#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sos h THR 2 N 0.00 0.65 -4.00 0.00 2.02 -1.87 -3.44 112.91 106.28 1sos h THR 2 Ca 0.00 -1.78 -0.52 0.00 0.77 0.00 0.00 66.41 64.88 1sos h THR 2 Cb 0.00 1.52 -0.23 0.00 -1.74 0.00 0.00 68.15 67.70 1sos h THR 2 CO 0.00 0.22 -0.82 -0.54 0.37 0.00 0.00 175.52 174.75 1sos s LYS 3 N -2.28 1.10 0.05 6.66 1.02 -1.26 -0.34 119.74 124.69 1sos s LYS 3 Ca -0.23 -1.02 -0.04 0.00 0.02 0.00 0.00 55.97 54.70 1sos s LYS 3 Cb 0.04 -1.25 -0.02 0.00 -0.52 0.00 0.00 37.83 36.08 1sos s LYS 3 CO 0.46 0.30 0.06 0.00 -0.92 0.00 0.00 175.35 175.25 1sos s ALA 4 N -1.06 0.11 0.22 5.17 0.00 -0.96 -0.85 121.76 124.39 1sos s ALA 4 Ca 0.04 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.23 1sos s ALA 4 Cb -0.09 0.30 -0.05 0.00 0.00 0.00 0.00 23.12 23.28 1sos s ALA 4 CO 0.03 -0.37 0.01 0.54 0.00 0.00 0.00 175.76 175.97 1sos s VAL 5 N -3.28 0.86 -0.08 0.00 0.11 0.39 -1.28 120.40 117.12 1sos s VAL 5 Ca 0.01 -2.01 -0.03 0.00 -2.93 0.00 0.00 61.98 57.01 1sos s VAL 5 Cb 0.03 -2.33 0.04 0.00 -1.53 0.00 0.00 36.38 32.59 1sos s VAL 5 CO -0.08 -0.31 0.17 0.00 -3.33 0.00 0.00 175.10 171.55 1sos s ALA 6 N -3.54 -0.29 -0.33 1.54 0.00 -0.05 -0.66 121.76 118.44 1sos s ALA 6 Ca 0.29 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 1sos s ALA 6 Cb 0.06 -0.59 0.06 0.00 0.00 0.00 0.00 23.12 22.66 1sos s ALA 6 CO 0.08 -0.28 0.05 0.08 0.00 0.00 0.00 175.76 175.70 1sos s VAL 7 N 1.50 3.07 -0.07 0.00 1.01 -1.26 -1.92 120.40 122.72 1sos s VAL 7 Ca -0.06 -1.55 -0.29 0.00 0.00 0.00 0.00 61.98 60.08 1sos s VAL 7 Cb -0.12 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 1sos s VAL 7 CO -0.06 -0.25 0.95 -0.76 0.00 0.00 0.00 175.10 174.97 1sos s LEU 8 N 1.22 4.29 0.05 3.92 1.02 0.11 -4.32 118.68 124.98 1sos s LEU 8 Ca -0.02 1.50 -0.09 0.00 0.02 0.00 0.00 54.13 55.55 1sos s LEU 8 Cb -0.20 -3.48 0.00 0.00 0.02 0.00 0.00 46.19 42.53 1sos s LEU 8 CO -0.02 -0.34 0.19 -0.54 0.02 0.00 0.00 176.35 175.66 1sos s LYS 9 N 1.56 0.74 0.00 1.70 -0.14 -1.17 -0.89 119.74 121.53 1sos s LYS 9 Ca 0.47 -0.73 0.00 0.00 -1.36 0.00 0.00 55.97 54.35 1sos s LYS 9 Cb -0.19 0.30 0.00 0.00 -1.68 0.00 0.00 37.83 36.27 1sos s LYS 9 CO 0.21 -0.22 0.00 0.41 -0.76 0.00 0.00 175.35 174.99 1sos n GLY 10 N 0.45 3.73 3.50 -3.33 0.00 -1.21 -2.21 105.19 106.11 1sos n GLY 10 Ca -0.18 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1sos n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sos s ASP 11 N 1.75 6.77 0.75 1.61 1.11 -1.26 -4.76 116.67 122.63 1sos s ASP 11 Ca 0.00 -2.27 0.00 0.00 0.18 0.00 0.00 52.55 50.46 1sos s ASP 11 Cb 0.00 -2.47 0.00 0.00 1.07 0.00 0.00 42.92 41.52 1sos s ASP 11 CO 0.00 -1.09 0.00 0.61 1.18 0.00 0.00 175.17 175.87 1sos n GLY 12 N 5.37 0.93 0.21 0.21 0.00 -1.26 -4.83 105.19 105.83 1sos n GLY 12 Ca 0.34 -0.80 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 1sos n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sos h PRO 13 N 0.00 0.53 -6.36 1.61 0.13 -1.91 -3.43 132.00 122.57 1sos h PRO 13 Ca 0.00 -0.33 -0.55 0.00 -0.87 0.00 0.00 66.00 64.25 1sos h PRO 13 Cb 0.00 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.15 1sos h PRO 13 CO 0.00 0.93 0.66 0.08 -0.23 0.00 0.00 178.00 179.44 1sos s VAL 14 N -4.01 4.20 0.10 1.56 1.01 -1.26 -4.52 120.40 117.49 1sos s VAL 14 Ca -0.07 1.54 0.04 0.00 0.00 0.00 0.00 61.98 63.49 1sos s VAL 14 Cb 0.11 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1sos s VAL 14 CO 0.84 0.04 -0.10 -1.10 0.00 0.00 0.00 175.10 174.77 1sos s GLN 15 N 1.87 0.87 0.03 2.72 -0.21 -0.85 -3.36 119.66 120.74 1sos s GLN 15 Ca 0.57 -1.21 -0.28 0.00 0.02 0.00 0.00 55.36 54.46 1sos s GLN 15 Cb -0.26 -0.52 0.10 0.00 1.00 0.00 0.00 33.01 33.32 1sos s GLN 15 CO 0.24 0.07 1.01 0.20 -2.12 0.00 0.00 175.29 174.70 1sos s GLY 16 N -2.57 -0.35 -0.07 3.09 0.00 -0.07 -1.11 107.32 106.23 1sos s GLY 16 Ca 0.07 0.72 -0.01 0.00 0.00 0.00 0.00 44.72 45.50 1sos s GLY 16 CO -0.00 0.21 -0.01 -0.42 0.00 0.00 0.00 173.10 172.87 1sos s ILE 17 N -2.99 0.48 -0.06 0.90 1.01 -0.91 0.04 121.20 119.66 1sos s ILE 17 Ca 0.09 0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.84 1sos s ILE 17 Cb -0.00 -0.60 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1sos s ILE 17 CO -0.04 0.27 -0.24 -0.63 0.00 0.00 0.00 174.94 174.31 1sos s ILE 18 N 1.78 1.95 -0.02 2.92 -1.09 -0.81 -2.57 121.20 123.35 1sos s ILE 18 Ca 0.03 -1.00 0.01 0.00 -2.23 0.00 0.00 60.65 57.45 1sos s ILE 18 Cb -0.13 -1.66 -0.03 0.00 -1.58 0.00 0.00 42.46 39.06 1sos s ILE 18 CO -0.05 0.54 -0.02 0.20 -1.23 0.00 0.00 174.94 174.38 1sos s ASN 19 N -0.08 4.98 0.08 3.58 -0.87 -0.33 -0.87 114.94 121.43 1sos s ASN 19 Ca -0.05 -0.01 0.08 0.00 -1.57 0.00 0.00 52.86 51.31 1sos s ASN 19 Cb -0.14 -1.29 -0.03 0.00 -0.02 0.00 0.00 41.25 39.77 1sos s ASN 19 CO 0.04 0.31 -0.23 -0.36 -2.57 0.00 0.00 177.10 174.29 1sos s PHE 20 N -1.00 1.97 -0.17 2.20 0.08 -0.41 -1.04 117.98 119.61 1sos s PHE 20 Ca 0.17 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.76 1sos s PHE 20 Cb -0.11 -1.13 0.08 0.00 -0.57 0.00 0.00 43.02 41.29 1sos s PHE 20 CO 0.07 0.17 0.37 -2.00 -0.10 0.00 0.00 175.22 173.73 1sos s GLU 21 N -1.55 0.27 -0.43 0.44 2.12 -0.66 -2.27 118.70 116.62 1sos s GLU 21 Ca 0.09 0.93 0.01 0.00 0.36 0.00 0.00 54.97 56.36 1sos s GLU 21 Cb -0.10 0.20 0.12 0.00 0.26 0.00 0.00 34.13 34.61 1sos s GLU 21 CO 0.03 -0.26 0.18 -1.14 -0.54 0.00 0.00 175.26 173.54 1sos s GLN 22 N 2.49 1.87 0.00 4.30 0.74 0.54 -0.73 119.66 128.87 1sos s GLN 22 Ca -0.01 -2.06 0.11 0.00 0.05 0.00 0.00 55.36 53.45 1sos s GLN 22 Cb -0.12 -3.42 0.61 0.00 1.10 0.00 0.00 33.01 31.18 1sos s GLN 22 CO -0.11 -1.04 1.20 0.36 -0.55 0.00 0.00 175.29 175.15 1sos n LYS 23 N 4.08 0.24 -3.61 1.67 2.85 -1.26 -4.62 118.16 117.51 1sos n LYS 23 Ca 0.03 0.11 -0.02 0.00 -1.05 0.00 0.00 58.31 57.38 1sos n LYS 23 Cb 0.40 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.23 1sos n LYS 23 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1sos s GLU 24 N -2.35 0.54 0.00 -1.58 2.56 -1.26 -5.05 118.70 111.57 1sos s GLU 24 Ca 0.13 1.27 0.00 0.00 0.00 0.00 0.00 54.97 56.37 1sos s GLU 24 Cb 0.08 0.65 0.00 0.00 2.00 0.00 0.00 34.13 36.86 1sos s GLU 24 CO 0.15 -0.17 0.00 -1.13 -0.56 0.00 0.00 175.26 173.55 1sos n SER 25 N 5.11 0.00 -1.03 -1.70 3.41 -1.26 0.25 113.62 118.40 1sos n SER 25 Ca -0.13 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.45 1sos n SER 25 Cb 0.52 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1sos n SER 25 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1sos n ASN 26 N -1.60 -0.31 -5.02 4.04 6.94 -1.26 -4.88 115.26 113.17 1sos n ASN 26 Ca 0.00 -1.87 -0.19 0.00 -0.02 0.00 0.00 54.58 52.50 1sos n ASN 26 Cb 0.00 0.08 0.05 0.00 -2.36 0.00 0.00 39.78 37.55 1sos n ASN 26 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1sos s GLY 27 N -1.13 1.81 0.66 4.83 0.00 0.14 -5.08 107.32 108.56 1sos s GLY 27 Ca 0.09 -2.00 -0.15 0.00 0.00 0.00 0.00 44.72 42.65 1sos s GLY 27 CO -0.04 -1.65 1.12 2.56 0.00 0.00 0.00 173.10 175.09 1sos s PRO 28 N -4.57 2.76 -0.24 2.90 0.04 -1.26 -4.79 135.00 129.83 1sos s PRO 28 Ca 0.59 1.42 -0.12 0.00 0.04 0.00 0.00 61.00 62.93 1sos s PRO 28 Cb -0.07 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 1sos s PRO 28 CO 0.37 -1.29 0.23 0.08 0.04 0.00 0.00 177.00 176.43 1sos s VAL 29 N -2.31 5.30 0.08 -0.36 1.01 0.73 -4.10 120.40 120.76 1sos s VAL 29 Ca 0.68 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.68 1sos s VAL 29 Cb -0.21 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1sos s VAL 29 CO 0.42 0.30 1.00 -0.75 0.00 0.00 0.00 175.10 176.06 1sos s LYS 30 N 1.30 4.63 -0.07 2.72 2.47 0.09 -0.85 119.74 130.04 1sos s LYS 30 Ca 0.10 1.49 0.02 0.00 -1.56 0.00 0.00 55.97 56.03 1sos s LYS 30 Cb -0.14 -3.39 0.01 0.00 -1.46 0.00 0.00 37.83 32.85 1sos s LYS 30 CO 0.07 0.09 -0.12 0.54 0.16 0.00 0.00 175.35 176.09 1sos s VAL 31 N 0.35 1.11 0.04 4.02 0.11 0.06 -1.65 120.40 124.44 1sos s VAL 31 Ca 0.49 -0.46 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 1sos s VAL 31 Cb -0.24 -1.03 0.01 0.00 -1.53 0.00 0.00 36.38 33.60 1sos s VAL 31 CO 0.30 0.35 0.22 -1.66 -3.33 0.00 0.00 175.10 170.98 1sos s TRP 32 N 0.71 0.01 -3.50 1.54 -2.14 -0.21 -1.02 118.94 114.32 1sos s TRP 32 Ca -0.14 -0.21 0.00 0.00 2.66 0.00 0.00 56.10 58.42 1sos s TRP 32 Cb -0.16 0.00 0.00 0.00 -3.10 0.00 0.00 33.47 30.22 1sos s TRP 32 CO 0.03 -0.45 0.00 0.41 -2.66 0.00 0.00 176.95 174.29 1sos n GLY 33 N 0.68 -0.52 2.93 3.67 0.00 -0.18 -1.19 105.19 110.59 1sos n GLY 33 Ca -0.19 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 1sos n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sos s SER 34 N -4.00 0.27 0.01 1.61 0.01 -1.06 -0.61 113.70 109.93 1sos s SER 34 Ca 0.00 -0.19 0.08 0.00 1.31 0.00 0.00 55.95 57.15 1sos s SER 34 Cb 0.00 0.01 -0.02 0.00 0.21 0.00 0.00 66.02 66.22 1sos s SER 34 CO 0.00 -0.08 -0.26 -0.63 0.41 0.00 0.00 173.24 172.68 1sos s ILE 35 N -0.51 2.06 0.19 1.44 1.01 -0.22 -2.14 121.20 123.02 1sos s ILE 35 Ca -0.04 -1.22 0.00 0.00 0.00 0.00 0.00 60.65 59.39 1sos s ILE 35 Cb -0.04 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 1sos s ILE 35 CO -0.00 0.47 0.08 -1.59 0.00 0.00 0.00 174.94 173.90 1sos s LYS 36 N -0.89 1.16 0.00 2.79 -2.85 -0.27 -0.61 119.74 119.08 1sos s LYS 36 Ca 0.11 -1.59 0.00 0.00 -1.00 0.00 0.00 55.97 53.48 1sos s LYS 36 Cb -0.10 0.02 0.00 0.00 -2.06 0.00 0.00 37.83 35.69 1sos s LYS 36 CO 0.00 -0.28 0.00 0.41 0.10 0.00 0.00 175.35 175.58 1sos n GLY 37 N -0.27 0.63 3.90 0.59 0.00 -0.60 -2.00 105.19 107.44 1sos n GLY 37 Ca -0.02 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 1sos n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sos s LEU 38 N 0.00 3.21 0.56 0.99 2.01 0.32 -4.38 118.68 121.38 1sos s LEU 38 Ca 0.00 0.92 -0.16 0.00 0.01 0.00 0.00 54.13 54.90 1sos s LEU 38 Cb 0.00 -3.79 -0.06 0.00 0.01 0.00 0.00 46.19 42.36 1sos s LEU 38 CO 0.00 -1.04 1.02 0.42 1.01 0.00 0.00 176.35 177.76 1sos s THR 39 N -3.07 4.14 0.32 5.49 -4.23 -1.26 -3.96 115.64 113.08 1sos s THR 39 Ca 0.54 1.03 -0.29 0.00 -1.18 0.00 0.00 61.69 61.79 1sos s THR 39 Cb -0.11 -3.54 -0.11 0.00 1.34 0.00 0.00 72.50 70.08 1sos s THR 39 CO 0.48 -0.59 1.52 -0.70 -0.54 0.00 0.00 174.62 174.79 1sos s GLU 40 N -4.06 4.14 0.00 3.99 2.12 -1.26 -4.50 118.70 119.13 1sos s GLU 40 Ca 0.61 2.53 0.00 0.00 0.36 0.00 0.00 54.97 58.47 1sos s GLU 40 Cb -0.13 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.25 1sos s GLU 40 CO 0.34 -0.55 0.00 0.41 -0.54 0.00 0.00 175.26 174.92 1sos n GLY 41 N 1.43 0.52 3.80 -1.50 0.00 -0.62 -4.90 105.19 103.92 1sos n GLY 41 Ca 0.05 -2.22 -0.38 0.00 0.00 0.00 0.00 46.02 43.47 1sos n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sos s LEU 42 N 0.00 4.45 -0.10 0.99 1.02 -1.26 -0.55 118.68 123.23 1sos s LEU 42 Ca 0.00 1.06 -0.01 0.00 0.02 0.00 0.00 54.13 55.20 1sos s LEU 42 Cb 0.00 -2.74 0.03 0.00 0.02 0.00 0.00 46.19 43.50 1sos s LEU 42 CO 0.00 0.23 -0.02 -1.00 0.02 0.00 0.00 176.35 175.58 1sos s HIS 43 N -0.71 1.00 0.29 0.29 3.76 -0.04 -2.85 115.29 117.04 1sos s HIS 43 Ca 0.27 -0.43 -0.29 0.00 -0.15 0.00 0.00 55.06 54.45 1sos s HIS 43 Cb -0.18 -0.98 -0.13 0.00 1.11 0.00 0.00 32.58 32.41 1sos s HIS 43 CO 0.15 -0.42 1.28 0.41 -0.85 0.00 0.00 174.74 175.32 1sos n GLY 44 N 5.06 0.51 2.79 -2.22 0.00 -0.31 -0.96 105.19 110.07 1sos n GLY 44 Ca -0.09 0.38 -0.28 0.00 0.00 0.00 0.00 46.02 46.04 1sos n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1sos s PHE 45 N -0.72 1.28 0.21 1.61 5.36 -0.04 0.03 117.98 125.72 1sos s PHE 45 Ca 0.61 -0.93 0.01 0.00 -0.96 0.00 0.00 56.93 55.65 1sos s PHE 45 Cb -0.62 -1.12 -0.05 0.00 -0.34 0.00 0.00 43.02 40.89 1sos s PHE 45 CO 0.57 -0.60 0.06 -1.01 -1.46 0.00 0.00 175.22 172.79 1sos s HIS 46 N 1.77 1.32 -0.21 10.12 3.76 -1.00 -2.42 115.29 128.63 1sos s HIS 46 Ca -0.01 -1.15 -0.04 0.00 -0.15 0.00 0.00 55.06 53.71 1sos s HIS 46 Cb -0.16 -0.75 -0.01 0.00 1.11 0.00 0.00 32.58 32.77 1sos s HIS 46 CO -0.07 -0.35 -0.05 0.08 -0.85 0.00 0.00 174.74 173.50 1sos s VAL 47 N -3.80 3.40 0.41 -0.90 1.01 -0.34 -1.65 120.40 118.53 1sos s VAL 47 Ca 0.32 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1sos s VAL 47 Cb 0.07 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.91 1sos s VAL 47 CO 0.09 0.43 0.58 -1.00 0.00 0.00 0.00 175.10 175.21 1sos s HIS 48 N 1.32 3.08 0.01 5.22 3.76 0.39 -1.31 115.29 127.76 1sos s HIS 48 Ca 0.04 -0.07 -0.22 0.00 -0.15 0.00 0.00 55.06 54.66 1sos s HIS 48 Cb -0.14 -2.23 -0.19 0.00 1.11 0.00 0.00 32.58 31.13 1sos s HIS 48 CO -0.02 -0.27 1.21 1.49 -0.85 0.00 0.00 174.74 176.30 1sos h GLU 49 N 0.61 0.30 -5.81 1.40 4.81 -0.91 -2.90 114.58 112.08 1sos h GLU 49 Ca -0.45 -0.22 -0.67 0.00 -0.13 0.00 0.00 59.36 57.89 1sos h GLU 49 Cb 1.26 0.04 -0.11 0.00 0.63 0.00 0.00 28.75 30.57 1sos h GLU 49 CO 0.53 0.84 -0.55 -0.06 -0.73 0.00 0.00 179.01 179.04 1sos s PHE 50 N -3.79 3.39 -1.10 0.92 0.08 0.07 -4.68 117.98 112.87 1sos s PHE 50 Ca -0.15 0.36 -0.04 0.00 0.12 0.00 0.00 56.93 57.22 1sos s PHE 50 Cb 0.04 -1.86 0.14 0.00 -0.57 0.00 0.00 43.02 40.77 1sos s PHE 50 CO 0.76 0.61 2.37 0.41 -0.10 0.00 0.00 175.22 179.27 1sos n GLY 51 N 2.03 5.20 3.04 4.36 0.00 -0.97 -3.99 105.19 114.86 1sos n GLY 51 Ca -0.19 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.41 1sos n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sos s ASP 52 N 0.08 3.49 -0.15 1.61 2.15 -1.26 -4.93 116.67 117.66 1sos s ASP 52 Ca 0.53 -0.90 0.16 0.00 0.43 0.00 0.00 52.55 52.76 1sos s ASP 52 Cb 0.23 -1.34 0.47 0.00 -0.30 0.00 0.00 42.92 41.98 1sos s ASP 52 CO -0.14 -0.12 1.37 -3.20 -0.17 0.00 0.00 175.17 172.92 1sos n ASN 53 N 4.63 3.59 -0.06 -0.34 2.85 -1.26 -2.98 115.26 121.69 1sos n ASN 53 Ca -0.16 -2.86 -0.13 0.00 -0.11 0.00 0.00 54.58 51.33 1sos n ASN 53 Cb 0.47 -0.48 -0.06 0.00 1.24 0.00 0.00 39.78 40.95 1sos n ASN 53 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1sos h THR 54 N 1.66 1.32 -1.27 -0.44 1.35 -1.93 -3.04 112.91 110.57 1sos h THR 54 Ca 0.00 -1.20 -0.58 0.00 -0.55 0.00 0.00 66.41 64.08 1sos h THR 54 Cb 1.29 1.72 -0.21 0.00 -1.73 0.00 0.00 68.15 69.22 1sos h THR 54 CO 0.17 0.36 0.65 0.00 -0.25 0.00 0.00 175.52 176.45 1sos n ALA 55 N -2.40 6.30 -0.58 6.62 0.00 -1.26 -5.02 120.51 124.17 1sos n ALA 55 Ca -0.05 -3.24 0.00 0.00 0.00 0.00 0.00 53.44 50.14 1sos n ALA 55 Cb 0.34 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1sos n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sos n GLY 56 N 0.21 2.67 0.01 0.00 0.00 -1.15 -2.77 105.19 104.16 1sos n GLY 56 Ca 0.50 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1sos n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sos h THR 58 N 0.00 1.26 0.00 0.00 2.02 -1.86 -2.77 112.91 111.56 1sos h THR 58 Ca 0.00 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.95 1sos h THR 58 Cb 0.59 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1sos h THR 58 CO 0.00 0.39 0.00 -1.54 0.37 0.00 0.00 175.52 174.74 1sos n SER 59 N -4.13 0.00 0.03 4.18 3.41 -1.26 -3.13 113.62 112.72 1sos n SER 59 Ca -0.00 -0.88 0.09 0.00 -0.26 0.00 0.00 58.87 57.82 1sos n SER 59 Cb 0.39 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.74 1sos n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sos n ALA 60 N -0.98 1.79 0.00 7.33 0.00 -1.05 -4.52 120.51 123.09 1sos n ALA 60 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1sos n ALA 60 Cb 0.09 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1sos n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sos n GLY 61 N 0.29 -1.74 3.87 0.00 0.00 -1.19 -0.75 105.19 105.67 1sos n GLY 61 Ca 0.04 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1sos n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1sos s PRO 62 N 0.00 0.06 0.70 1.61 0.04 -1.26 -4.62 135.00 131.53 1sos s PRO 62 Ca 0.00 -0.44 -0.16 0.00 0.04 0.00 0.00 61.00 60.43 1sos s PRO 62 Cb 0.00 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.78 1sos s PRO 62 CO 0.00 -2.80 1.26 -1.01 0.04 0.00 0.00 177.00 174.49 1sos s HIS 63 N -3.78 2.00 -0.20 0.56 3.76 -1.26 -1.58 115.29 114.79 1sos s HIS 63 Ca 0.75 1.55 -0.29 0.00 -0.15 0.00 0.00 55.06 56.92 1sos s HIS 63 Cb -0.03 -3.61 -0.02 0.00 1.11 0.00 0.00 32.58 30.02 1sos s HIS 63 CO 0.54 -2.87 1.40 0.12 -0.85 0.00 0.00 174.74 173.08 1sos s PHE 64 N -1.67 2.53 -0.39 1.40 5.36 -0.43 -4.54 117.98 120.24 1sos s PHE 64 Ca 0.79 0.77 0.09 0.00 -0.96 0.00 0.00 56.93 57.61 1sos s PHE 64 Cb -0.34 -3.78 0.26 0.00 -0.34 0.00 0.00 43.02 38.82 1sos s PHE 64 CO 0.43 -2.23 0.55 -1.71 -1.46 0.00 0.00 175.22 170.79 1sos n ASN 65 N 7.38 0.25 0.28 6.13 5.15 -1.26 -0.98 115.26 132.21 1sos n ASN 65 Ca 0.16 -2.73 0.18 0.00 -0.60 0.00 0.00 54.58 51.58 1sos n ASN 65 Cb 0.45 -0.64 0.76 0.00 -0.53 0.00 0.00 39.78 39.82 1sos n ASN 65 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1sos h PRO 66 N 3.87 0.00 -0.64 1.20 0.13 -1.95 -2.94 132.00 131.67 1sos h PRO 66 Ca 0.07 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.05 1sos h PRO 66 Cb 0.89 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.93 1sos h PRO 66 CO 0.47 0.00 0.18 1.28 -0.23 0.00 0.00 178.00 179.70 1sos n LEU 67 N -3.02 5.72 -3.09 1.56 4.77 -1.26 -4.99 117.00 116.68 1sos n LEU 67 Ca 0.00 -3.19 -0.13 0.00 -0.03 0.00 0.00 56.01 52.66 1sos n LEU 67 Cb 0.26 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1sos n LEU 67 CO 0.25 0.79 -0.13 -1.20 -1.33 0.00 0.00 177.39 175.77 1sos n SER 68 N -0.12 -2.40 -4.43 -1.43 7.64 -1.11 -4.97 113.62 106.79 1sos n SER 68 Ca 0.36 -0.47 -0.24 0.00 1.01 0.00 0.00 58.87 59.54 1sos n SER 68 Cb 1.29 -0.79 -0.10 0.00 -1.01 0.00 0.00 64.21 63.60 1sos n SER 68 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1sos s ARG 69 N -3.34 1.76 0.77 1.43 0.52 -1.26 -5.15 118.95 113.69 1sos s ARG 69 Ca 0.01 -2.01 -0.10 0.00 -0.52 0.00 0.00 55.73 53.12 1sos s ARG 69 Cb -0.00 -0.94 0.08 0.00 0.52 0.00 0.00 34.95 34.61 1sos s ARG 69 CO 0.45 -0.23 1.12 0.15 0.02 0.00 0.00 175.30 176.80 1sos s LYS 70 N -3.84 1.96 0.02 3.54 1.02 -1.26 -4.66 119.74 116.51 1sos s LYS 70 Ca 0.32 -0.10 -0.30 0.00 0.02 0.00 0.00 55.97 55.91 1sos s LYS 70 Cb 0.07 -2.04 -0.04 0.00 -0.52 0.00 0.00 37.83 35.31 1sos s LYS 70 CO 0.15 -1.50 1.02 -1.58 -0.92 0.00 0.00 175.35 172.51 1sos s HIS 71 N -3.45 3.63 0.00 3.18 5.65 0.87 -2.17 115.29 123.00 1sos s HIS 71 Ca 0.62 1.63 0.00 0.00 0.25 0.00 0.00 55.06 57.57 1sos s HIS 71 Cb -0.10 -3.17 0.00 0.00 -1.18 0.00 0.00 32.58 28.13 1sos s HIS 71 CO 0.47 -0.23 0.00 0.41 -0.65 0.00 0.00 174.74 174.75 1sos n GLY 72 N 2.92 5.70 3.78 1.59 0.00 -1.25 -3.86 105.19 114.07 1sos n GLY 72 Ca 0.06 -1.50 -0.22 0.00 0.00 0.00 0.00 46.02 44.36 1sos n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sos s GLY 73 N 0.00 1.86 0.50 -0.02 0.00 -1.23 -4.61 107.32 103.82 1sos s GLY 73 Ca 0.00 -1.75 0.31 0.00 0.00 0.00 0.00 44.72 43.28 1sos s GLY 73 CO 0.00 -1.68 1.94 -0.56 0.00 0.00 0.00 173.10 172.79 1sos h PRO 74 N 1.45 0.00 -0.04 2.90 0.13 -1.79 -0.99 132.00 133.67 1sos h PRO 74 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1sos h PRO 74 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1sos h PRO 74 CO 0.61 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.01 1sos n LYS 75 N -2.63 0.70 -2.74 0.86 5.02 -1.26 -4.94 118.16 113.16 1sos n LYS 75 Ca -0.02 -1.22 -0.31 0.00 -2.02 0.00 0.00 58.31 54.75 1sos n LYS 75 Cb 0.12 -1.21 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 1sos n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1sos s ASP 76 N -0.91 6.53 0.03 4.39 1.01 -0.38 -4.97 116.67 122.37 1sos s ASP 76 Ca 0.13 1.22 -0.27 0.00 0.71 0.00 0.00 52.55 54.34 1sos s ASP 76 Cb 0.09 -2.36 -0.17 0.00 1.01 0.00 0.00 42.92 41.50 1sos s ASP 76 CO 0.14 -0.45 1.33 -0.33 0.21 0.00 0.00 175.17 176.07 1sos h GLU 77 N 1.13 -0.55 -5.41 8.23 5.08 -1.93 -3.40 114.58 117.74 1sos h GLU 77 Ca -0.47 0.04 -0.63 0.00 -1.00 0.00 0.00 59.36 57.30 1sos h GLU 77 Cb 1.19 0.13 -0.14 0.00 0.50 0.00 0.00 28.75 30.43 1sos h GLU 77 CO 0.63 -0.26 0.07 -2.00 -1.00 0.00 0.00 179.01 176.46 1sos s GLU 78 N -5.05 3.76 0.15 2.33 2.12 -1.26 -4.97 118.70 115.79 1sos s GLU 78 Ca -0.15 0.09 -0.25 0.00 0.36 0.00 0.00 54.97 55.02 1sos s GLU 78 Cb 0.03 -3.77 0.06 0.00 0.26 0.00 0.00 34.13 30.71 1sos s GLU 78 CO 0.55 -0.62 0.89 -0.98 -0.54 0.00 0.00 175.26 174.55 1sos s ARG 79 N 2.55 1.25 0.53 4.30 1.04 -1.21 -3.76 118.95 123.66 1sos s ARG 79 Ca 0.23 -0.65 -0.14 0.00 -1.04 0.00 0.00 55.73 54.12 1sos s ARG 79 Cb -0.15 0.45 -0.07 0.00 -2.04 0.00 0.00 34.95 33.14 1sos s ARG 79 CO 0.13 -0.57 0.98 -1.01 -0.04 0.00 0.00 175.30 174.79 1sos s HIS 80 N -3.40 3.50 0.28 5.89 3.76 -0.92 -4.66 115.29 119.74 1sos s HIS 80 Ca 0.10 1.38 -0.03 0.00 -0.15 0.00 0.00 55.06 56.36 1sos s HIS 80 Cb -0.02 -2.74 0.37 0.00 1.11 0.00 0.00 32.58 31.30 1sos s HIS 80 CO 0.01 -0.43 1.90 0.28 -0.85 0.00 0.00 174.74 175.65 1sos h VAL 81 N 0.59 1.23 -0.13 -0.90 2.07 -1.43 -2.70 116.25 114.99 1sos h VAL 81 Ca -0.46 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.43 1sos h VAL 81 Cb 1.19 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1sos h VAL 81 CO 0.62 0.25 0.08 0.61 0.02 0.00 0.00 177.57 179.15 1sos n GLY 82 N -1.20 2.29 3.26 2.17 0.00 -0.37 -4.37 105.19 106.98 1sos n GLY 82 Ca 0.08 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 1sos n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sos s ASP 83 N 0.65 6.20 0.00 1.61 1.01 -1.02 -1.20 116.67 123.92 1sos s ASP 83 Ca 0.07 -2.41 0.18 0.00 0.71 0.00 0.00 52.55 51.10 1sos s ASP 83 Cb 0.06 -2.11 0.50 0.00 1.01 0.00 0.00 42.92 42.38 1sos s ASP 83 CO 0.01 -0.61 1.41 0.18 0.21 0.00 0.00 175.17 176.37 1sos n LEU 84 N 4.30 2.76 0.00 1.23 4.77 -1.02 -2.60 117.00 126.44 1sos n LEU 84 Ca 0.04 -1.33 0.00 0.00 -0.03 0.00 0.00 56.01 54.68 1sos n LEU 84 Cb 0.43 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1sos n LEU 84 CO 0.39 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.73 1sos n GLY 85 N 1.34 0.37 3.01 -0.72 0.00 -1.19 -4.73 105.19 103.27 1sos n GLY 85 Ca 0.18 -0.79 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 1sos n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1sos s ASN 86 N -4.00 0.57 0.17 1.61 0.01 -1.26 -0.86 114.94 111.18 1sos s ASN 86 Ca 0.00 -0.43 0.11 0.00 -0.71 0.00 0.00 52.86 51.83 1sos s ASN 86 Cb 0.00 0.04 -0.04 0.00 0.41 0.00 0.00 41.25 41.66 1sos s ASN 86 CO 0.00 -0.18 -0.25 0.68 -1.51 0.00 0.00 177.10 175.84 1sos s VAL 87 N -1.13 2.31 -0.25 1.60 -7.23 -0.13 -4.89 120.40 110.68 1sos s VAL 87 Ca -0.09 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.13 1sos s VAL 87 Cb -0.08 -2.07 0.03 0.00 0.56 0.00 0.00 36.38 34.81 1sos s VAL 87 CO -0.00 -0.04 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.79 1sos s THR 88 N -1.45 2.82 0.15 5.32 2.01 -1.26 -0.86 115.64 122.37 1sos s THR 88 Ca 0.18 -1.08 -0.27 0.00 0.31 0.00 0.00 61.69 60.83 1sos s THR 88 Cb -0.09 -2.45 -0.07 0.00 0.01 0.00 0.00 72.50 69.90 1sos s THR 88 CO 0.08 0.18 0.86 0.00 -0.69 0.00 0.00 174.62 175.05 1sos s ALA 89 N 1.31 3.36 1.04 7.40 0.00 0.28 -4.38 121.76 130.77 1sos s ALA 89 Ca -0.01 0.46 -0.13 0.00 0.00 0.00 0.00 51.96 52.28 1sos s ALA 89 Cb -0.17 -3.10 0.18 0.00 0.00 0.00 0.00 23.12 20.03 1sos s ALA 89 CO -0.04 0.15 0.94 -0.40 0.00 0.00 0.00 175.76 176.41 1sos n ASP 90 N 2.10 -0.34 0.00 0.00 5.68 0.63 -1.58 116.55 123.04 1sos n ASP 90 Ca -0.02 -1.28 0.00 0.00 -0.50 0.00 0.00 54.79 52.99 1sos n ASP 90 Cb 0.49 -0.75 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1sos n ASP 90 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1sos n LYS 91 N -3.27 0.00 -0.09 0.11 2.85 -1.26 -0.45 118.16 116.05 1sos n LYS 91 Ca 0.12 0.27 0.12 0.00 -1.05 0.00 0.00 58.31 57.77 1sos n LYS 91 Cb 0.43 -1.51 0.22 0.00 -0.65 0.00 0.00 35.03 33.52 1sos n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1sos n ASP 92 N -1.26 2.89 -0.25 -5.58 8.00 -1.26 -4.90 116.55 114.20 1sos n ASP 92 Ca 0.00 -1.92 -0.03 0.00 0.71 0.00 0.00 54.79 53.55 1sos n ASP 92 Cb 0.01 -0.12 -0.01 0.00 -0.02 0.00 0.00 41.12 40.98 1sos n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sos n GLY 93 N 1.37 0.63 3.70 0.44 0.00 0.40 -4.67 105.19 107.07 1sos n GLY 93 Ca 0.17 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 1sos n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sos s VAL 94 N -2.05 4.68 -0.17 1.61 1.01 -1.26 -0.52 120.40 123.70 1sos s VAL 94 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1sos s VAL 94 Cb 0.00 -3.03 0.04 0.00 0.00 0.00 0.00 36.38 33.39 1sos s VAL 94 CO 0.00 0.57 -0.09 0.00 0.00 0.00 0.00 175.10 175.58 1sos s ALA 95 N -0.53 1.73 -0.13 5.51 0.00 0.22 -0.27 121.76 128.29 1sos s ALA 95 Ca 0.10 -0.95 -0.16 0.00 0.00 0.00 0.00 51.96 50.95 1sos s ALA 95 Cb -0.12 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 1sos s ALA 95 CO 0.02 -0.68 0.39 -0.51 0.00 0.00 0.00 175.76 174.98 1sos s ASP 96 N 1.53 6.58 -0.04 0.00 1.01 -1.26 -1.06 116.67 123.42 1sos s ASP 96 Ca 0.01 0.68 0.02 0.00 0.71 0.00 0.00 52.55 53.98 1sos s ASP 96 Cb -0.15 -2.24 -0.03 0.00 1.01 0.00 0.00 42.92 41.52 1sos s ASP 96 CO -0.09 0.07 -0.09 -0.69 0.21 0.00 0.00 175.17 174.58 1sos s VAL 97 N 0.43 3.48 -0.30 -1.27 1.01 0.22 -4.74 120.40 119.23 1sos s VAL 97 Ca 0.21 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1sos s VAL 97 Cb -0.14 -2.43 0.19 0.00 0.00 0.00 0.00 36.38 34.00 1sos s VAL 97 CO 0.07 0.54 0.77 -0.44 0.00 0.00 0.00 175.10 176.05 1sos s SER 98 N -0.94 -1.07 0.17 3.32 0.01 -1.24 -1.01 113.70 112.94 1sos s SER 98 Ca 0.13 0.51 0.07 0.00 1.31 0.00 0.00 55.95 57.97 1sos s SER 98 Cb -0.11 1.84 -0.04 0.00 0.21 0.00 0.00 66.02 67.91 1sos s SER 98 CO 0.03 -0.20 -0.14 -0.63 0.41 0.00 0.00 173.24 172.71 1sos s ILE 99 N 2.89 1.55 -0.05 1.44 1.01 -0.19 -4.99 121.20 122.86 1sos s ILE 99 Ca 0.13 -2.06 -0.00 0.00 0.00 0.00 0.00 60.65 58.72 1sos s ILE 99 Cb -0.12 -1.89 0.03 0.00 0.01 0.00 0.00 42.46 40.49 1sos s ILE 99 CO -0.19 -0.57 -0.01 -0.70 0.00 0.00 0.00 174.94 173.47 1sos s GLU 100 N -3.40 0.62 0.01 2.79 -6.30 -1.26 -0.76 118.70 110.40 1sos s GLU 100 Ca 0.18 0.03 -0.09 0.00 -2.50 0.00 0.00 54.97 52.60 1sos s GLU 100 Cb -0.01 -0.83 0.00 0.00 0.00 0.00 0.00 34.13 33.29 1sos s GLU 100 CO 0.05 -0.20 0.17 0.34 0.02 0.00 0.00 175.26 175.64 1sos s ASP 101 N 1.43 0.01 -0.08 -1.70 2.15 -0.03 -4.96 116.67 113.49 1sos s ASP 101 Ca -0.03 -0.22 0.13 0.00 0.43 0.00 0.00 52.55 52.86 1sos s ASP 101 Cb -0.13 0.24 0.26 0.00 -0.30 0.00 0.00 42.92 42.99 1sos s ASP 101 CO -0.03 -0.42 1.13 -1.20 -0.17 0.00 0.00 175.17 174.48 1sos n SER 102 N 1.24 1.28 -0.07 -0.34 7.64 -1.26 -0.20 113.62 121.91 1sos n SER 102 Ca -0.22 -2.74 -0.09 0.00 1.01 0.00 0.00 58.87 56.83 1sos n SER 102 Cb 0.56 -0.36 -0.07 0.00 -1.01 0.00 0.00 64.21 63.33 1sos n SER 102 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1sos n VAL 103 N -0.58 0.82 -1.77 0.44 0.31 -1.26 -4.94 118.33 111.36 1sos n VAL 103 Ca 0.10 -0.34 -0.33 0.00 -0.01 0.00 0.00 64.34 63.77 1sos n VAL 103 Cb 0.77 -0.98 0.04 0.00 -0.91 0.00 0.00 33.84 32.77 1sos n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1sos s ILE 104 N -2.29 3.34 0.17 2.52 -4.36 -1.26 -4.90 121.20 114.42 1sos s ILE 104 Ca -0.18 0.61 -0.10 0.00 -0.26 0.00 0.00 60.65 60.72 1sos s ILE 104 Cb 0.05 -3.13 -0.00 0.00 1.25 0.00 0.00 42.46 40.62 1sos s ILE 104 CO 0.35 -0.40 0.32 -0.55 0.24 0.00 0.00 174.94 174.90 1sos s SER 105 N -2.67 0.00 -0.02 4.36 0.15 -1.22 -4.67 113.70 109.62 1sos s SER 105 Ca 0.66 -0.83 0.17 0.00 0.70 0.00 0.00 55.95 56.65 1sos s SER 105 Cb -0.20 0.46 0.51 0.00 -1.71 0.00 0.00 66.02 65.09 1sos s SER 105 CO 0.42 -0.92 1.43 0.18 1.20 0.00 0.00 173.24 175.55 1sos n LEU 106 N -0.24 3.64 -3.82 3.45 4.77 -1.26 -1.21 117.00 122.33 1sos n LEU 106 Ca -0.07 -2.10 -0.12 0.00 -0.03 0.00 0.00 56.01 53.69 1sos n LEU 106 Cb 0.63 -0.40 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 1sos n LEU 106 CO 0.23 0.85 -0.08 -0.44 -1.33 0.00 0.00 177.39 176.62 1sos s SER 107 N -1.03 -0.05 0.00 -1.43 0.01 -1.26 -0.98 113.70 108.96 1sos s SER 107 Ca 0.39 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.51 1sos s SER 107 Cb 0.21 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1sos s SER 107 CO 0.24 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 174.06 1sos n GLY 108 N 1.23 -1.79 0.17 3.44 0.00 -1.26 -3.63 105.19 103.35 1sos n GLY 108 Ca -0.22 -1.78 0.13 0.00 0.00 0.00 0.00 46.02 44.16 1sos n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sos h ASP 109 N 0.00 0.00 -0.42 1.61 5.19 -2.00 -2.77 116.42 118.04 1sos h ASP 109 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1sos h ASP 109 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1sos h ASP 109 CO 0.00 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.53 1sos n HIS 110 N -2.65 0.55 -1.55 4.55 8.25 -1.26 -4.99 115.22 118.12 1sos n HIS 110 Ca 0.04 -0.28 -0.55 0.00 -0.26 0.00 0.00 57.72 56.68 1sos n HIS 110 Cb 0.43 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.47 1sos n HIS 110 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1sos n SER 111 N 0.89 0.94 -0.90 0.41 2.88 -1.05 -3.45 113.62 113.34 1sos n SER 111 Ca 0.17 1.14 0.12 0.00 -1.33 0.00 0.00 58.87 58.97 1sos n SER 111 Cb 0.42 -1.08 0.21 0.00 -0.75 0.00 0.00 64.21 63.01 1sos n SER 111 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1sos n ILE 112 N 2.08 0.12 -2.00 2.46 -5.35 -0.35 -4.91 119.36 111.40 1sos n ILE 112 Ca 0.19 -0.50 -0.42 0.00 -0.27 0.00 0.00 62.75 61.75 1sos n ILE 112 Cb 0.14 1.17 -0.03 0.00 -1.74 0.00 0.00 39.64 39.19 1sos n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1sos s ILE 113 N -1.88 2.93 0.00 7.28 -1.09 -1.26 -2.01 121.20 125.16 1sos s ILE 113 Ca 0.32 0.60 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 1sos s ILE 113 Cb 0.21 -3.39 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 1sos s ILE 113 CO 0.31 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.66 1sos n GLY 114 N 3.74 0.59 0.25 6.18 0.00 0.22 -4.98 105.19 111.17 1sos n GLY 114 Ca 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 1sos n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sos n ARG 115 N -2.81 1.45 -4.85 1.61 1.74 -0.85 -2.29 116.66 110.66 1sos n ARG 115 Ca 0.00 -0.23 -0.29 0.00 -0.77 0.00 0.00 57.85 56.56 1sos n ARG 115 Cb 0.00 0.03 -0.17 0.00 -1.02 0.00 0.00 32.46 31.30 1sos n ARG 115 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1sos s THR 116 N -0.19 1.69 0.05 0.55 2.01 -1.09 -0.63 115.64 118.02 1sos s THR 116 Ca 0.02 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.03 1sos s THR 116 Cb -0.00 -1.49 -0.06 0.00 0.01 0.00 0.00 72.50 70.95 1sos s THR 116 CO 0.01 0.48 0.58 -0.22 -0.69 0.00 0.00 174.62 174.78 1sos s LEU 117 N 0.59 4.50 -0.06 4.42 2.96 0.62 -0.46 118.68 131.26 1sos s LEU 117 Ca -0.14 1.24 -0.00 0.00 -0.22 0.00 0.00 54.13 55.00 1sos s LEU 117 Cb -0.17 -2.91 0.03 0.00 0.50 0.00 0.00 46.19 43.64 1sos s LEU 117 CO 0.05 0.23 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.60 1sos s VAL 118 N -0.85 0.43 -0.16 1.68 1.01 -0.66 -1.02 120.40 120.83 1sos s VAL 118 Ca 0.30 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 62.19 1sos s VAL 118 Cb -0.19 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 1sos s VAL 118 CO 0.19 0.24 0.19 0.54 0.00 0.00 0.00 175.10 176.26 1sos s VAL 119 N 1.53 5.38 0.40 2.92 0.11 -0.73 -2.37 120.40 127.63 1sos s VAL 119 Ca -0.02 0.33 0.06 0.00 -2.93 0.00 0.00 61.98 59.42 1sos s VAL 119 Cb -0.13 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.21 1sos s VAL 119 CO -0.03 0.47 0.56 -1.00 -3.33 0.00 0.00 175.10 171.77 1sos s HIS 120 N 0.02 3.00 0.05 1.54 3.76 0.10 -0.26 115.29 123.51 1sos s HIS 120 Ca 0.13 -0.20 -0.26 0.00 -0.15 0.00 0.00 55.06 54.58 1sos s HIS 120 Cb -0.12 -2.24 -0.17 0.00 1.11 0.00 0.00 32.58 31.16 1sos s HIS 120 CO 0.02 -0.28 1.53 1.49 -0.85 0.00 0.00 174.74 176.64 1sos h GLU 121 N 0.66 -0.25 -5.90 1.40 4.81 0.01 -3.37 114.58 111.94 1sos h GLU 121 Ca -0.44 0.02 -0.61 0.00 -0.13 0.00 0.00 59.36 58.20 1sos h GLU 121 Cb 1.27 0.06 -0.12 0.00 0.63 0.00 0.00 28.75 30.58 1sos h GLU 121 CO 0.51 -0.05 -0.64 0.15 -0.73 0.00 0.00 179.01 178.25 1sos s LYS 122 N -5.50 1.93 0.29 1.92 1.02 -0.08 -4.87 119.74 114.46 1sos s LYS 122 Ca -0.15 -1.93 -0.30 0.00 0.02 0.00 0.00 55.97 53.62 1sos s LYS 122 Cb 0.04 -1.76 -0.12 0.00 -0.52 0.00 0.00 37.83 35.47 1sos s LYS 122 CO 0.63 0.09 1.45 0.00 -0.92 0.00 0.00 175.35 176.60 1sos n ALA 123 N -0.89 1.74 -2.11 5.17 0.00 -1.13 -1.16 120.51 122.13 1sos n ALA 123 Ca -0.05 0.38 -0.41 0.00 0.00 0.00 0.00 53.44 53.37 1sos n ALA 123 Cb 0.64 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.70 1sos n ALA 123 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1sos s ASP 124 N 0.19 7.43 -0.08 0.00 -1.08 -1.26 -3.90 116.67 117.97 1sos s ASP 124 Ca 0.63 1.93 0.11 0.00 -0.52 0.00 0.00 52.55 54.69 1sos s ASP 124 Cb -0.56 -2.60 0.44 0.00 -1.46 0.00 0.00 42.92 38.74 1sos s ASP 124 CO 0.53 -0.09 1.27 -0.90 0.52 0.00 0.00 175.17 176.51 1sos n ASP 125 N 2.43 3.13 -1.23 -0.34 5.68 0.01 -4.92 116.55 121.30 1sos n ASP 125 Ca 0.02 -2.30 -0.09 0.00 -0.50 0.00 0.00 54.79 51.92 1sos n ASP 125 Cb 0.48 -0.47 -0.04 0.00 -1.14 0.00 0.00 41.12 39.95 1sos n ASP 125 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1sos n LEU 126 N 0.55 -0.65 0.00 -2.12 4.77 -1.26 -1.95 117.00 116.34 1sos n LEU 126 Ca 0.16 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1sos n LEU 126 Cb 0.61 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1sos n LEU 126 CO 0.15 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.33 1sos n GLY 127 N -0.15 1.66 1.47 -0.72 0.00 -1.25 -3.51 105.19 102.69 1sos n GLY 127 Ca -0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.01 1sos n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sos n LYS 128 N -2.00 3.51 0.13 1.61 5.02 -0.82 -4.32 118.16 121.29 1sos n LYS 128 Ca 0.00 -2.53 0.13 0.00 -2.02 0.00 0.00 58.31 53.88 1sos n LYS 128 Cb 0.00 -1.86 0.42 0.00 -0.02 0.00 0.00 35.03 33.57 1sos n LYS 128 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1sos h GLY 129 N 4.37 0.00 -3.88 0.72 0.00 -1.89 -3.48 103.07 98.90 1sos h GLY 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1sos h GLY 129 CO 0.23 0.00 -0.17 0.61 0.00 0.00 0.00 176.54 177.21 1sos n GLY 130 N 0.90 -0.90 0.00 4.60 0.00 -1.26 -4.97 105.19 103.56 1sos n GLY 130 Ca 0.04 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1sos n GLY 130 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1sos n ASN 131 N -0.53 0.00 -0.26 1.61 0.23 -1.26 -4.94 115.26 110.11 1sos n ASN 131 Ca 0.04 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.16 1sos n ASN 131 Cb 0.22 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.11 1sos n ASN 131 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1sos h GLU 132 N 0.00 0.27 -0.30 -3.83 4.81 -2.00 -2.51 114.58 111.01 1sos h GLU 132 Ca 0.00 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1sos h GLU 132 Cb 0.00 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.26 1sos h GLU 132 CO 0.00 0.18 -0.10 0.93 -0.73 0.00 0.00 179.01 179.29 1sos h GLU 133 N 0.28 -0.04 -0.98 1.92 4.39 -1.99 -2.12 114.58 116.05 1sos h GLU 133 Ca 0.43 0.00 0.23 0.00 0.34 0.00 0.00 59.36 60.37 1sos h GLU 133 Cb 0.76 0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.33 1sos h GLU 133 CO -0.52 -0.02 0.63 1.03 -1.16 0.00 0.00 179.01 178.97 1sos h SER 134 N -0.04 0.47 0.54 1.42 0.87 -1.79 0.13 113.55 115.15 1sos h SER 134 Ca 0.15 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1sos h SER 134 Cb 0.27 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1sos h SER 134 CO -0.33 0.15 -0.57 0.35 -0.53 0.00 0.00 176.83 175.89 1sos n THR 135 N -4.58 0.06 -0.05 2.23 -2.24 -0.83 -2.35 114.28 106.52 1sos n THR 135 Ca 0.22 -0.06 -0.03 0.00 -2.27 0.00 0.00 64.05 61.92 1sos n THR 135 Cb 0.76 0.21 -0.01 0.00 -2.10 0.00 0.00 70.33 69.19 1sos n THR 135 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1sos h LYS 136 N 0.00 0.00 0.00 -0.78 1.57 -0.42 0.25 116.57 117.19 1sos h LYS 136 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1sos h LYS 136 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1sos h LYS 136 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.13 1sos n THR 137 N -3.80 0.00 -2.13 -0.16 -2.24 0.08 -4.50 114.28 101.53 1sos n THR 137 Ca -0.04 -0.47 -0.20 0.00 -2.27 0.00 0.00 64.05 61.08 1sos n THR 137 Cb 0.16 1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 1sos n THR 137 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sos n GLY 138 N 0.16 0.28 3.28 3.38 0.00 -0.99 -3.47 105.19 107.83 1sos n GLY 138 Ca 0.00 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 1sos n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sos n ASN 139 N -1.57 -4.92 -0.01 1.61 3.02 -1.26 -0.81 115.26 111.31 1sos n ASN 139 Ca -0.22 -0.39 0.14 0.00 -0.03 0.00 0.00 54.58 54.08 1sos n ASN 139 Cb 0.67 -4.00 0.64 0.00 -0.61 0.00 0.00 39.78 36.48 1sos n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sos n ALA 140 N -3.70 2.49 -0.26 5.41 0.00 -1.23 -4.65 120.51 118.57 1sos n ALA 140 Ca -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1sos n ALA 140 Cb 0.57 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1sos n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sos n GLY 141 N 1.41 0.01 3.76 0.00 0.00 -1.26 -0.90 105.19 108.20 1sos n GLY 141 Ca 0.10 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1sos n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sos s SER 142 N -4.00 5.47 -0.39 1.61 0.01 -1.26 -4.54 113.70 110.60 1sos s SER 142 Ca 0.00 2.44 -0.29 0.00 1.31 0.00 0.00 55.95 59.41 1sos s SER 142 Cb 0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.65 1sos s SER 142 CO 0.00 -1.40 1.10 -0.13 0.41 0.00 0.00 173.24 173.21 1sos s ARG 143 N -3.08 3.90 -0.07 12.44 0.52 -1.26 0.20 118.95 131.60 1sos s ARG 143 Ca 0.73 0.82 -0.10 0.00 -0.52 0.00 0.00 55.73 56.65 1sos s ARG 143 Cb -0.32 -3.82 -0.30 0.00 0.52 0.00 0.00 34.95 31.04 1sos s ARG 143 CO 0.36 -1.13 0.59 -0.07 0.02 0.00 0.00 175.30 175.08 1sos h LEU 144 N 10.61 0.58 -7.99 2.53 3.38 -0.91 -3.47 115.31 120.04 1sos h LEU 144 Ca -0.22 -0.95 -0.11 0.00 0.09 0.00 0.00 57.88 56.69 1sos h LEU 144 Cb 1.06 -0.19 -0.16 0.00 0.09 0.00 0.00 40.66 41.47 1sos h LEU 144 CO 1.08 1.81 -0.53 0.00 0.09 0.00 0.00 178.44 180.88 1sos s ALA 145 N -2.57 0.08 0.13 1.53 0.00 -1.18 -4.06 121.76 115.68 1sos s ALA 145 Ca -0.18 -0.79 -0.24 0.00 0.00 0.00 0.00 51.96 50.76 1sos s ALA 145 Cb 0.06 0.32 0.08 0.00 0.00 0.00 0.00 23.12 23.57 1sos s ALA 145 CO 0.83 -0.39 0.67 0.00 0.00 0.00 0.00 175.76 176.87 1sos s GLY 147 N -2.70 -0.56 0.16 0.00 0.00 -0.19 -3.07 107.32 100.96 1sos s GLY 147 Ca 0.02 1.36 -0.30 0.00 0.00 0.00 0.00 44.72 45.80 1sos s GLY 147 CO -0.11 1.01 1.07 0.14 0.00 0.00 0.00 173.10 175.20 1sos s VAL 148 N -1.02 4.01 -0.15 1.40 1.01 -1.26 -0.27 120.40 124.12 1sos s VAL 148 Ca -0.10 1.73 -0.24 0.00 0.00 0.00 0.00 61.98 63.37 1sos s VAL 148 Cb -0.01 -4.10 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 1sos s VAL 148 CO 0.09 0.29 0.78 -0.63 0.00 0.00 0.00 175.10 175.63 1sos s ILE 149 N -0.20 4.94 0.22 2.22 1.01 0.20 -4.40 121.20 125.19 1sos s ILE 149 Ca 0.49 1.54 0.06 0.00 0.00 0.00 0.00 60.65 62.73 1sos s ILE 149 Cb -0.28 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 1sos s ILE 149 CO 0.34 0.09 -0.09 -0.83 0.00 0.00 0.00 174.94 174.45 1sos s GLY 150 N 1.09 1.52 0.49 6.18 0.00 0.17 -0.61 107.32 116.14 1sos s GLY 150 Ca 0.37 -1.73 -0.22 0.00 0.00 0.00 0.00 44.72 43.14 1sos s GLY 150 CO 0.14 -1.74 1.21 -0.42 0.00 0.00 0.00 173.10 172.28 1sos s ILE 151 N -3.12 2.87 0.13 0.90 1.01 -1.26 -0.46 121.20 121.26 1sos s ILE 151 Ca 0.25 0.64 -0.02 0.00 0.00 0.00 0.00 60.65 61.52 1sos s ILE 151 Cb 0.02 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 1sos s ILE 151 CO 0.08 -0.02 0.08 0.00 0.00 0.00 0.00 174.94 175.08 1sos s ALA 152 N -1.50 0.68 -2.13 9.38 0.00 -0.03 -4.66 121.76 123.50 1sos s ALA 152 Ca 0.66 -1.34 0.17 0.00 0.00 0.00 0.00 51.96 51.45 1sos s ALA 152 Cb -0.31 0.79 0.13 0.00 0.00 0.00 0.00 23.12 23.74 1sos s ALA 152 CO 0.37 -0.50 1.04 0.00 0.00 0.00 0.00 175.76 176.67