#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sos n THR 2 N 0.00 0.06 -4.02 0.00 -1.04 -1.26 -4.74 114.28 103.28 1sos n THR 2 Ca 0.00 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.05 61.85 1sos n THR 2 Cb 0.00 -0.84 -0.13 0.00 -1.82 0.00 0.00 70.33 67.54 1sos n THR 2 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1sos s LYS 3 N -2.02 0.27 0.23 -2.82 1.02 -1.26 -0.69 119.74 114.48 1sos s LYS 3 Ca -0.01 -0.26 0.00 0.00 0.02 0.00 0.00 55.97 55.73 1sos s LYS 3 Cb 0.00 -0.18 -0.04 0.00 -0.52 0.00 0.00 37.83 37.09 1sos s LYS 3 CO 0.03 0.04 0.13 0.00 -0.92 0.00 0.00 175.35 174.63 1sos s ALA 4 N -0.44 1.44 0.03 5.17 0.00 -0.24 -1.31 121.76 126.41 1sos s ALA 4 Ca -0.03 -1.77 -0.16 0.00 0.00 0.00 0.00 51.96 50.00 1sos s ALA 4 Cb -0.04 1.27 0.03 0.00 0.00 0.00 0.00 23.12 24.39 1sos s ALA 4 CO -0.00 -0.55 0.36 0.54 0.00 0.00 0.00 175.76 176.11 1sos s VAL 5 N -3.96 0.06 -0.07 0.00 0.11 -0.65 -1.65 120.40 114.25 1sos s VAL 5 Ca 0.38 -0.53 -0.03 0.00 -2.93 0.00 0.00 61.98 58.87 1sos s VAL 5 Cb 0.07 -0.89 0.04 0.00 -1.53 0.00 0.00 36.38 34.07 1sos s VAL 5 CO 0.14 -0.29 0.14 0.00 -3.33 0.00 0.00 175.10 171.75 1sos s ALA 6 N -2.27 -0.12 -0.24 1.54 0.00 -0.53 -1.49 121.76 118.65 1sos s ALA 6 Ca -0.07 0.53 -0.17 0.00 0.00 0.00 0.00 51.96 52.25 1sos s ALA 6 Cb -0.02 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1sos s ALA 6 CO -0.01 -0.43 0.45 0.54 0.00 0.00 0.00 175.76 176.30 1sos s VAL 7 N 1.95 5.13 -0.03 0.00 0.11 -1.26 -1.18 120.40 125.12 1sos s VAL 7 Ca -0.00 0.77 -0.16 0.00 -2.93 0.00 0.00 61.98 59.65 1sos s VAL 7 Cb -0.12 -3.77 -0.05 0.00 -1.53 0.00 0.00 36.38 30.90 1sos s VAL 7 CO -0.05 0.15 0.45 -0.76 -3.33 0.00 0.00 175.10 171.56 1sos s LEU 8 N 1.94 4.41 0.06 2.54 1.43 -0.04 -4.08 118.68 124.95 1sos s LEU 8 Ca 0.19 0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 54.21 1sos s LEU 8 Cb -0.15 -2.66 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 1sos s LEU 8 CO 0.09 0.21 0.04 -0.54 0.23 0.00 0.00 176.35 176.38 1sos s LYS 9 N -0.51 0.65 0.00 1.70 -0.14 -0.69 -3.04 119.74 117.70 1sos s LYS 9 Ca 0.25 -1.06 0.00 0.00 -1.36 0.00 0.00 55.97 53.80 1sos s LYS 9 Cb -0.16 0.24 0.00 0.00 -1.68 0.00 0.00 37.83 36.22 1sos s LYS 9 CO 0.13 -0.15 0.00 0.41 -0.76 0.00 0.00 175.35 174.98 1sos n GLY 10 N 0.25 4.23 1.58 -3.33 0.00 -1.25 -1.80 105.19 104.87 1sos n GLY 10 Ca -0.16 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 1sos n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sos n ASP 11 N 0.00 3.56 -0.18 1.61 8.00 -1.26 -4.98 116.55 123.30 1sos n ASP 11 Ca 0.00 -3.76 0.00 0.00 0.71 0.00 0.00 54.79 51.74 1sos n ASP 11 Cb 0.00 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.42 1sos n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sos n GLY 12 N -1.06 5.16 0.04 0.44 0.00 -1.26 -5.04 105.19 103.46 1sos n GLY 12 Ca 0.43 -1.51 0.14 0.00 0.00 0.00 0.00 46.02 45.08 1sos n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1sos n PRO 13 N 0.00 0.47 -2.77 1.61 -0.04 -1.26 -4.90 135.00 128.11 1sos n PRO 13 Ca 0.00 -0.08 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 1sos n PRO 13 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1sos n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1sos s VAL 14 N -2.59 4.84 -0.12 0.52 1.01 -1.26 -4.38 120.40 118.43 1sos s VAL 14 Ca 0.27 1.96 -0.30 0.00 0.00 0.00 0.00 61.98 63.91 1sos s VAL 14 Cb 0.20 -4.27 0.10 0.00 0.00 0.00 0.00 36.38 32.40 1sos s VAL 14 CO 0.48 0.20 0.83 0.00 0.00 0.00 0.00 175.10 176.61 1sos s GLN 15 N 0.81 0.83 -0.00 2.72 -2.07 -0.58 -3.95 119.66 117.42 1sos s GLN 15 Ca 0.49 0.28 -0.29 0.00 -1.82 0.00 0.00 55.36 54.02 1sos s GLN 15 Cb -0.21 0.39 0.11 0.00 -1.09 0.00 0.00 33.01 32.21 1sos s GLN 15 CO 0.27 -0.24 1.27 0.20 -1.32 0.00 0.00 175.29 175.46 1sos s GLY 16 N -0.98 -0.26 -0.07 2.60 0.00 -1.17 -0.30 107.32 107.14 1sos s GLY 16 Ca -0.06 0.34 0.04 0.00 0.00 0.00 0.00 44.72 45.04 1sos s GLY 16 CO 0.05 2.57 -0.19 -0.42 0.00 0.00 0.00 173.10 175.11 1sos s ILE 17 N -2.25 1.66 -0.03 0.90 1.01 -0.93 -0.86 121.20 120.71 1sos s ILE 17 Ca 0.21 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 60.12 1sos s ILE 17 Cb 0.02 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 1sos s ILE 17 CO -0.02 0.47 -0.20 -0.63 0.00 0.00 0.00 174.94 174.56 1sos s ILE 18 N 0.33 1.64 0.09 2.92 -1.09 -0.32 -2.37 121.20 122.40 1sos s ILE 18 Ca -0.13 -0.87 0.09 0.00 -2.23 0.00 0.00 60.65 57.51 1sos s ILE 18 Cb -0.16 -1.38 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 1sos s ILE 18 CO 0.06 0.46 -0.21 0.20 -1.23 0.00 0.00 174.94 174.22 1sos s ASN 19 N -0.33 3.68 0.00 3.58 -0.87 0.12 -1.46 114.94 119.66 1sos s ASN 19 Ca 0.04 -0.57 0.05 0.00 -1.57 0.00 0.00 52.86 50.81 1sos s ASN 19 Cb -0.09 -0.47 -0.01 0.00 -0.02 0.00 0.00 41.25 40.65 1sos s ASN 19 CO 0.00 0.21 -0.15 -0.36 -2.57 0.00 0.00 177.10 174.23 1sos s PHE 20 N -1.04 1.34 -0.16 2.20 0.40 -0.66 -1.11 117.98 118.95 1sos s PHE 20 Ca 0.16 -0.27 -0.08 0.00 -0.60 0.00 0.00 56.93 56.13 1sos s PHE 20 Cb -0.10 -0.84 0.06 0.00 0.51 0.00 0.00 43.02 42.64 1sos s PHE 20 CO 0.07 -0.01 0.39 -2.00 0.70 0.00 0.00 175.22 174.37 1sos s GLU 21 N -0.53 0.36 -0.16 0.44 2.12 0.01 -1.08 118.70 119.86 1sos s GLU 21 Ca 0.05 0.77 -0.02 0.00 0.36 0.00 0.00 54.97 56.13 1sos s GLU 21 Cb -0.06 -0.01 0.05 0.00 0.26 0.00 0.00 34.13 34.37 1sos s GLU 21 CO -0.00 -0.17 0.02 -1.14 -0.54 0.00 0.00 175.26 173.43 1sos s GLN 22 N 1.50 0.70 0.08 4.30 0.74 0.14 -0.48 119.66 126.63 1sos s GLN 22 Ca -0.09 -0.30 0.22 0.00 0.05 0.00 0.00 55.36 55.25 1sos s GLN 22 Cb -0.09 -1.83 -0.14 0.00 1.10 0.00 0.00 33.01 32.05 1sos s GLN 22 CO -0.12 -0.55 0.80 1.63 -0.55 0.00 0.00 175.29 176.51 1sos n LYS 23 N 5.06 0.56 -5.10 1.67 4.76 -1.26 -4.48 118.16 119.37 1sos n LYS 23 Ca -0.09 -0.04 -0.29 0.00 -2.87 0.00 0.00 58.31 55.03 1sos n LYS 23 Cb 0.48 -1.65 -0.16 0.00 -1.84 0.00 0.00 35.03 31.86 1sos n LYS 23 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1sos s GLU 24 N -3.39 1.92 0.00 1.97 -6.30 -1.26 -5.01 118.70 106.62 1sos s GLU 24 Ca -0.03 -0.79 0.09 0.00 -2.50 0.00 0.00 54.97 51.74 1sos s GLU 24 Cb 0.12 -1.79 0.38 0.00 0.00 0.00 0.00 34.13 32.84 1sos s GLU 24 CO 0.84 0.44 1.26 -1.13 0.02 0.00 0.00 175.26 176.70 1sos n SER 25 N 2.66 0.00 -3.19 -1.70 3.41 -1.26 -2.36 113.62 111.18 1sos n SER 25 Ca -0.16 0.46 -0.22 0.00 -0.26 0.00 0.00 58.87 58.69 1sos n SER 25 Cb 0.52 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.47 0.78 -4.00 4.04 0.23 -1.26 -4.88 115.26 108.70 1sos n ASN 26 Ca 0.02 -2.90 -0.11 0.00 -0.53 0.00 0.00 54.58 51.07 1sos n ASN 26 Cb 0.10 -0.63 -0.07 0.00 -2.08 0.00 0.00 39.78 37.10 1sos n ASN 26 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1sos s GLY 27 N -1.85 0.97 0.54 4.83 0.00 -0.99 -5.16 107.32 105.66 1sos s GLY 27 Ca 0.38 -1.25 -0.16 0.00 0.00 0.00 0.00 44.72 43.69 1sos s GLY 27 CO -0.09 -0.95 1.00 2.56 0.00 0.00 0.00 173.10 175.62 1sos s PRO 28 N -3.98 3.79 -0.29 2.90 0.04 -1.26 -4.88 135.00 131.31 1sos s PRO 28 Ca 0.29 0.98 -0.07 0.00 0.04 0.00 0.00 61.00 62.25 1sos s PRO 28 Cb 0.02 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1sos s PRO 28 CO 0.11 -0.41 0.08 0.08 0.04 0.00 0.00 177.00 176.90 1sos s VAL 29 N -2.65 4.04 -0.20 -0.36 1.01 0.16 -4.49 120.40 117.92 1sos s VAL 29 Ca 0.59 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.69 1sos s VAL 29 Cb -0.11 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 1sos s VAL 29 CO 0.35 0.13 1.43 -0.54 0.00 0.00 0.00 175.10 176.46 1sos s LYS 30 N 1.52 4.03 -0.20 2.72 -0.14 0.37 -1.22 119.74 126.82 1sos s LYS 30 Ca 0.03 1.64 -0.05 0.00 -1.36 0.00 0.00 55.97 56.23 1sos s LYS 30 Cb -0.17 -3.90 -0.03 0.00 -1.68 0.00 0.00 37.83 32.06 1sos s LYS 30 CO 0.03 -0.99 0.00 0.54 -0.76 0.00 0.00 175.35 174.17 1sos s VAL 31 N 4.27 4.02 0.12 3.17 0.11 -0.23 -0.81 120.40 131.04 1sos s VAL 31 Ca 0.62 -0.29 -0.05 0.00 -2.93 0.00 0.00 61.98 59.33 1sos s VAL 31 Cb -0.23 -2.82 -0.02 0.00 -1.53 0.00 0.00 36.38 31.78 1sos s VAL 31 CO 0.23 0.43 0.14 -1.66 -3.33 0.00 0.00 175.10 170.91 1sos s TRP 32 N 0.94 0.49 -4.31 1.54 -2.14 -0.26 -0.56 118.94 114.63 1sos s TRP 32 Ca 0.01 -0.90 0.00 0.00 2.66 0.00 0.00 56.10 57.87 1sos s TRP 32 Cb -0.14 -0.23 0.00 0.00 -3.10 0.00 0.00 33.47 29.99 1sos s TRP 32 CO 0.02 -0.56 0.00 0.41 -2.66 0.00 0.00 176.95 174.16 1sos n GLY 33 N -0.08 -1.36 3.32 3.67 0.00 -1.11 0.13 105.19 109.75 1sos n GLY 33 Ca -0.10 -1.17 -0.26 0.00 0.00 0.00 0.00 46.02 44.49 1sos n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1sos s SER 34 N -4.00 2.85 0.01 1.61 0.15 -1.00 -0.06 113.70 113.26 1sos s SER 34 Ca 0.00 -0.68 0.04 0.00 0.70 0.00 0.00 55.95 56.01 1sos s SER 34 Cb 0.00 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 64.11 1sos s SER 34 CO 0.00 0.13 -0.13 -0.63 1.20 0.00 0.00 173.24 173.82 1sos s ILE 35 N -1.04 0.99 0.27 6.45 1.01 -0.32 -2.18 121.20 126.37 1sos s ILE 35 Ca 0.10 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1sos s ILE 35 Cb -0.10 -0.85 -0.06 0.00 0.01 0.00 0.00 42.46 41.46 1sos s ILE 35 CO 0.04 0.17 -0.02 -1.59 0.00 0.00 0.00 174.94 173.54 1sos s LYS 36 N -0.57 1.49 -0.49 2.79 -2.85 0.59 -1.04 119.74 119.65 1sos s LYS 36 Ca 0.03 -1.76 0.00 0.00 -1.00 0.00 0.00 55.97 53.24 1sos s LYS 36 Cb -0.06 -0.93 0.00 0.00 -2.06 0.00 0.00 37.83 34.78 1sos s LYS 36 CO 0.00 -0.04 0.00 0.41 0.10 0.00 0.00 175.35 175.82 1sos n GLY 37 N -0.54 0.33 3.93 0.59 0.00 -0.95 -1.53 105.19 107.02 1sos n GLY 37 Ca -0.05 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.46 4.35 0.52 0.99 2.01 0.17 -4.38 118.68 120.88 1sos s LEU 38 Ca 0.00 0.26 -0.20 0.00 0.01 0.00 0.00 54.13 54.20 1sos s LEU 38 Cb 0.00 -2.96 -0.07 0.00 0.01 0.00 0.00 46.19 43.17 1sos s LEU 38 CO 0.00 0.14 1.11 0.42 1.01 0.00 0.00 176.35 179.02 1sos s THR 39 N -1.57 3.33 0.26 5.49 -4.23 -1.26 -3.83 115.64 113.83 1sos s THR 39 Ca 0.35 0.84 -0.31 0.00 -1.18 0.00 0.00 61.69 61.39 1sos s THR 39 Cb -0.12 -3.34 -0.12 0.00 1.34 0.00 0.00 72.50 70.26 1sos s THR 39 CO 0.28 -0.17 1.64 -0.70 -0.54 0.00 0.00 174.62 175.13 1sos s GLU 40 N -3.24 4.12 0.00 3.99 2.12 -1.26 -4.65 118.70 119.78 1sos s GLU 40 Ca 0.71 2.59 0.00 0.00 0.36 0.00 0.00 54.97 58.63 1sos s GLU 40 Cb -0.22 -3.04 0.00 0.00 0.26 0.00 0.00 34.13 31.13 1sos s GLU 40 CO 0.25 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.71 1sos n GLY 41 N 2.79 0.42 3.79 -1.50 0.00 -0.51 -4.93 105.19 105.24 1sos n GLY 41 Ca 0.11 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 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 4.53 -0.15 0.99 1.02 -1.26 -1.26 118.68 122.54 1sos s LEU 42 Ca 0.00 1.51 -0.05 0.00 0.02 0.00 0.00 54.13 55.61 1sos s LEU 42 Cb 0.00 -3.27 0.08 0.00 0.02 0.00 0.00 46.19 43.02 1sos s LEU 42 CO 0.00 0.19 0.30 -1.00 0.02 0.00 0.00 176.35 175.86 1sos s HIS 43 N -1.22 -0.51 -0.14 0.29 3.76 -0.86 -2.77 115.29 113.84 1sos s HIS 43 Ca 0.36 1.02 -0.38 0.00 -0.15 0.00 0.00 55.06 55.91 1sos s HIS 43 Cb -0.21 0.01 -0.15 0.00 1.11 0.00 0.00 32.58 33.35 1sos s HIS 43 CO 0.24 -0.42 1.71 0.41 -0.85 0.00 0.00 174.74 175.83 1sos n GLY 44 N 5.36 0.98 3.29 -2.22 0.00 0.13 -0.94 105.19 111.80 1sos n GLY 44 Ca -0.06 0.86 -0.36 0.00 0.00 0.00 0.00 46.02 46.45 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 3.05 3.12 0.12 1.61 5.36 0.38 -1.12 117.98 130.51 1sos s PHE 45 Ca 0.93 -1.18 -0.03 0.00 -0.96 0.00 0.00 56.93 55.70 1sos s PHE 45 Cb -0.92 -2.19 -0.03 0.00 -0.34 0.00 0.00 43.02 39.54 1sos s PHE 45 CO 0.57 -0.63 0.09 -1.01 -1.46 0.00 0.00 175.22 172.78 1sos s HIS 46 N 1.44 0.71 -0.13 10.12 3.76 -0.81 -2.92 115.29 127.46 1sos s HIS 46 Ca 0.02 -1.11 -0.02 0.00 -0.15 0.00 0.00 55.06 53.80 1sos s HIS 46 Cb -0.17 -0.38 -0.02 0.00 1.11 0.00 0.00 32.58 33.11 1sos s HIS 46 CO 0.00 -0.54 -0.07 0.08 -0.85 0.00 0.00 174.74 173.37 1sos s VAL 47 N -4.01 3.61 0.21 -0.90 1.01 0.42 -1.09 120.40 119.65 1sos s VAL 47 Ca 0.20 -0.47 0.09 0.00 0.00 0.00 0.00 61.98 61.80 1sos s VAL 47 Cb 0.07 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1sos s VAL 47 CO -0.01 0.52 -0.06 -1.00 0.00 0.00 0.00 175.10 174.56 1sos s HIS 48 N 0.19 2.67 0.35 5.22 3.76 0.44 -2.18 115.29 125.74 1sos s HIS 48 Ca -0.04 -0.21 0.04 0.00 -0.15 0.00 0.00 55.06 54.70 1sos s HIS 48 Cb -0.14 -1.26 0.68 0.00 1.11 0.00 0.00 32.58 32.96 1sos s HIS 48 CO 0.04 0.55 1.97 1.49 -0.85 0.00 0.00 174.74 177.94 1sos h GLU 49 N 2.53 0.80 -6.57 1.40 4.81 -0.50 -2.76 114.58 114.30 1sos h GLU 49 Ca -0.46 -0.05 -0.65 0.00 -0.13 0.00 0.00 59.36 58.07 1sos h GLU 49 Cb 1.22 -0.18 -0.25 0.00 0.63 0.00 0.00 28.75 30.17 1sos h GLU 49 CO 0.57 0.53 -0.86 -0.06 -0.73 0.00 0.00 179.01 178.46 1sos s PHE 50 N -5.72 2.14 -0.29 0.92 0.08 0.76 -4.68 117.98 111.19 1sos s PHE 50 Ca -0.10 -0.40 -0.00 0.00 0.12 0.00 0.00 56.93 56.55 1sos s PHE 50 Cb 0.19 -1.23 0.24 0.00 -0.57 0.00 0.00 43.02 41.65 1sos s PHE 50 CO 0.77 0.19 1.87 0.41 -0.10 0.00 0.00 175.22 178.36 1sos n GLY 51 N 1.47 3.88 3.39 4.36 0.00 -1.02 -3.22 105.19 114.05 1sos n GLY 51 Ca -0.18 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 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 0.11 6.06 -0.32 1.61 -1.08 -1.26 -4.93 116.67 116.85 1sos s ASP 52 Ca 0.30 -1.22 0.07 0.00 -0.52 0.00 0.00 52.55 51.18 1sos s ASP 52 Cb 0.24 -2.15 0.48 0.00 -1.46 0.00 0.00 42.92 40.04 1sos s ASP 52 CO 0.01 -0.57 1.44 0.59 0.52 0.00 0.00 175.17 177.16 1sos n ASN 53 N 5.15 3.50 0.01 -0.34 5.03 -1.26 -2.51 115.26 124.83 1sos n ASN 53 Ca -0.12 -3.80 -0.18 0.00 0.87 0.00 0.00 54.58 51.35 1sos n ASN 53 Cb 0.45 -0.59 -0.10 0.00 -1.02 0.00 0.00 39.78 38.52 1sos n ASN 53 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1sos h THR 54 N 1.28 1.33 -0.55 3.41 1.35 -1.93 -2.28 112.91 115.52 1sos h THR 54 Ca 0.28 -2.08 -0.35 0.00 -0.55 0.00 0.00 66.41 63.71 1sos h THR 54 Cb 1.49 2.32 -0.16 0.00 -1.73 0.00 0.00 68.15 70.06 1sos h THR 54 CO 0.57 0.64 0.45 0.00 -0.25 0.00 0.00 175.52 176.92 1sos n ALA 55 N -2.61 4.96 -0.64 6.62 0.00 -1.26 -5.03 120.51 122.55 1sos n ALA 55 Ca -0.10 -1.81 0.00 0.00 0.00 0.00 0.00 53.44 51.53 1sos n ALA 55 Cb 0.76 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.00 0.46 0.29 0.00 0.00 -0.86 -3.62 105.19 101.46 1sos n GLY 56 Ca 0.34 -0.81 0.17 0.00 0.00 0.00 0.00 46.02 45.72 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 1.21 0.00 0.00 2.02 -1.90 -2.15 112.91 112.10 1sos h THR 58 Ca -0.00 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1sos h THR 58 Cb 0.39 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1sos h THR 58 CO 0.00 0.24 0.00 -1.54 0.37 0.00 0.00 175.52 174.60 1sos n SER 59 N -4.36 0.00 0.29 4.18 3.41 -1.10 -2.72 113.62 113.31 1sos n SER 59 Ca 0.07 -0.79 0.18 0.00 -0.26 0.00 0.00 58.87 58.07 1sos n SER 59 Cb 0.10 -0.04 0.97 0.00 -0.26 0.00 0.00 64.21 64.99 1sos n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sos h ALA 60 N 3.73 1.44 0.00 7.33 0.00 -1.08 -3.40 119.26 127.28 1sos h ALA 60 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sos h ALA 60 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1sos h ALA 60 CO 0.00 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.52 1sos n GLY 61 N -1.26 -1.81 0.88 0.00 0.00 -1.10 -0.17 105.19 101.73 1sos n GLY 61 Ca -0.01 -1.72 -0.07 0.00 0.00 0.00 0.00 46.02 44.21 1sos n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1sos n PRO 62 N 0.00 -0.90 -2.41 1.61 -0.04 -1.26 -4.66 135.00 127.34 1sos n PRO 62 Ca 0.00 -0.46 -0.41 0.00 -0.04 0.00 0.00 63.50 62.60 1sos n PRO 62 Cb 0.00 -0.36 -0.04 0.00 -0.04 0.00 0.00 33.50 33.06 1sos n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1sos s HIS 63 N -1.59 3.48 -0.00 0.54 3.76 -1.26 -0.38 115.29 119.84 1sos s HIS 63 Ca 0.18 1.58 -0.30 0.00 -0.15 0.00 0.00 55.06 56.36 1sos s HIS 63 Cb -0.01 -3.37 -0.09 0.00 1.11 0.00 0.00 32.58 30.22 1sos s HIS 63 CO 0.13 -0.89 2.00 0.34 -0.85 0.00 0.00 174.74 175.46 1sos n PHE 64 N 1.64 2.44 -3.14 1.40 7.35 -0.93 -4.53 117.46 121.69 1sos n PHE 64 Ca 0.01 -0.32 -0.20 0.00 -0.76 0.00 0.00 57.45 56.18 1sos n PHE 64 Cb 0.44 -2.78 -0.03 0.00 0.35 0.00 0.00 39.48 37.46 1sos n PHE 64 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1sos n ASN 65 N 7.88 1.58 0.10 -2.13 5.15 -1.26 -2.33 115.26 124.24 1sos n ASN 65 Ca 0.21 -3.14 0.08 0.00 -0.60 0.00 0.00 54.58 51.13 1sos n ASN 65 Cb 0.40 -0.61 0.38 0.00 -0.53 0.00 0.00 39.78 39.43 1sos n ASN 65 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1sos n PRO 66 N 0.21 0.10 -0.39 1.20 -0.04 -1.26 -1.72 135.00 133.09 1sos n PRO 66 Ca 0.26 0.52 0.08 0.00 -0.04 0.00 0.00 63.50 64.32 1sos n PRO 66 Cb 0.60 -1.77 0.24 0.00 -0.04 0.00 0.00 33.50 32.53 1sos n PRO 66 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1sos n LEU 67 N -1.97 3.72 -4.11 1.53 4.77 -1.26 -5.00 117.00 114.68 1sos n LEU 67 Ca 0.00 -2.70 -0.45 0.00 -0.03 0.00 0.00 56.01 52.83 1sos n LEU 67 Cb 0.07 -0.46 0.01 0.00 -2.33 0.00 0.00 43.42 40.71 1sos n LEU 67 CO 0.09 0.69 -0.20 -1.20 -1.33 0.00 0.00 177.39 175.45 1sos n SER 68 N -0.11 -3.47 -1.56 -1.43 7.64 -0.70 -4.97 113.62 109.02 1sos n SER 68 Ca 0.19 -1.29 0.00 0.00 1.01 0.00 0.00 58.87 58.78 1sos n SER 68 Cb 0.77 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1sos n SER 68 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1sos n ARG 69 N -4.97 1.73 -4.27 1.43 5.12 -1.26 -5.14 116.66 109.30 1sos n ARG 69 Ca -0.13 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.55 1sos n ARG 69 Cb 0.56 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.79 1sos n ARG 69 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1sos s LYS 70 N -1.04 2.22 0.37 5.56 1.02 -1.26 -4.84 119.74 121.76 1sos s LYS 70 Ca 0.00 -1.55 -0.27 0.00 0.02 0.00 0.00 55.97 54.17 1sos s LYS 70 Cb 0.00 -2.08 -0.12 0.00 -0.52 0.00 0.00 37.83 35.11 1sos s LYS 70 CO 0.00 0.25 1.16 1.58 -0.92 0.00 0.00 175.35 177.42 1sos n HIS 71 N -0.95 1.76 -3.39 3.18 -0.00 -0.30 -2.27 115.22 113.25 1sos n HIS 71 Ca -0.05 0.57 -0.04 0.00 -0.00 0.00 0.00 57.72 58.21 1sos n HIS 71 Cb 0.60 -2.33 0.01 0.00 -0.00 0.00 0.00 29.99 28.27 1sos n HIS 71 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1sos n GLY 72 N 0.98 1.89 3.99 1.57 0.00 -1.25 -4.48 105.19 107.90 1sos n GLY 72 Ca 0.07 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.76 1.77 0.57 -0.02 0.00 -1.21 -4.65 107.32 102.02 1sos s GLY 73 Ca 0.07 -1.70 0.35 0.00 0.00 0.00 0.00 44.72 43.43 1sos s GLY 73 CO 0.05 -1.21 2.08 -0.56 0.00 0.00 0.00 173.10 173.46 1sos h PRO 74 N -0.31 0.00 -0.48 2.90 0.13 -1.86 -2.62 132.00 129.76 1sos h PRO 74 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1sos h PRO 74 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1sos h PRO 74 CO 0.43 0.04 0.00 1.63 -0.23 0.00 0.00 178.00 179.86 1sos n LYS 75 N -3.20 2.13 -4.01 0.86 5.02 -1.26 -4.93 118.16 112.78 1sos n LYS 75 Ca -0.01 -1.70 -0.25 0.00 -2.02 0.00 0.00 58.31 54.33 1sos n LYS 75 Cb 0.25 -1.39 -0.04 0.00 -0.02 0.00 0.00 35.03 33.83 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 -0.98 5.98 0.10 4.39 1.11 -0.99 -4.98 116.67 121.30 1sos s ASP 76 Ca 0.32 0.02 -0.11 0.00 0.18 0.00 0.00 52.55 52.95 1sos s ASP 76 Cb 0.17 -1.69 -0.17 0.00 1.07 0.00 0.00 42.92 42.29 1sos s ASP 76 CO 0.21 0.04 1.25 -0.33 1.18 0.00 0.00 175.17 177.52 1sos h GLU 77 N 2.07 0.66 -4.28 8.23 5.08 -1.91 -3.39 114.58 121.03 1sos h GLU 77 Ca -0.49 -0.65 -0.74 0.00 -1.00 0.00 0.00 59.36 56.48 1sos h GLU 77 Cb 1.20 0.17 -0.23 0.00 0.50 0.00 0.00 28.75 30.40 1sos h GLU 77 CO 0.65 1.25 -0.05 -2.00 -1.00 0.00 0.00 179.01 177.86 1sos s GLU 78 N -3.42 3.09 0.00 2.33 2.56 -1.26 -4.88 118.70 117.11 1sos s GLU 78 Ca -0.09 -1.67 -0.28 0.00 0.00 0.00 0.00 54.97 52.93 1sos s GLU 78 Cb 0.08 -4.32 0.08 0.00 2.00 0.00 0.00 34.13 31.97 1sos s GLU 78 CO 0.90 -1.41 0.74 -0.98 -0.56 0.00 0.00 175.26 173.96 1sos s ARG 79 N 1.83 1.01 0.57 4.30 1.04 -0.96 -3.74 118.95 123.00 1sos s ARG 79 Ca 0.08 -0.06 -0.15 0.00 -1.04 0.00 0.00 55.73 54.56 1sos s ARG 79 Cb -0.25 0.47 -0.05 0.00 -2.04 0.00 0.00 34.95 33.08 1sos s ARG 79 CO 0.02 -0.38 1.03 -1.01 -0.04 0.00 0.00 175.30 174.92 1sos s HIS 80 N -2.23 3.23 0.35 5.89 3.76 -1.19 -4.64 115.29 120.46 1sos s HIS 80 Ca -0.04 1.47 0.04 0.00 -0.15 0.00 0.00 55.06 56.38 1sos s HIS 80 Cb -0.01 -2.89 0.67 0.00 1.11 0.00 0.00 32.58 31.46 1sos s HIS 80 CO -0.01 -0.79 1.96 0.28 -0.85 0.00 0.00 174.74 175.33 1sos h VAL 81 N 0.50 1.07 -0.08 -0.90 2.07 -1.87 -2.44 116.25 114.59 1sos h VAL 81 Ca -0.46 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1sos h VAL 81 Cb 1.20 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1sos h VAL 81 CO 0.59 0.15 0.00 0.61 0.02 0.00 0.00 177.57 178.95 1sos n GLY 82 N -1.44 -0.47 3.43 2.17 0.00 -0.98 -4.28 105.19 103.61 1sos n GLY 82 Ca 0.10 -0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.94 6.31 0.00 1.61 1.01 -0.92 -0.44 116.67 123.30 1sos s ASP 83 Ca 0.06 -1.44 0.22 0.00 0.71 0.00 0.00 52.55 52.10 1sos s ASP 83 Cb 0.03 -2.37 0.63 0.00 1.01 0.00 0.00 42.92 42.22 1sos s ASP 83 CO 0.04 -1.23 1.53 0.18 0.21 0.00 0.00 175.17 175.90 1sos n LEU 84 N 6.91 3.93 0.00 1.23 4.77 -1.15 -3.70 117.00 128.99 1sos n LEU 84 Ca 0.02 -1.98 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1sos n LEU 84 Cb 0.46 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1sos n LEU 84 CO 0.58 0.98 0.00 0.61 -1.33 0.00 0.00 177.39 178.23 1sos n GLY 85 N 1.63 0.98 3.31 -0.72 0.00 -1.24 -4.78 105.19 104.37 1sos n GLY 85 Ca 0.24 -0.73 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 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 2.41 0.29 1.61 0.01 -1.26 -0.47 114.94 113.53 1sos s ASN 86 Ca 0.00 -0.93 0.09 0.00 -0.71 0.00 0.00 52.86 51.31 1sos s ASN 86 Cb 0.00 -0.12 -0.05 0.00 0.41 0.00 0.00 41.25 41.50 1sos s ASN 86 CO 0.00 -0.14 0.01 0.68 -1.51 0.00 0.00 177.10 176.14 1sos s VAL 87 N -2.56 3.17 -0.24 1.60 -7.23 -0.12 -4.84 120.40 110.18 1sos s VAL 87 Ca 0.17 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 1sos s VAL 87 Cb -0.03 -2.83 0.04 0.00 0.56 0.00 0.00 36.38 34.12 1sos s VAL 87 CO 0.05 -0.31 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.54 1sos s THR 88 N -2.39 2.43 -0.08 5.32 2.01 -1.26 -2.03 115.64 119.64 1sos s THR 88 Ca 0.33 -1.26 -0.22 0.00 0.31 0.00 0.00 61.69 60.85 1sos s THR 88 Cb -0.04 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1sos s THR 88 CO 0.20 0.17 0.66 0.00 -0.69 0.00 0.00 174.62 174.97 1sos s ALA 89 N 1.23 3.37 1.16 7.40 0.00 -0.39 -4.26 121.76 130.27 1sos s ALA 89 Ca -0.02 0.07 -0.16 0.00 0.00 0.00 0.00 51.96 51.85 1sos s ALA 89 Cb -0.17 -2.91 0.23 0.00 0.00 0.00 0.00 23.12 20.27 1sos s ALA 89 CO -0.06 -0.10 0.89 -0.40 0.00 0.00 0.00 175.76 176.08 1sos n ASP 90 N 3.81 -1.54 0.13 0.00 5.68 -0.19 -1.43 116.55 123.01 1sos n ASP 90 Ca -0.02 -1.08 0.09 0.00 -0.50 0.00 0.00 54.79 53.28 1sos n ASP 90 Cb 0.51 -0.79 0.58 0.00 -1.14 0.00 0.00 41.12 40.28 1sos n ASP 90 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1sos h LYS 91 N 0.00 0.16 0.00 0.11 2.10 -1.95 0.29 116.57 117.29 1sos h LYS 91 Ca -0.33 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1sos h LYS 91 Cb 0.98 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.27 1sos h LYS 91 CO 0.22 0.11 0.00 -0.25 -2.00 0.00 0.00 179.45 177.52 1sos n ASP 92 N -4.50 0.00 -0.36 7.07 8.00 -1.26 -4.82 116.55 120.68 1sos n ASP 92 Ca 0.01 -1.32 -0.05 0.00 0.71 0.00 0.00 54.79 54.15 1sos n ASP 92 Cb 0.18 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.26 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 0.45 0.74 3.67 0.44 0.00 0.10 -4.72 105.19 105.87 1sos n GLY 93 Ca 0.08 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.13 4.76 -0.39 1.61 1.01 -1.25 -0.66 120.40 123.35 1sos s VAL 94 Ca 0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 1sos s VAL 94 Cb 0.00 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.34 1sos s VAL 94 CO 0.00 0.51 0.19 0.00 0.00 0.00 0.00 175.10 175.80 1sos s ALA 95 N -0.05 3.18 -0.25 5.51 0.00 -0.21 -1.02 121.76 128.92 1sos s ALA 95 Ca 0.06 -2.07 -0.25 0.00 0.00 0.00 0.00 51.96 49.70 1sos s ALA 95 Cb -0.12 -2.47 -0.00 0.00 0.00 0.00 0.00 23.12 20.53 1sos s ALA 95 CO 0.01 -1.56 0.85 -0.51 0.00 0.00 0.00 175.76 174.55 1sos s ASP 96 N 1.83 6.84 0.01 0.00 1.01 -1.26 -1.17 116.67 123.93 1sos s ASP 96 Ca 0.02 1.03 0.00 0.00 0.71 0.00 0.00 52.55 54.31 1sos s ASP 96 Cb -0.22 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 1sos s ASP 96 CO 0.01 -0.55 0.08 0.68 0.21 0.00 0.00 175.17 175.60 1sos s VAL 97 N 2.91 4.67 -0.09 -1.27 -7.23 0.92 -4.84 120.40 115.48 1sos s VAL 97 Ca 0.36 -0.47 -0.01 0.00 -1.81 0.00 0.00 61.98 60.05 1sos s VAL 97 Cb -0.15 -3.15 0.03 0.00 0.56 0.00 0.00 36.38 33.67 1sos s VAL 97 CO 0.08 0.32 -0.01 -0.44 -0.31 0.00 0.00 175.10 174.74 1sos s SER 98 N -1.82 1.77 0.01 4.85 0.01 -1.26 -2.75 113.70 114.50 1sos s SER 98 Ca 0.24 -0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.34 1sos s SER 98 Cb -0.12 -0.51 -0.01 0.00 0.21 0.00 0.00 66.02 65.60 1sos s SER 98 CO 0.15 -0.19 -0.05 -0.63 0.41 0.00 0.00 173.24 172.92 1sos s ILE 99 N 1.93 0.40 -0.13 1.44 1.01 0.27 -4.98 121.20 121.15 1sos s ILE 99 Ca 0.05 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.32 1sos s ILE 99 Cb -0.13 -0.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.96 1sos s ILE 99 CO -0.06 -0.00 -0.17 -0.70 0.00 0.00 0.00 174.94 174.01 1sos s GLU 100 N -0.43 3.23 0.04 2.79 2.12 -1.26 -1.06 118.70 124.12 1sos s GLU 100 Ca -0.01 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.60 1sos s GLU 100 Cb -0.04 -2.52 -0.02 0.00 0.26 0.00 0.00 34.13 31.81 1sos s GLU 100 CO -0.00 0.14 -0.12 0.34 -0.54 0.00 0.00 175.26 175.08 1sos s ASP 101 N 0.48 1.46 0.00 -1.70 2.15 -0.35 -4.93 116.67 113.78 1sos s ASP 101 Ca -0.12 -0.46 0.16 0.00 0.43 0.00 0.00 52.55 52.56 1sos s ASP 101 Cb -0.16 -0.08 -0.16 0.00 -0.30 0.00 0.00 42.92 42.22 1sos s ASP 101 CO 0.05 -0.01 0.68 -1.20 -0.17 0.00 0.00 175.17 174.52 1sos n SER 102 N 1.86 0.80 -0.04 -0.34 7.64 -1.26 -0.66 113.62 121.62 1sos n SER 102 Ca -0.19 -0.90 -0.15 0.00 1.01 0.00 0.00 58.87 58.64 1sos n SER 102 Cb 0.55 0.96 -0.14 0.00 -1.01 0.00 0.00 64.21 64.57 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 -1.29 1.62 -1.73 0.44 0.31 -1.26 -4.85 118.33 111.58 1sos n VAL 103 Ca 0.03 -0.72 -0.31 0.00 -0.01 0.00 0.00 64.34 63.33 1sos n VAL 103 Cb 0.25 -1.25 0.04 0.00 -0.91 0.00 0.00 33.84 31.96 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 -2.56 4.00 0.12 2.52 -4.36 -1.26 -4.92 121.20 114.75 1sos s ILE 104 Ca -0.16 0.74 -0.11 0.00 -0.26 0.00 0.00 60.65 60.86 1sos s ILE 104 Cb 0.07 -3.41 0.00 0.00 1.25 0.00 0.00 42.46 40.37 1sos s ILE 104 CO 0.77 -0.77 0.28 -0.55 0.24 0.00 0.00 174.94 174.91 1sos s SER 105 N -3.51 0.01 0.00 4.36 0.15 -0.85 -4.66 113.70 109.20 1sos s SER 105 Ca 0.59 -0.64 0.24 0.00 0.70 0.00 0.00 55.95 56.84 1sos s SER 105 Cb -0.14 0.41 0.40 0.00 -1.71 0.00 0.00 66.02 64.98 1sos s SER 105 CO 0.49 -0.82 1.38 0.18 1.20 0.00 0.00 173.24 175.68 1sos n LEU 106 N -0.15 2.86 -3.74 3.45 4.77 -1.26 -0.54 117.00 122.39 1sos n LEU 106 Ca -0.13 -1.06 -0.10 0.00 -0.03 0.00 0.00 56.01 54.69 1sos n LEU 106 Cb 0.63 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.58 1sos n LEU 106 CO 0.22 0.53 0.04 -0.94 -1.33 0.00 0.00 177.39 175.91 1sos s SER 107 N -1.82 -0.09 0.00 -1.43 1.04 -1.26 -3.56 113.70 106.58 1sos s SER 107 Ca 0.33 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1sos s SER 107 Cb 0.21 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1sos s SER 107 CO 0.31 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.39 1sos n GLY 108 N 0.06 -2.62 0.38 7.32 0.00 -1.26 -3.70 105.19 105.36 1sos n GLY 108 Ca -0.16 -1.72 0.16 0.00 0.00 0.00 0.00 46.02 44.29 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 0.46 -0.18 1.61 3.32 -2.00 -0.92 116.42 118.70 1sos h ASP 109 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1sos h ASP 109 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1sos h ASP 109 CO 0.00 0.22 0.00 1.41 -1.72 0.00 0.00 179.24 179.15 1sos n HIS 110 N -4.51 0.53 -2.19 4.55 8.25 -1.26 -4.97 115.22 115.62 1sos n HIS 110 Ca 0.17 -0.19 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 1sos n HIS 110 Cb 0.57 -0.17 -0.02 0.00 1.12 0.00 0.00 29.99 31.49 1sos n HIS 110 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1sos s SER 111 N -0.41 6.64 -0.11 0.41 0.15 -0.35 -2.01 113.70 118.02 1sos s SER 111 Ca 0.15 2.54 0.15 0.00 0.70 0.00 0.00 55.95 59.50 1sos s SER 111 Cb 0.11 -2.63 0.54 0.00 -1.71 0.00 0.00 66.02 62.32 1sos s SER 111 CO 0.06 -0.61 1.45 2.30 1.20 0.00 0.00 173.24 177.64 1sos n ILE 112 N 0.48 1.79 -2.33 6.45 -5.35 0.30 -4.88 119.36 115.81 1sos n ILE 112 Ca 0.02 -1.39 -0.42 0.00 -0.27 0.00 0.00 62.75 60.70 1sos n ILE 112 Cb 0.44 0.09 -0.03 0.00 -1.74 0.00 0.00 39.64 38.39 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 -1.98 3.60 0.00 7.28 -1.09 -1.26 -2.75 121.20 124.99 1sos s ILE 113 Ca 0.40 1.25 0.00 0.00 -2.23 0.00 0.00 60.65 60.07 1sos s ILE 113 Cb 0.28 -3.80 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 1sos s ILE 113 CO 0.16 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.64 1sos n GLY 114 N 2.67 0.50 2.27 6.18 0.00 0.74 -5.00 105.19 112.55 1sos n GLY 114 Ca 0.07 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.92 1.14 -4.80 1.61 1.74 -1.11 -2.43 116.66 109.88 1sos n ARG 115 Ca 0.00 -2.20 -0.33 0.00 -0.77 0.00 0.00 57.85 54.56 1sos n ARG 115 Cb 0.00 0.44 -0.16 0.00 -1.02 0.00 0.00 32.46 31.72 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 -1.92 2.58 0.01 0.55 2.01 -1.04 -0.09 115.64 117.73 1sos s THR 116 Ca 0.08 -0.82 -0.25 0.00 0.31 0.00 0.00 61.69 61.02 1sos s THR 116 Cb -0.01 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.40 1sos s THR 116 CO 0.05 0.53 0.75 -0.22 -0.69 0.00 0.00 174.62 175.05 1sos s LEU 117 N 0.54 4.40 -0.02 4.42 2.96 -0.85 -0.42 118.68 129.71 1sos s LEU 117 Ca -0.11 1.37 0.07 0.00 -0.22 0.00 0.00 54.13 55.24 1sos s LEU 117 Cb -0.16 -3.20 -0.02 0.00 0.50 0.00 0.00 46.19 43.32 1sos s LEU 117 CO 0.04 -0.04 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.11 1sos s VAL 118 N 0.28 1.84 -0.13 1.68 1.01 -0.25 -2.54 120.40 122.29 1sos s VAL 118 Ca 0.39 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1sos s VAL 118 Cb -0.20 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.64 1sos s VAL 118 CO 0.22 0.52 -0.18 0.54 0.00 0.00 0.00 175.10 176.20 1sos s VAL 119 N -0.46 2.57 0.43 2.92 0.11 -0.20 -1.92 120.40 123.85 1sos s VAL 119 Ca 0.06 -0.82 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 1sos s VAL 119 Cb -0.10 -2.05 0.01 0.00 -1.53 0.00 0.00 36.38 32.71 1sos s VAL 119 CO -0.00 0.53 0.61 -1.00 -3.33 0.00 0.00 175.10 171.91 1sos s HIS 120 N 0.51 3.02 0.03 1.54 3.76 -0.27 -0.48 115.29 123.40 1sos s HIS 120 Ca -0.11 -0.10 -0.21 0.00 -0.15 0.00 0.00 55.06 54.48 1sos s HIS 120 Cb -0.16 -2.33 -0.15 0.00 1.11 0.00 0.00 32.58 31.04 1sos s HIS 120 CO 0.05 -0.38 1.33 1.49 -0.85 0.00 0.00 174.74 176.37 1sos h GLU 121 N 0.53 0.30 -5.87 1.40 4.81 -0.00 -3.39 114.58 112.36 1sos h GLU 121 Ca -0.44 -0.16 -0.57 0.00 -0.13 0.00 0.00 59.36 58.06 1sos h GLU 121 Cb 1.27 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.58 1sos h GLU 121 CO 0.52 0.71 -0.42 0.15 -0.73 0.00 0.00 179.01 179.23 1sos s LYS 122 N -4.28 2.27 0.43 1.92 1.02 0.25 -4.84 119.74 116.50 1sos s LYS 122 Ca -0.14 -1.91 -0.25 0.00 0.02 0.00 0.00 55.97 53.69 1sos s LYS 122 Cb 0.05 -2.02 -0.08 0.00 -0.52 0.00 0.00 37.83 35.25 1sos s LYS 122 CO 0.74 -0.31 1.21 0.00 -0.92 0.00 0.00 175.35 176.07 1sos s ALA 123 N -2.66 3.11 -0.11 5.17 0.00 -1.11 0.23 121.76 126.38 1sos s ALA 123 Ca 0.36 1.03 -0.13 0.00 0.00 0.00 0.00 51.96 53.23 1sos s ALA 123 Cb 0.01 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 1sos s ALA 123 CO 0.21 -0.67 0.31 0.34 0.00 0.00 0.00 175.76 175.94 1sos s ASP 124 N -1.10 6.55 0.00 0.00 2.15 -1.26 -3.95 116.67 119.05 1sos s ASP 124 Ca 0.60 0.65 0.08 0.00 0.43 0.00 0.00 52.55 54.31 1sos s ASP 124 Cb -0.32 -2.19 0.25 0.00 -0.30 0.00 0.00 42.92 40.36 1sos s ASP 124 CO 0.40 0.21 1.21 -0.90 -0.17 0.00 0.00 175.17 175.92 1sos n ASP 125 N 2.82 1.35 -2.48 -0.34 5.68 -0.43 -4.88 116.55 118.27 1sos n ASP 125 Ca -0.14 -1.98 -0.20 0.00 -0.50 0.00 0.00 54.79 51.98 1sos n ASP 125 Cb 0.52 -0.17 -0.00 0.00 -1.14 0.00 0.00 41.12 40.33 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 0.23 -1.89 0.00 -2.12 4.77 -1.26 -1.80 117.00 114.92 1sos n LEU 126 Ca 0.09 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1sos n LEU 126 Cb 0.22 -2.82 0.00 0.00 -2.33 0.00 0.00 43.42 38.49 1sos n LEU 126 CO 0.06 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 1sos n GLY 127 N -1.04 0.61 1.54 -0.72 0.00 -1.25 -3.31 105.19 101.03 1sos n GLY 127 Ca -0.22 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.77 3.58 -0.17 1.61 5.02 -0.75 -4.49 118.16 120.20 1sos n LYS 128 Ca 0.00 -3.04 0.12 0.00 -2.02 0.00 0.00 58.31 53.36 1sos n LYS 128 Cb 0.00 -2.07 0.23 0.00 -0.02 0.00 0.00 35.03 33.17 1sos n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sos n GLY 129 N -0.18 1.52 2.41 0.72 0.00 -1.26 -4.99 105.19 103.41 1sos n GLY 129 Ca 0.31 -0.70 -0.20 0.00 0.00 0.00 0.00 46.02 45.43 1sos n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sos n GLY 130 N 1.46 -0.17 3.24 -0.02 0.00 -1.26 -4.92 105.19 103.52 1sos n GLY 130 Ca 0.19 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1sos n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sos s ASN 131 N -2.18 0.18 0.20 1.61 4.22 -1.26 -5.05 114.94 112.66 1sos s ASN 131 Ca 0.00 -1.08 -0.11 0.00 -2.14 0.00 0.00 52.86 49.53 1sos s ASN 131 Cb 0.00 0.37 0.25 0.00 1.28 0.00 0.00 41.25 43.14 1sos s ASN 131 CO 0.00 -0.82 1.72 -0.33 -2.04 0.00 0.00 177.10 175.63 1sos h GLU 132 N 2.70 0.26 0.00 3.55 5.08 -2.02 -2.80 114.58 121.35 1sos h GLU 132 Ca -0.33 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.97 1sos h GLU 132 Cb 1.22 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1sos h GLU 132 CO 0.53 0.17 -0.21 1.49 -1.00 0.00 0.00 179.01 180.00 1sos h GLU 133 N 0.27 0.00 -0.97 2.33 4.57 -1.97 -2.82 114.58 115.99 1sos h GLU 133 Ca 0.28 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.54 1sos h GLU 133 Cb 0.39 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.92 1sos h GLU 133 CO -0.35 0.21 0.63 1.03 -1.18 0.00 0.00 179.01 179.34 1sos h SER 134 N 0.00 0.97 -0.24 1.04 0.87 -1.81 0.11 113.55 114.49 1sos h SER 134 Ca -0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1sos h SER 134 Cb 0.45 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1sos h SER 134 CO 0.03 0.60 0.00 0.35 -0.53 0.00 0.00 176.83 177.27 1sos n THR 135 N -4.52 0.30 0.00 2.23 -2.24 -1.06 -0.85 114.28 108.14 1sos n THR 135 Ca 0.16 -0.47 -0.03 0.00 -2.27 0.00 0.00 64.05 61.44 1sos n THR 135 Cb 0.23 0.54 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 1sos n THR 135 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1sos n LYS 136 N 0.67 0.11 0.00 -0.78 5.02 -0.91 -1.15 118.16 121.11 1sos n LYS 136 Ca 0.17 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1sos n LYS 136 Cb 0.41 -0.68 0.00 0.00 -0.02 0.00 0.00 35.03 34.74 1sos n LYS 136 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1sos n THR 137 N -3.48 0.00 -1.03 -0.18 -2.24 0.32 -4.70 114.28 102.96 1sos n THR 137 Ca -0.06 -0.47 -0.01 0.00 -2.27 0.00 0.00 64.05 61.24 1sos n THR 137 Cb 0.31 1.05 -0.01 0.00 -2.10 0.00 0.00 70.33 69.58 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 0.17 0.48 2.64 3.38 0.00 -0.03 -3.03 105.19 108.79 1sos n GLY 138 Ca 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 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 0.17 -5.97 -0.04 1.61 3.02 -1.23 -1.31 115.26 111.51 1sos n ASN 139 Ca -0.01 -0.13 0.15 0.00 -0.03 0.00 0.00 54.58 54.56 1sos n ASN 139 Cb 0.12 -4.90 0.79 0.00 -0.61 0.00 0.00 39.78 35.17 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 -2.62 2.62 -0.54 5.41 0.00 -1.17 -4.71 120.51 119.50 1sos n ALA 140 Ca -0.19 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1sos n ALA 140 Cb 0.66 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.17 1.46 3.77 0.00 0.00 -1.26 -0.59 105.19 109.74 1sos n GLY 141 Ca 0.18 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 4.82 -0.73 1.61 0.01 -1.26 -4.70 113.70 109.45 1sos s SER 142 Ca 0.00 1.96 -0.18 0.00 1.31 0.00 0.00 55.95 59.04 1sos s SER 142 Cb 0.00 -2.54 0.13 0.00 0.21 0.00 0.00 66.02 63.82 1sos s SER 142 CO 0.00 -1.82 0.85 -0.13 0.41 0.00 0.00 173.24 172.55 1sos s ARG 143 N -4.36 3.30 0.15 12.44 0.52 -1.26 0.35 118.95 130.09 1sos s ARG 143 Ca 0.65 -1.61 0.05 0.00 -0.52 0.00 0.00 55.73 54.30 1sos s ARG 143 Cb -0.20 -4.47 -0.06 0.00 0.52 0.00 0.00 34.95 30.75 1sos s ARG 143 CO 0.47 -1.58 1.35 -0.07 0.02 0.00 0.00 175.30 175.49 1sos h LEU 144 N 9.80 0.14 -7.12 2.53 3.38 -1.08 -3.46 115.31 119.50 1sos h LEU 144 Ca -0.10 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 1sos h LEU 144 Cb 1.06 -0.04 -0.21 0.00 0.09 0.00 0.00 40.66 41.56 1sos h LEU 144 CO 1.05 0.98 0.04 0.00 0.09 0.00 0.00 178.44 180.60 1sos s ALA 145 N -3.02 -1.52 0.24 1.53 0.00 -1.09 -4.22 121.76 113.69 1sos s ALA 145 Ca -0.01 1.38 -0.09 0.00 0.00 0.00 0.00 51.96 53.23 1sos s ALA 145 Cb 0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1sos s ALA 145 CO 0.82 -0.32 0.40 0.00 0.00 0.00 0.00 175.76 176.66 1sos s GLY 147 N -3.06 -0.45 0.29 0.00 0.00 -1.05 -1.71 107.32 101.34 1sos s GLY 147 Ca 0.27 1.51 -0.29 0.00 0.00 0.00 0.00 44.72 46.21 1sos s GLY 147 CO 0.10 0.86 1.05 0.14 0.00 0.00 0.00 173.10 175.26 1sos s VAL 148 N -1.55 3.68 -0.32 1.40 1.01 -1.26 -2.00 120.40 121.36 1sos s VAL 148 Ca -0.05 1.62 -0.25 0.00 0.00 0.00 0.00 61.98 63.30 1sos s VAL 148 Cb -0.00 -4.00 0.01 0.00 0.00 0.00 0.00 36.38 32.39 1sos s VAL 148 CO 0.03 0.33 0.85 -0.63 0.00 0.00 0.00 175.10 175.67 1sos s ILE 149 N -1.26 4.72 0.35 2.22 1.01 0.87 -4.46 121.20 124.64 1sos s ILE 149 Ca 0.46 1.25 0.09 0.00 0.00 0.00 0.00 60.65 62.45 1sos s ILE 149 Cb -0.28 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 37.91 1sos s ILE 149 CO 0.36 -0.33 -0.02 -0.83 0.00 0.00 0.00 174.94 174.13 1sos s GLY 150 N 1.66 2.15 0.20 6.18 0.00 -0.55 -0.19 107.32 116.77 1sos s GLY 150 Ca 0.35 -2.03 -0.30 0.00 0.00 0.00 0.00 44.72 42.74 1sos s GLY 150 CO 0.14 -1.96 1.23 -0.42 0.00 0.00 0.00 173.10 172.09 1sos s ILE 151 N -2.56 3.41 0.42 0.90 1.01 -1.26 -1.64 121.20 121.47 1sos s ILE 151 Ca 0.34 1.20 0.04 0.00 0.00 0.00 0.00 60.65 62.23 1sos s ILE 151 Cb 0.02 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.67 1sos s ILE 151 CO 0.18 0.20 0.04 0.00 0.00 0.00 0.00 174.94 175.36 1sos s ALA 152 N -0.11 3.19 -2.52 9.38 0.00 -0.43 -4.80 121.76 126.47 1sos s ALA 152 Ca 0.53 -1.52 0.28 0.00 0.00 0.00 0.00 51.96 51.25 1sos s ALA 152 Cb -0.34 0.36 1.01 0.00 0.00 0.00 0.00 23.12 24.14 1sos s ALA 152 CO 0.38 -0.18 1.72 0.94 0.00 0.00 0.00 175.76 178.63