0v n GLY 79 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 2b0v n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b0v s THR 80 N -1.48 5.27 -0.04 2.61 2.01 -1.17 -4.84 115.64 118.01 2b0v s THR 80 Ca 0.00 0.62 -0.16 0.00 0.31 0.00 0.00 61.69 62.46 2b0v s THR 80 Cb 0.00 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 2b0v s THR 80 CO 0.00 0.41 0.43 -0.89 -0.69 0.00 0.00 174.62 173.88 2b0v s THR 81 N 0.25 5.07 0.09 -0.82 2.01 -1.26 -1.13 115.64 119.85 2b0v s THR 81 Ca 0.18 0.88 0.08 0.00 0.31 0.00 0.00 61.69 63.14 2b0v s THR 81 Cb -0.14 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 2b0v s THR 81 CO 0.06 0.50 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.98 2b0v s TYR 82 N -0.52 1.68 -0.30 4.92 2.02 0.69 -0.47 117.35 125.36 2b0v s TYR 82 Ca 0.24 -0.42 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 2b0v s TYR 82 Cb -0.16 -0.93 0.09 0.00 -0.40 0.00 0.00 41.96 40.55 2b0v s TYR 82 CO 0.12 0.17 0.00 -0.51 -1.57 0.00 0.00 175.55 173.77 2b0v s LEU 83 N -1.84 3.88 -0.37 -1.29 1.43 -0.02 -1.69 118.68 118.79 2b0v s LEU 83 Ca 0.05 -1.79 -0.12 0.00 -1.03 0.00 0.00 54.13 51.24 2b0v s LEU 83 Cb -0.10 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.67 2b0v s LEU 83 CO 0.04 -0.32 0.23 -0.60 0.23 0.00 0.00 176.35 175.93 2b0v s ARG 84 N 1.09 3.06 -0.21 1.70 3.52 0.35 -0.79 118.95 127.67 2b0v s ARG 84 Ca 0.04 -0.93 -0.22 0.00 -0.13 0.00 0.00 55.73 54.49 2b0v s ARG 84 Cb -0.19 -3.79 -0.02 0.00 -1.56 0.00 0.00 34.95 29.39 2b0v s ARG 84 CO -0.09 -0.63 0.69 -0.06 -0.81 0.00 0.00 175.30 174.40 2b0v s PHE 85 N 1.63 3.35 -0.10 5.12 0.08 0.00 -1.11 117.98 126.95 2b0v s PHE 85 Ca 0.04 0.98 0.01 0.00 0.12 0.00 0.00 56.93 58.08 2b0v s PHE 85 Cb -0.18 -2.88 -0.02 0.00 -0.57 0.00 0.00 43.02 39.37 2b0v s PHE 85 CO 0.08 -0.25 -0.14 0.99 -0.10 0.00 0.00 175.22 175.80 2b0v s THR 86 N 2.23 3.00 0.15 0.64 2.01 -0.18 -1.76 115.64 121.73 2b0v s THR 86 Ca 0.30 -0.70 0.09 0.00 0.31 0.00 0.00 61.69 61.69 2b0v s THR 86 Cb -0.16 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 2b0v s THR 86 CO 0.10 0.55 -0.21 -0.36 -0.69 0.00 0.00 174.62 174.00 2b0v s PHE 87 N -0.01 1.98 0.11 4.92 0.08 -0.34 -0.58 117.98 124.13 2b0v s PHE 87 Ca -0.04 -0.42 0.06 0.00 0.12 0.00 0.00 56.93 56.66 2b0v s PHE 87 Cb -0.14 -1.02 -0.04 0.00 -0.57 0.00 0.00 43.02 41.25 2b0v s PHE 87 CO 0.04 0.33 -0.07 0.45 -0.10 0.00 0.00 175.22 175.88 2b0v s SER 88 N -2.38 4.60 0.01 1.36 0.15 -0.00 -0.32 113.70 117.12 2b0v s SER 88 Ca 0.14 -0.33 -0.06 0.00 0.70 0.00 0.00 55.95 56.40 2b0v s SER 88 Cb -0.08 -0.95 0.02 0.00 -1.71 0.00 0.00 66.02 63.30 2b0v s SER 88 CO 0.07 0.17 0.26 0.61 1.20 0.00 0.00 173.24 175.55 2b0v n GLY 89 N 0.60 0.75 3.94 9.45 0.00 -1.18 -0.61 105.19 118.13 2b0v n GLY 89 Ca -0.12 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.72 2b0v n GLY 89 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b0v s GLN 90 N -2.01 3.45 -0.09 1.61 -0.21 -0.70 -4.45 119.66 117.28 2b0v s GLN 90 Ca 0.06 -0.55 -0.13 0.00 0.02 0.00 0.00 55.36 54.77 2b0v s GLN 90 Cb -0.00 -2.95 -0.05 0.00 1.00 0.00 0.00 33.01 31.01 2b0v s GLN 90 CO 0.00 0.51 0.31 0.14 -2.12 0.00 0.00 175.29 174.13 2b0v s VAL 91 N -1.75 5.24 0.00 1.09 -7.23 -1.26 -0.20 120.40 116.29 2b0v s VAL 91 Ca 0.35 0.61 0.00 0.00 -1.81 0.00 0.00 61.98 61.13 2b0v s VAL 91 Cb -0.11 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.21 2b0v s VAL 91 CO 0.29 0.51 0.24 1.33 -0.31 0.00 0.00 175.10 177.16 2b0v n VAL 92 N 2.53 0.00 -3.50 1.32 0.24 -0.36 -4.95 118.33 113.60 2b0v n VAL 92 Ca -0.14 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.34 61.66 2b0v n VAL 92 Cb 0.53 1.16 -0.03 0.00 -1.47 0.00 0.00 33.84 34.02 2b0v n VAL 92 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2b0v s SER 93 N -0.27 -0.47 -0.08 -1.34 1.04 -1.25 -4.95 113.70 106.39 2b0v s SER 93 Ca 0.00 -0.04 -0.06 0.00 0.48 0.00 0.00 55.95 56.34 2b0v s SER 93 Cb 0.00 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.70 2b0v s SER 93 CO 0.00 -0.90 0.20 0.12 0.98 0.00 0.00 173.24 173.64 2b0v s PHE 94 N -3.52 -0.23 -0.13 5.02 5.36 -1.26 -1.65 117.98 121.57 2b0v s PHE 94 Ca 0.00 0.57 -0.02 0.00 -0.96 0.00 0.00 56.93 56.53 2b0v s PHE 94 Cb -0.00 0.04 0.04 0.00 -0.34 0.00 0.00 43.02 42.76 2b0v s PHE 94 CO -0.11 -0.14 0.02 0.34 -1.46 0.00 0.00 175.22 173.87 2b0v s ASP 95 N 0.56 2.18 0.37 6.13 2.15 -1.11 -5.02 116.67 121.91 2b0v s ASP 95 Ca -0.04 -0.41 0.26 0.00 0.43 0.00 0.00 52.55 52.79 2b0v s ASP 95 Cb -0.05 -0.51 1.31 0.00 -0.30 0.00 0.00 42.92 43.37 2b0v s ASP 95 CO -0.03 -0.24 1.79 1.55 -0.17 0.00 0.00 175.17 178.07 2b0v h PRO 96 N 8.29 0.00 0.00 4.34 0.13 -1.97 -2.29 132.00 140.51 2b0v h PRO 96 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2b0v h PRO 96 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2b0v h PRO 96 CO 0.30 0.00 -0.64 -0.25 -0.23 0.00 0.00 178.00 177.18 2b0v n ASP 97 N -2.42 0.60 -4.68 1.44 8.00 -1.26 -4.88 116.55 113.35 2b0v n ASP 97 Ca -0.01 -0.09 -0.45 0.00 0.71 0.00 0.00 54.79 54.96 2b0v n ASP 97 Cb 0.10 0.30 -0.04 0.00 -0.02 0.00 0.00 41.12 41.47 2b0v n ASP 97 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2b0v n ARG 98 N -1.83 2.30 -2.45 -1.24 1.74 -0.86 -4.92 116.66 109.40 2b0v n ARG 98 Ca 0.04 0.83 -0.41 0.00 -0.77 0.00 0.00 57.85 57.53 2b0v n ARG 98 Cb 0.40 -2.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.20 2b0v n ARG 98 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2b0v s LYS 99 N 0.71 4.51 0.17 5.56 -2.85 -1.26 -4.84 119.74 121.73 2b0v s LYS 99 Ca 0.76 1.77 -0.07 0.00 -1.00 0.00 0.00 55.97 57.42 2b0v s LYS 99 Cb -0.63 -3.30 -0.06 0.00 -2.06 0.00 0.00 37.83 31.78 2b0v s LYS 99 CO 0.39 -0.09 0.45 -0.51 0.10 0.00 0.00 175.35 175.69 2b0v s LEU 100 N 0.21 4.24 0.49 2.77 1.43 -1.26 -4.85 118.68 121.72 2b0v s LEU 100 Ca 0.54 0.75 -0.22 0.00 -1.03 0.00 0.00 54.13 54.17 2b0v s LEU 100 Cb -0.30 -3.41 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 2b0v s LEU 100 CO 0.33 0.02 0.89 0.47 0.23 0.00 0.00 176.35 178.29 2b0v n ASP 101 N 0.13 0.61 -4.75 2.29 8.00 0.09 -4.88 116.55 118.04 2b0v n ASP 101 Ca -0.02 0.92 -0.41 0.00 0.71 0.00 0.00 54.79 55.98 2b0v n ASP 101 Cb 0.52 -1.32 -0.02 0.00 -0.02 0.00 0.00 41.12 40.29 2b0v n ASP 101 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2b0v s THR 102 N -1.42 2.24 0.00 -3.53 2.01 -1.26 -2.17 115.64 111.50 2b0v s THR 102 Ca 0.67 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.88 2b0v s THR 102 Cb -0.51 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 68.87 2b0v s THR 102 CO 0.54 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 2b0v n GLY 103 N 1.92 2.87 3.65 4.40 0.00 -1.26 -5.03 105.19 111.74 2b0v n GLY 103 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2b0v n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b0v s ILE 104 N -2.58 4.71 -0.12 -0.61 -1.09 -0.92 -0.27 121.20 120.32 2b0v s ILE 104 Ca 0.00 1.78 -0.28 0.00 -2.23 0.00 0.00 60.65 59.93 2b0v s ILE 104 Cb 0.00 -4.26 -0.24 0.00 -1.58 0.00 0.00 42.46 36.38 2b0v s ILE 104 CO 0.00 -0.20 0.83 0.58 -1.23 0.00 0.00 174.94 174.92 2b0v h VAL 105 N 5.50 1.68 -1.99 2.92 2.07 -0.80 -3.48 116.25 122.15 2b0v h VAL 105 Ca -0.21 -2.11 -0.04 0.00 0.82 0.00 0.00 66.70 65.17 2b0v h VAL 105 Cb 1.07 3.09 -0.19 0.00 -1.52 0.00 0.00 31.29 33.75 2b0v h VAL 105 CO 0.95 0.54 0.25 0.00 0.02 0.00 0.00 177.57 179.33 2b0v s ARG 106 N -2.55 1.00 -0.11 1.57 1.70 -1.14 -5.01 118.95 114.41 2b0v s ARG 106 Ca -0.18 0.20 0.00 0.00 -0.47 0.00 0.00 55.73 55.28 2b0v s ARG 106 Cb -0.02 0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 34.81 2b0v s ARG 106 CO 0.67 -0.32 -0.11 0.00 -1.08 0.00 0.00 175.30 174.45 2b0v s ALA 107 N -1.33 2.72 0.27 7.88 0.00 -1.26 -0.87 121.76 129.16 2b0v s ALA 107 Ca -0.09 -0.90 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 2b0v s ALA 107 Cb -0.00 -1.21 -0.00 0.00 0.00 0.00 0.00 23.12 21.91 2b0v s ALA 107 CO 0.07 0.35 0.48 0.00 0.00 0.00 0.00 175.76 176.66 2b0v s ALA 108 N -0.01 -0.06 -0.22 0.00 0.00 -0.44 -4.98 121.76 116.04 2b0v s ALA 108 Ca -0.03 -1.00 -0.10 0.00 0.00 0.00 0.00 51.96 50.84 2b0v s ALA 108 Cb -0.14 1.07 -0.05 0.00 0.00 0.00 0.00 23.12 24.01 2b0v s ALA 108 CO 0.04 -0.84 0.14 -1.58 0.00 0.00 0.00 175.76 173.51 2b0v s TRP 109 N -3.79 3.34 -0.02 0.00 0.52 -1.26 -1.27 118.94 116.46 2b0v s TRP 109 Ca 0.24 0.24 0.07 0.00 0.02 0.00 0.00 56.10 56.67 2b0v s TRP 109 Cb -0.01 -2.21 -0.02 0.00 -1.15 0.00 0.00 33.47 30.09 2b0v s TRP 109 CO 0.11 0.16 -0.22 -0.06 0.02 0.00 0.00 176.95 176.96 2b0v s PHE 110 N 0.72 1.98 0.71 -1.98 0.08 0.05 -4.85 117.98 114.69 2b0v s PHE 110 Ca 0.07 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.63 2b0v s PHE 110 Cb -0.12 -1.28 0.02 0.00 -0.57 0.00 0.00 43.02 41.06 2b0v s PHE 110 CO 0.01 -0.04 1.07 -1.54 -0.10 0.00 0.00 175.22 174.63 2b0v s SER 111 N -0.49 5.35 0.29 1.36 1.04 -1.26 -0.66 113.70 119.32 2b0v s SER 111 Ca 0.08 1.35 -0.00 0.00 0.48 0.00 0.00 55.95 57.85 2b0v s SER 111 Cb -0.09 -2.20 0.49 0.00 0.10 0.00 0.00 66.02 64.33 2b0v s SER 111 CO -0.01 -1.43 1.90 -0.29 0.98 0.00 0.00 173.24 174.39 2b0v h ILE 112 N -0.71 1.07 -0.67 -1.02 6.09 -1.99 -1.16 117.51 119.11 2b0v h ILE 112 Ca -0.45 -0.37 0.01 0.00 -1.37 0.00 0.00 64.86 62.67 2b0v h ILE 112 Cb 1.23 -0.11 -0.03 0.00 0.47 0.00 0.00 36.82 38.38 2b0v h ILE 112 CO 0.61 0.20 0.44 0.44 -3.07 0.00 0.00 178.15 176.76 2b0v h ASP 113 N 1.08 0.77 -0.48 2.19 5.19 -1.95 0.14 116.42 123.37 2b0v h ASP 113 Ca 0.41 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.72 2b0v h ASP 113 Cb 0.20 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 2b0v h ASP 113 CO -0.16 0.56 -0.01 -0.33 -3.12 0.00 0.00 179.24 176.18 2b0v h GLU 114 N 0.91 0.85 -0.26 3.56 5.08 -1.72 -1.47 114.58 121.51 2b0v h GLU 114 Ca 0.24 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2b0v h GLU 114 Cb -0.10 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 2b0v h GLU 114 CO -0.05 0.90 0.12 0.82 -1.00 0.00 0.00 179.01 179.80 2b0v h ILE 115 N 0.70 1.15 -0.73 3.13 2.04 -0.90 -2.37 117.51 120.53 2b0v h ILE 115 Ca 0.13 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 2b0v h ILE 115 Cb 0.52 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2b0v h ILE 115 CO 0.03 0.15 0.44 0.03 0.00 0.00 0.00 178.15 178.79 2b0v h ARG 116 N 0.29 0.99 0.00 2.37 3.08 -0.83 -1.70 114.38 118.57 2b0v h ARG 116 Ca 0.09 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2b0v h ARG 116 Cb 0.13 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2b0v h ARG 116 CO -0.01 0.69 0.00 0.00 -1.07 0.00 0.00 179.97 179.58 2b0v n ALA 117 N -2.43 1.90 -0.62 0.04 0.00 -0.57 -2.18 120.51 116.66 2b0v n ALA 117 Ca 0.08 0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.62 2b0v n ALA 117 Cb 0.07 -1.40 0.31 0.00 0.00 0.00 0.00 19.45 18.43 2b0v n ALA 117 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2b0v n LYS 118 N -2.10 3.49 -0.31 0.00 5.02 -0.65 -4.69 118.16 118.93 2b0v n LYS 118 Ca 0.04 -2.75 0.10 0.00 -2.02 0.00 0.00 58.31 53.68 2b0v n LYS 118 Cb 0.29 -1.79 0.26 0.00 -0.02 0.00 0.00 35.03 33.78 2b0v n LYS 118 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 2b0v h GLN 119 N 3.33 0.55 -1.93 1.97 4.15 -1.31 -2.95 115.11 118.92 2b0v h GLN 119 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2b0v h GLN 119 Cb 1.35 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.91 2b0v h GLN 119 CO 0.20 0.36 0.00 0.00 -1.93 0.00 0.00 178.83 177.46 2b0v n ALA 120 N -2.43 1.61 -1.49 3.38 0.00 -1.26 -4.89 120.51 115.43 2b0v n ALA 120 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2b0v n ALA 120 Cb 0.53 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2b0v n ALA 120 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2b0v n HIS 122 N 1.14 -4.11 -0.28 0.00 -0.00 -1.12 -5.09 115.22 105.77 2b0v n HIS 122 Ca 0.00 2.20 -0.04 0.00 -0.00 0.00 0.00 57.72 59.88 2b0v n HIS 122 Cb 0.04 -3.37 0.07 0.00 -0.00 0.00 0.00 29.99 26.73 2b0v n HIS 122 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 2b0v h ARG 123 N 1.30 0.98 -3.91 -0.41 9.65 -1.18 -3.45 114.38 117.36 2b0v h ARG 123 Ca 0.00 -0.06 -0.11 0.00 -1.10 0.00 0.00 59.98 58.71 2b0v h ARG 123 Cb 0.16 -0.22 -0.12 0.00 -1.39 0.00 0.00 29.97 28.40 2b0v h ARG 123 CO 0.00 0.65 -0.30 0.95 2.80 0.00 0.00 179.97 184.07 2b0v s THR 124 N -6.13 0.03 0.03 0.20 -4.23 -1.26 -5.02 115.64 99.26 2b0v s THR 124 Ca -0.13 -1.48 0.28 0.00 -1.18 0.00 0.00 61.69 59.18 2b0v s THR 124 Cb 0.15 -2.06 0.28 0.00 1.34 0.00 0.00 72.50 72.21 2b0v s THR 124 CO 0.78 -0.15 1.85 -0.65 -0.54 0.00 0.00 174.62 175.91 2b0v h PRO 125 N 2.46 0.00 0.00 3.99 0.11 -1.97 -2.61 132.00 133.98 2b0v h PRO 125 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2b0v h PRO 125 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2b0v h PRO 125 CO 0.45 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 178.17 2b0v h LEU 126 N 0.00 0.00 -0.08 2.35 -0.00 -1.98 -2.53 115.31 113.06 2b0v h LEU 126 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2b0v h LEU 126 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.67 2b0v h LEU 126 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 178.44 178.96 2b0v n VAL 127 N -2.77 0.00 0.00 1.22 0.31 -0.98 -0.53 118.33 115.58 2b0v n VAL 127 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2b0v n VAL 127 Cb 0.38 -0.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 2b0v n VAL 127 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2b0v n GLN 129 N -0.42 0.00 0.18 5.55 -0.06 -0.96 -3.44 117.38 118.24 2b0v n GLN 129 Ca 0.00 0.00 0.02 0.00 -2.00 0.00 0.00 57.00 55.02 2b0v n GLN 129 Cb 0.00 0.00 0.34 0.00 -4.06 0.00 0.00 30.24 26.52 2b0v n GLN 129 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2b0v h ILE 131 N 0.00 1.29 -0.44 0.00 2.04 -1.78 -2.07 117.51 116.55 2b0v h ILE 131 Ca -0.00 -1.33 0.04 0.00 1.00 0.00 0.00 64.86 64.56 2b0v h ILE 131 Cb 0.72 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 2b0v h ILE 131 CO 0.05 0.43 0.22 -0.33 0.00 0.00 0.00 178.15 178.52 2b0v h GLU 132 N 0.49 0.42 -0.56 2.37 5.08 -1.74 0.82 114.58 121.46 2b0v h GLU 132 Ca 0.07 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2b0v h GLU 132 Cb 0.75 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2b0v h GLU 132 CO 0.06 0.28 0.09 -0.44 -1.00 0.00 0.00 179.01 178.00 2b0v h ASP 133 N 0.44 0.89 -0.41 1.42 3.32 -1.13 0.12 116.42 121.07 2b0v h ASP 133 Ca 0.19 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2b0v h ASP 133 Cb 0.10 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2b0v h ASP 133 CO -0.14 0.92 0.24 0.22 -1.72 0.00 0.00 179.24 178.76 2b0v h TYR 134 N 0.82 0.55 -0.27 4.55 3.20 -1.04 -2.06 116.97 122.71 2b0v h TYR 134 Ca 0.17 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 2b0v h TYR 134 Cb 0.41 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2b0v h TYR 134 CO 0.03 0.40 -0.08 1.25 -1.64 0.00 0.00 178.16 178.12 2b0v h HIS 135 N 0.54 0.45 0.00 -3.82 2.76 -0.37 -1.89 115.15 112.82 2b0v h HIS 135 Ca 0.15 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 2b0v h HIS 135 Cb 0.02 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 28.85 2b0v h HIS 135 CO -0.03 0.51 0.00 0.00 -1.30 0.00 0.00 177.93 177.11 2b0v n ALA 136 N -2.48 2.23 -0.71 5.26 0.00 0.39 -4.84 120.51 120.35 2b0v n ALA 136 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2b0v n ALA 136 Cb 0.28 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2b0v n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b0v n GLY 137 N 0.24 0.58 3.59 0.00 0.00 -0.71 -4.99 105.19 103.90 2b0v n GLY 137 Ca 0.09 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 2b0v n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0v s LYS 138 N -1.09 3.44 -0.04 1.61 1.02 -0.82 -4.95 119.74 118.90 2b0v s LYS 138 Ca 0.00 0.74 -0.02 0.00 0.02 0.00 0.00 55.97 56.71 2b0v s LYS 138 Cb 0.00 -4.07 0.03 0.00 -0.52 0.00 0.00 37.83 33.27 2b0v s LYS 138 CO 0.00 -1.75 0.07 1.03 -0.92 0.00 0.00 175.35 173.78 2b0v s ARG 139 N 5.22 -0.05 0.08 1.68 1.81 -1.26 -4.53 118.95 121.90 2b0v s ARG 139 Ca 0.58 0.35 0.06 0.00 -1.72 0.00 0.00 55.73 55.00 2b0v s ARG 139 Cb -0.12 -0.40 -0.03 0.00 -0.45 0.00 0.00 34.95 33.94 2b0v s ARG 139 CO 0.29 -0.28 -0.16 0.71 -0.68 0.00 0.00 175.30 175.19 2b0v s TYR 140 N 1.85 1.36 0.38 -0.53 2.02 0.17 -4.97 117.35 117.63 2b0v s TYR 140 Ca 0.00 -0.45 -0.27 0.00 -0.37 0.00 0.00 57.07 55.98 2b0v s TYR 140 Cb -0.12 -0.76 -0.10 0.00 -0.40 0.00 0.00 41.96 40.58 2b0v s TYR 140 CO -0.03 0.10 1.36 -2.14 -1.57 0.00 0.00 175.55 173.26 2b0v s PRO 141 N -1.80 4.11 0.50 -1.71 0.02 -1.26 -0.36 135.00 134.51 2b0v s PRO 141 Ca 0.00 2.29 0.17 0.00 0.02 0.00 0.00 61.00 63.49 2b0v s PRO 141 Cb -0.10 -2.91 1.24 0.00 0.02 0.00 0.00 34.50 32.75 2b0v s PRO 141 CO 0.03 -0.42 2.08 -0.07 -0.33 0.00 0.00 177.00 178.29 2b0v h LEU 142 N 2.97 0.09 0.00 -5.54 3.38 -1.92 -2.64 115.31 111.65 2b0v h LEU 142 Ca -0.50 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2b0v h LEU 142 Cb 1.24 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2b0v h LEU 142 CO 0.64 0.06 0.00 -0.90 0.09 0.00 0.00 178.44 178.33 2b0v n ASP 143 N -4.48 0.00 -0.25 -0.43 5.75 -1.26 -1.80 116.55 114.08 2b0v n ASP 143 Ca 0.02 -1.66 0.14 0.00 -0.01 0.00 0.00 54.79 53.29 2b0v n ASP 143 Cb 0.25 0.00 0.43 0.00 -1.03 0.00 0.00 41.12 40.77 2b0v n ASP 143 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2b0v h ILE 144 N 0.00 0.78 -3.21 2.12 2.04 -1.86 -3.41 117.51 113.97 2b0v h ILE 144 Ca 0.00 -0.20 -0.59 0.00 1.00 0.00 0.00 64.86 65.07 2b0v h ILE 144 Cb 0.00 0.16 -0.07 0.00 -0.74 0.00 0.00 36.82 36.17 2b0v h ILE 144 CO 0.00 0.11 -0.16 -0.76 0.00 0.00 0.00 178.15 177.34 2b0v s LEU 145 N -9.66 4.37 -0.19 1.44 1.02 -0.74 -5.06 118.68 109.86 2b0v s LEU 145 Ca -0.09 0.90 0.01 0.00 0.02 0.00 0.00 54.13 54.97 2b0v s LEU 145 Cb 0.22 -2.67 0.03 0.00 0.02 0.00 0.00 46.19 43.80 2b0v s LEU 145 CO 0.78 0.15 -0.15 -1.58 0.02 0.00 0.00 176.35 175.57 2b0v s GLN 146 N -0.15 2.46 -0.11 1.70 2.00 -1.26 -5.06 119.66 119.24 2b0v s GLN 146 Ca 0.25 -0.84 -0.05 0.00 -2.00 0.00 0.00 55.36 52.72 2b0v s GLN 146 Cb -0.16 -2.46 -0.04 0.00 0.80 0.00 0.00 33.01 31.15 2b0v s GLN 146 CO 0.12 -0.32 0.09 -0.47 -0.50 0.00 0.00 175.29 174.21 2b0v s TYR 147 N 1.34 3.45 -0.21 1.67 5.04 -1.26 -5.08 117.35 122.29 2b0v s TYR 147 Ca 0.01 0.41 0.02 0.00 -2.44 0.00 0.00 57.07 55.07 2b0v s TYR 147 Cb -0.15 -1.89 0.04 0.00 0.35 0.00 0.00 41.96 40.31 2b0v s TYR 147 CO -0.10 0.65 -0.15 0.71 -1.34 0.00 0.00 175.55 175.31 2b0v s TYR 148 N -0.98 2.89 -0.89 4.97 2.02 -1.26 -5.00 117.35 119.09 2b0v s TYR 148 Ca 0.15 -1.88 0.27 0.00 -0.37 0.00 0.00 57.07 55.24 2b0v s TYR 148 Cb -0.12 -1.87 0.96 0.00 -0.40 0.00 0.00 41.96 40.53 2b0v s TYR 148 CO 0.04 -0.82 1.78 -0.40 -1.57 0.00 0.00 175.55 174.57 2b0v n ASP 149 N 4.56 0.36 0.00 2.29 3.85 -1.26 -4.91 116.55 121.44 2b0v n ASP 149 Ca -0.17 0.41 0.00 0.00 -0.71 0.00 0.00 54.79 54.31 2b0v n ASP 149 Cb 0.47 -0.45 0.00 0.00 -1.35 0.00 0.00 41.12 39.78 2b0v n ASP 149 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2b0v n GLY 150 N 1.43 0.90 0.00 6.12 0.00 -1.26 -5.13 105.19 107.24 2b0v n GLY 150 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2b0v n GLY 150 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76