#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hog n THR 2 N 0.00 -0.01 -3.68 0.00 -1.04 -1.26 -4.09 114.28 104.21 3hog n THR 2 Ca 0.00 0.29 -0.13 0.00 -2.04 0.00 0.00 64.05 62.17 3hog n THR 2 Cb 0.00 -0.49 -0.09 0.00 -1.82 0.00 0.00 70.33 67.94 3hog n THR 2 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3hog s LYS 3 N -3.45 0.64 0.08 -2.82 2.20 -0.61 -4.89 119.74 110.90 3hog s LYS 3 Ca -0.01 0.82 0.06 0.00 -0.36 0.00 0.00 55.97 56.47 3hog s LYS 3 Cb 0.05 0.28 -0.03 0.00 -1.51 0.00 0.00 37.83 36.62 3hog s LYS 3 CO 0.17 -0.09 -0.15 0.15 -0.36 0.00 0.00 175.35 175.07 3hog s LYS 4 N 0.47 0.87 0.21 4.03 1.02 -1.26 -1.37 119.74 123.72 3hog s LYS 4 Ca -0.01 -0.99 -0.05 0.00 0.02 0.00 0.00 55.97 54.93 3hog s LYS 4 Cb -0.04 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.33 3hog s LYS 4 CO -0.02 0.20 0.26 0.00 -0.92 0.00 0.00 175.35 174.87 3hog s ALA 5 N -1.28 0.62 0.02 5.17 0.00 -0.37 -2.75 121.76 123.17 3hog s ALA 5 Ca -0.01 -1.37 -0.15 0.00 0.00 0.00 0.00 51.96 50.44 3hog s ALA 5 Cb -0.10 1.24 0.02 0.00 0.00 0.00 0.00 23.12 24.28 3hog s ALA 5 CO 0.03 -0.68 0.32 0.54 0.00 0.00 0.00 175.76 175.97 3hog s VAL 6 N -4.10 0.07 -0.03 0.00 0.11 -0.05 -1.00 120.40 115.41 3hog s VAL 6 Ca 0.32 -0.58 0.02 0.00 -2.93 0.00 0.00 61.98 58.80 3hog s VAL 6 Cb 0.04 -0.84 0.01 0.00 -1.53 0.00 0.00 36.38 34.06 3hog s VAL 6 CO 0.10 -0.32 -0.07 0.00 -3.33 0.00 0.00 175.10 171.48 3hog s ALA 7 N -2.15 0.74 -0.24 1.54 0.00 0.17 -0.62 121.76 121.21 3hog s ALA 7 Ca -0.08 -0.24 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 3hog s ALA 7 Cb -0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 3hog s ALA 7 CO -0.01 0.10 0.27 0.08 0.00 0.00 0.00 175.76 176.20 3hog s VAL 8 N 0.31 5.28 -0.18 0.00 1.01 -1.26 -0.80 120.40 124.76 3hog s VAL 8 Ca -0.04 0.40 -0.09 0.00 0.00 0.00 0.00 61.98 62.25 3hog s VAL 8 Cb -0.09 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 3hog s VAL 8 CO 0.00 0.28 0.12 -0.76 0.00 0.00 0.00 175.10 174.74 3hog s LEU 9 N 1.37 4.15 0.12 3.92 1.02 0.80 -4.05 118.68 126.01 3hog s LEU 9 Ca 0.12 0.25 -0.09 0.00 0.02 0.00 0.00 54.13 54.43 3hog s LEU 9 Cb -0.14 -2.05 -0.00 0.00 0.02 0.00 0.00 46.19 44.01 3hog s LEU 9 CO 0.07 0.23 0.23 -0.54 0.02 0.00 0.00 176.35 176.36 3hog s LYS 10 N 0.05 0.96 0.00 1.70 1.02 -0.72 -1.43 119.74 121.32 3hog s LYS 10 Ca 0.09 -1.02 0.00 0.00 0.02 0.00 0.00 55.97 55.06 3hog s LYS 10 Cb -0.11 0.36 0.00 0.00 -0.52 0.00 0.00 37.83 37.56 3hog s LYS 10 CO -0.00 -0.33 0.00 0.41 -0.92 0.00 0.00 175.35 174.51 3hog n GLY 11 N -0.12 3.08 2.46 -3.33 0.00 -1.24 -1.13 105.19 104.92 3hog n GLY 11 Ca -0.13 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 3hog n GLY 11 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hog n ASN 12 N 0.00 7.04 -1.00 1.61 5.15 -1.26 -4.79 115.26 122.02 3hog n ASN 12 Ca 0.00 -3.14 0.00 0.00 -0.60 0.00 0.00 54.58 50.84 3hog n ASN 12 Cb 0.00 -1.29 0.00 0.00 -0.53 0.00 0.00 39.78 37.96 3hog n ASN 12 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3hog n SER 13 N 1.29 0.00 -0.74 1.20 3.41 -1.26 -5.02 113.62 112.51 3hog n SER 13 Ca 0.54 -1.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.24 3hog n SER 13 Cb 0.45 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.65 3hog n SER 13 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3hog n ASN 14 N -0.72 2.16 -4.71 4.04 5.03 -1.26 -4.90 115.26 114.90 3hog n ASN 14 Ca 0.00 -1.91 -0.42 0.00 0.87 0.00 0.00 54.58 53.12 3hog n ASN 14 Cb 0.00 -0.22 -0.03 0.00 -1.02 0.00 0.00 39.78 38.51 3hog n ASN 14 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3hog s VAL 15 N -1.55 2.89 0.03 2.41 1.01 -1.26 -4.50 120.40 119.43 3hog s VAL 15 Ca 0.30 0.62 -0.17 0.00 0.00 0.00 0.00 61.98 62.74 3hog s VAL 15 Cb 0.16 -3.40 0.03 0.00 0.00 0.00 0.00 36.38 33.17 3hog s VAL 15 CO 0.22 0.04 0.37 -1.83 0.00 0.00 0.00 175.10 173.91 3hog s GLU 16 N 1.24 0.86 0.04 2.72 -1.05 -0.96 -3.62 118.70 117.92 3hog s GLU 16 Ca 0.68 -0.37 -0.12 0.00 -0.15 0.00 0.00 54.97 55.01 3hog s GLU 16 Cb -0.41 0.38 0.04 0.00 -0.44 0.00 0.00 34.13 33.70 3hog s GLU 16 CO 0.31 -0.28 0.57 0.41 0.95 0.00 0.00 175.26 177.21 3hog n GLY 17 N 0.63 0.67 2.85 -3.83 0.00 -0.51 -0.62 105.19 104.38 3hog n GLY 17 Ca -0.19 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 3hog n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hog s VAL 18 N -2.19 -0.02 -0.08 1.61 1.01 -0.64 -0.14 120.40 119.94 3hog s VAL 18 Ca 0.13 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.20 3hog s VAL 18 Cb -0.01 -0.05 0.01 0.00 0.00 0.00 0.00 36.38 36.34 3hog s VAL 18 CO 0.01 0.03 -0.13 -0.69 0.00 0.00 0.00 175.10 174.32 3hog s VAL 19 N 0.37 1.26 0.07 2.92 1.01 0.02 -2.14 120.40 123.91 3hog s VAL 19 Ca -0.03 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.46 3hog s VAL 19 Cb -0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3hog s VAL 19 CO -0.01 0.39 0.04 0.42 0.00 0.00 0.00 175.10 175.94 3hog s THR 20 N 0.86 4.33 -0.00 3.92 -4.23 -0.37 -0.66 115.64 119.49 3hog s THR 20 Ca -0.10 -0.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.62 3hog s THR 20 Cb -0.15 -3.06 -0.01 0.00 1.34 0.00 0.00 72.50 70.62 3hog s THR 20 CO 0.01 0.16 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.40 3hog s LEU 21 N -2.26 2.02 -0.06 4.79 1.02 -0.17 -1.23 118.68 122.79 3hog s LEU 21 Ca 0.27 -0.16 -0.02 0.00 0.02 0.00 0.00 54.13 54.24 3hog s LEU 21 Cb -0.12 -0.42 0.04 0.00 0.02 0.00 0.00 46.19 45.70 3hog s LEU 21 CO 0.19 0.10 0.12 -0.55 0.02 0.00 0.00 176.35 176.23 3hog s SER 22 N -0.23 -0.01 -0.08 2.29 0.15 -0.43 -1.24 113.70 114.16 3hog s SER 22 Ca 0.03 0.24 -0.06 0.00 0.70 0.00 0.00 55.95 56.86 3hog s SER 22 Cb -0.03 0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.44 3hog s SER 22 CO -0.00 -0.15 0.20 -1.58 1.20 0.00 0.00 173.24 172.90 3hog s GLN 23 N 1.23 0.20 -0.38 5.44 0.74 -0.47 -0.61 119.66 125.81 3hog s GLN 23 Ca -0.08 0.35 -0.18 0.00 0.05 0.00 0.00 55.36 55.50 3hog s GLN 23 Cb -0.12 0.00 0.01 0.00 1.10 0.00 0.00 33.01 34.00 3hog s GLN 23 CO -0.05 -0.08 0.52 -0.51 -0.55 0.00 0.00 175.29 174.61 3hog s ASP 24 N 0.58 6.29 1.48 6.67 1.11 -1.26 -1.57 116.67 129.97 3hog s ASP 24 Ca -0.04 -0.20 0.00 0.00 0.18 0.00 0.00 52.55 52.49 3hog s ASP 24 Cb -0.05 -2.27 0.00 0.00 1.07 0.00 0.00 42.92 41.67 3hog s ASP 24 CO -0.03 -0.55 0.00 -0.67 1.18 0.00 0.00 175.17 175.10 3hog n ASP 25 N 5.80 0.00 -1.12 0.27 4.64 -1.26 -0.67 116.55 124.20 3hog n ASP 25 Ca -0.05 0.00 -0.04 0.00 -1.38 0.00 0.00 54.79 53.32 3hog n ASP 25 Cb 0.48 0.00 0.18 0.00 -1.04 0.00 0.00 41.12 40.75 3hog n ASP 25 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 3hog n ASP 26 N 8.10 2.62 -2.09 1.67 2.03 -1.26 -4.75 116.55 122.86 3hog n ASP 26 Ca 0.00 -3.83 0.00 0.00 0.52 0.00 0.00 54.79 51.48 3hog n ASP 26 Cb 0.00 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 3hog n ASP 26 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hog n GLY 27 N -1.08 -0.58 3.71 0.27 0.00 0.15 -5.00 105.19 102.66 3hog n GLY 27 Ca 0.31 -1.74 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 3hog n GLY 27 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hog n PRO 28 N -0.82 1.48 -3.87 1.61 -0.02 -1.26 -4.72 135.00 127.39 3hog n PRO 28 Ca 0.00 0.55 -0.36 0.00 -2.02 0.00 0.00 63.50 61.67 3hog n PRO 28 Cb 0.00 -2.47 -0.12 0.00 -0.02 0.00 0.00 33.50 30.89 3hog n PRO 28 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3hog s THR 29 N -1.33 4.46 -0.11 3.45 2.01 0.21 -4.40 115.64 119.93 3hog s THR 29 Ca 0.73 -0.13 -0.16 0.00 0.31 0.00 0.00 61.69 62.44 3hog s THR 29 Cb -0.42 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 3hog s THR 29 CO 0.48 0.38 0.41 -0.89 -0.69 0.00 0.00 174.62 174.31 3hog s THR 30 N 1.19 5.20 -0.15 -0.82 2.01 0.22 -0.88 115.64 122.40 3hog s THR 30 Ca 0.04 0.81 -0.00 0.00 0.31 0.00 0.00 61.69 62.86 3hog s THR 30 Cb -0.14 -3.74 0.03 0.00 0.01 0.00 0.00 72.50 68.65 3hog s THR 30 CO 0.03 0.39 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.57 3hog s VAL 31 N 0.29 1.27 -0.20 3.82 1.01 0.79 -1.31 120.40 126.06 3hog s VAL 31 Ca 0.23 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 3hog s VAL 31 Cb -0.15 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 3hog s VAL 31 CO 0.09 0.28 0.04 0.20 0.00 0.00 0.00 175.10 175.70 3hog s ASN 32 N 1.59 5.15 -0.06 3.32 0.01 -0.37 -0.40 114.94 124.18 3hog s ASN 32 Ca 0.03 -0.11 0.05 0.00 -0.71 0.00 0.00 52.86 52.12 3hog s ASN 32 Cb -0.14 -1.89 -0.01 0.00 0.41 0.00 0.00 41.25 39.62 3hog s ASN 32 CO -0.09 0.08 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.66 3hog s VAL 33 N 0.94 1.94 -0.13 1.60 1.01 0.62 -1.23 120.40 125.14 3hog s VAL 33 Ca 0.03 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 3hog s VAL 33 Cb -0.14 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.65 3hog s VAL 33 CO 0.02 0.54 0.14 -0.60 0.00 0.00 0.00 175.10 175.20 3hog s ARG 34 N -0.05 0.06 -0.03 2.72 3.52 -0.91 -1.35 118.95 122.91 3hog s ARG 34 Ca -0.06 0.24 0.06 0.00 -0.13 0.00 0.00 55.73 55.84 3hog s ARG 34 Cb -0.14 -1.04 -0.01 0.00 -1.56 0.00 0.00 34.95 32.20 3hog s ARG 34 CO 0.04 -0.51 -0.20 0.42 -0.81 0.00 0.00 175.30 174.24 3hog s ILE 35 N 2.24 1.57 0.39 4.11 1.01 0.03 -1.62 121.20 128.91 3hog s ILE 35 Ca 0.04 -0.83 0.05 0.00 0.00 0.00 0.00 60.65 59.91 3hog s ILE 35 Cb -0.14 -1.32 -0.07 0.00 0.01 0.00 0.00 42.46 40.95 3hog s ILE 35 CO -0.08 0.44 0.03 0.42 0.00 0.00 0.00 174.94 175.75 3hog s THR 36 N -0.31 1.61 0.00 2.92 -4.23 0.21 -0.60 115.64 115.24 3hog s THR 36 Ca 0.04 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 3hog s THR 36 Cb -0.09 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 70.90 3hog s THR 36 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 3hog n GLY 37 N -0.90 0.45 3.84 3.99 0.00 -1.08 -2.27 105.19 109.22 3hog n GLY 37 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 3hog n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hog s LEU 38 N 0.00 3.73 0.24 0.99 1.43 -0.71 -4.31 118.68 120.06 3hog s LEU 38 Ca 0.00 1.52 -0.30 0.00 -1.03 0.00 0.00 54.13 54.32 3hog s LEU 38 Cb 0.00 -4.42 -0.09 0.00 0.03 0.00 0.00 46.19 41.70 3hog s LEU 38 CO 0.00 -0.50 1.25 0.00 0.23 0.00 0.00 176.35 177.33 3hog s ALA 39 N -2.47 3.48 0.39 4.21 0.00 -1.26 -4.11 121.76 122.00 3hog s ALA 39 Ca 0.58 1.07 -0.25 0.00 0.00 0.00 0.00 51.96 53.37 3hog s ALA 39 Cb -0.10 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.47 3hog s ALA 39 CO 0.27 -0.46 0.96 -2.30 0.00 0.00 0.00 175.76 174.23 3hog n PRO 40 N 1.90 1.27 0.00 0.00 -0.02 -1.26 -4.68 135.00 132.21 3hog n PRO 40 Ca 0.03 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3hog n PRO 40 Cb 0.43 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 3hog n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hog n GLY 41 N 1.25 0.38 3.75 -1.23 0.00 -0.28 -4.91 105.19 104.14 3hog n GLY 41 Ca 0.10 -2.31 -0.40 0.00 0.00 0.00 0.00 46.02 43.40 3hog n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hog s LEU 42 N 0.00 4.59 0.06 0.99 1.43 -1.26 -1.57 118.68 122.92 3hog s LEU 42 Ca 0.00 2.03 0.04 0.00 -1.03 0.00 0.00 54.13 55.17 3hog s LEU 42 Cb 0.00 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 3hog s LEU 42 CO 0.00 0.02 -0.11 -1.00 0.23 0.00 0.00 176.35 175.49 3hog s HIS 43 N -0.96 0.95 0.56 0.29 3.76 0.16 -4.32 115.29 115.71 3hog s HIS 43 Ca 0.43 -0.47 -0.17 0.00 -0.15 0.00 0.00 55.06 54.70 3hog s HIS 43 Cb -0.28 -0.55 -0.05 0.00 1.11 0.00 0.00 32.58 32.82 3hog s HIS 43 CO 0.34 -0.01 1.04 0.20 -0.85 0.00 0.00 174.74 175.46 3hog s GLY 44 N -1.64 2.19 -0.23 -2.22 0.00 0.04 -1.14 107.32 104.32 3hog s GLY 44 Ca -0.06 0.40 -0.03 0.00 0.00 0.00 0.00 44.72 45.03 3hog s GLY 44 CO 0.01 0.71 0.28 -0.12 0.00 0.00 0.00 173.10 173.98 3hog s PHE 45 N -2.38 -0.45 0.06 1.90 5.36 -1.26 -0.62 117.98 120.58 3hog s PHE 45 Ca 0.64 0.32 0.03 0.00 -0.96 0.00 0.00 56.93 56.95 3hog s PHE 45 Cb -0.15 -0.28 -0.03 0.00 -0.34 0.00 0.00 43.02 42.23 3hog s PHE 45 CO 0.32 -0.69 -0.08 -1.01 -1.46 0.00 0.00 175.22 172.30 3hog s HIS 46 N 2.39 0.79 0.10 10.12 3.76 -0.68 -1.04 115.29 130.73 3hog s HIS 46 Ca 0.09 -0.57 -0.28 0.00 -0.15 0.00 0.00 55.06 54.14 3hog s HIS 46 Cb -0.15 -0.46 -0.06 0.00 1.11 0.00 0.00 32.58 33.01 3hog s HIS 46 CO -0.16 -0.07 0.89 -0.51 -0.85 0.00 0.00 174.74 174.03 3hog s LEU 47 N -1.90 4.50 0.31 0.89 1.43 0.22 -1.08 118.68 123.06 3hog s LEU 47 Ca -0.05 1.69 0.11 0.00 -1.03 0.00 0.00 54.13 54.85 3hog s LEU 47 Cb -0.07 -3.46 -0.06 0.00 0.03 0.00 0.00 46.19 42.63 3hog s LEU 47 CO -0.00 -0.00 -0.14 -1.00 0.23 0.00 0.00 176.35 175.43 3hog s HIS 48 N -0.20 2.33 0.19 0.29 3.76 0.30 -1.19 115.29 120.77 3hog s HIS 48 Ca 0.43 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 54.89 3hog s HIS 48 Cb -0.23 -1.18 0.11 0.00 1.11 0.00 0.00 32.58 32.39 3hog s HIS 48 CO 0.28 0.64 1.50 1.49 -0.85 0.00 0.00 174.74 177.79 3hog h GLU 49 N 2.15 0.51 -6.42 1.40 4.81 -0.67 -2.67 114.58 113.70 3hog h GLU 49 Ca -0.41 -0.34 -0.70 0.00 -0.13 0.00 0.00 59.36 57.79 3hog h GLU 49 Cb 1.25 0.05 -0.29 0.00 0.63 0.00 0.00 28.75 30.39 3hog h GLU 49 CO 0.65 0.95 -0.86 0.71 -0.73 0.00 0.00 179.01 179.73 3hog s TYR 50 N -3.91 2.44 -0.94 0.92 2.02 -0.62 -4.67 117.35 112.59 3hog s TYR 50 Ca -0.07 -0.44 -0.05 0.00 -0.37 0.00 0.00 57.07 56.14 3hog s TYR 50 Cb 0.11 -1.55 0.09 0.00 -0.40 0.00 0.00 41.96 40.21 3hog s TYR 50 CO 0.84 -0.03 2.58 0.41 -1.57 0.00 0.00 175.55 177.77 3hog n GLY 51 N 2.53 4.81 3.12 0.71 0.00 -0.90 -3.84 105.19 111.61 3hog n GLY 51 Ca -0.17 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 3hog n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hog s ASP 52 N 0.41 4.47 -0.19 1.61 -1.08 -1.26 -4.89 116.67 115.74 3hog s ASP 52 Ca 0.56 -1.24 0.15 0.00 -0.52 0.00 0.00 52.55 51.51 3hog s ASP 52 Cb 0.27 -1.61 0.45 0.00 -1.46 0.00 0.00 42.92 40.57 3hog s ASP 52 CO -0.15 -0.19 1.34 0.35 0.52 0.00 0.00 175.17 177.05 3hog n THR 53 N 4.53 2.23 0.20 1.71 -2.24 -1.26 -2.39 114.28 117.06 3hog n THR 53 Ca -0.15 -2.28 0.05 0.00 -2.27 0.00 0.00 64.05 59.40 3hog n THR 53 Cb 0.44 -0.27 0.43 0.00 -2.10 0.00 0.00 70.33 68.83 3hog n THR 53 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3hog h THR 54 N 1.05 1.10 -0.91 4.28 1.35 -1.93 -2.36 112.91 115.49 3hog h THR 54 Ca 0.05 -1.14 -0.58 0.00 -0.55 0.00 0.00 66.41 64.19 3hog h THR 54 Cb 1.33 1.64 -0.40 0.00 -1.73 0.00 0.00 68.15 68.99 3hog h THR 54 CO 0.18 0.31 -0.49 -3.20 -0.25 0.00 0.00 175.52 172.07 3hog n ASN 55 N -3.97 5.41 0.00 5.36 5.15 -1.26 -5.07 115.26 120.88 3hog n ASN 55 Ca -0.02 -3.76 0.00 0.00 -0.60 0.00 0.00 54.58 50.21 3hog n ASN 55 Cb 0.38 -0.47 0.00 0.00 -0.53 0.00 0.00 39.78 39.16 3hog n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hog n GLY 56 N -0.71 -0.29 0.04 8.20 0.00 -0.89 -3.67 105.19 107.87 3hog n GLY 56 Ca 0.47 -1.05 0.12 0.00 0.00 0.00 0.00 46.02 45.56 3hog n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hog h MET 58 N 0.00 0.08 0.00 0.00 2.07 -1.89 -2.83 114.93 112.35 3hog h MET 58 Ca 0.00 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.60 3hog h MET 58 Cb 0.50 -0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.22 3hog h MET 58 CO 0.00 0.44 0.00 0.43 1.07 0.00 0.00 176.91 178.85 3hog n SER 59 N -4.09 0.37 0.00 1.22 7.64 -1.13 -2.44 113.62 115.19 3hog n SER 59 Ca -0.02 0.60 0.08 0.00 1.01 0.00 0.00 58.87 60.55 3hog n SER 59 Cb 0.42 -0.67 0.44 0.00 -1.01 0.00 0.00 64.21 63.38 3hog n SER 59 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3hog n THR 60 N -1.92 0.44 -4.62 0.44 -2.24 -1.01 -4.39 114.28 100.99 3hog n THR 60 Ca 0.02 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3hog n THR 60 Cb 0.19 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 3hog n THR 60 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hog n GLY 61 N 0.17 0.38 3.77 3.38 0.00 -1.02 -1.58 105.19 110.28 3hog n GLY 61 Ca 0.09 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 3hog n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hog s ALA 62 N -1.62 2.55 0.19 4.61 0.00 -1.26 -4.62 121.76 121.60 3hog s ALA 62 Ca 0.00 0.62 -0.32 0.00 0.00 0.00 0.00 51.96 52.26 3hog s ALA 62 Cb 0.00 -3.33 -0.15 0.00 0.00 0.00 0.00 23.12 19.64 3hog s ALA 62 CO 0.00 -1.11 1.21 0.72 0.00 0.00 0.00 175.76 176.58 3hog n HIS 63 N -2.08 1.48 -4.05 0.00 8.25 -1.26 -0.65 115.22 116.91 3hog n HIS 63 Ca 0.11 0.63 -0.34 0.00 -0.26 0.00 0.00 57.72 57.85 3hog n HIS 63 Cb 0.52 -2.32 -0.15 0.00 1.12 0.00 0.00 29.99 29.16 3hog n HIS 63 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 3hog s PHE 64 N -0.18 2.88 -0.40 4.41 5.36 -0.33 -4.71 117.98 125.01 3hog s PHE 64 Ca 0.72 -1.17 -0.09 0.00 -0.96 0.00 0.00 56.93 55.42 3hog s PHE 64 Cb -0.81 -2.02 0.06 0.00 -0.34 0.00 0.00 43.02 39.92 3hog s PHE 64 CO 0.52 -0.62 0.23 1.21 -1.46 0.00 0.00 175.22 175.10 3hog s ASN 65 N 1.33 5.62 0.53 6.13 3.84 -1.26 -4.15 114.94 126.99 3hog s ASN 65 Ca 0.04 -1.35 0.27 0.00 0.21 0.00 0.00 52.86 52.03 3hog s ASN 65 Cb -0.14 -1.98 1.51 0.00 -0.55 0.00 0.00 41.25 40.09 3hog s ASN 65 CO -0.06 -0.48 2.11 -0.65 -2.79 0.00 0.00 177.10 175.23 3hog h PRO 66 N 8.39 0.00 -0.58 0.43 0.11 -1.86 -2.95 132.00 135.55 3hog h PRO 66 Ca -0.23 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.60 3hog h PRO 66 Cb 1.09 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.03 3hog h PRO 66 CO 0.72 0.09 0.18 0.09 -0.21 0.00 0.00 178.00 178.87 3hog n ASN 67 N -3.76 3.15 -0.24 -2.05 5.03 -1.26 -4.76 115.26 111.37 3hog n ASN 67 Ca -0.02 -3.63 -0.00 0.00 0.87 0.00 0.00 54.58 51.79 3hog n ASN 67 Cb 0.20 -0.70 0.11 0.00 -1.02 0.00 0.00 39.78 38.37 3hog n ASN 67 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3hog h LYS 68 N 1.19 0.64 -0.07 3.52 3.64 -1.92 -2.36 116.57 121.20 3hog h LYS 68 Ca 0.34 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 3hog h LYS 68 Cb 2.08 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.76 3hog h LYS 68 CO 0.63 0.42 0.00 1.28 -2.27 0.00 0.00 179.45 179.51 3hog n LEU 69 N -4.81 1.70 -4.77 5.20 4.77 -1.26 -4.95 117.00 112.88 3hog n LEU 69 Ca 0.09 -0.62 -0.39 0.00 -0.03 0.00 0.00 56.01 55.06 3hog n LEU 69 Cb 0.21 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 3hog n LEU 69 CO 0.27 0.31 0.85 -0.89 -1.33 0.00 0.00 177.39 176.60 3hog s THR 70 N -1.92 3.21 -1.05 -5.08 2.01 -0.89 -5.29 115.64 106.62 3hog s THR 70 Ca 0.36 1.11 -0.03 0.00 0.31 0.00 0.00 61.69 63.43 3hog s THR 70 Cb 0.20 -3.66 0.31 0.00 0.01 0.00 0.00 72.50 69.36 3hog s THR 70 CO 0.31 0.18 1.51 1.41 -0.69 0.00 0.00 174.62 177.34 3hog n HIS 71 N 0.54 2.35 0.00 4.92 8.25 -1.26 -5.13 115.22 124.89 3hog n HIS 71 Ca 0.02 -2.62 0.00 0.00 -0.26 0.00 0.00 57.72 54.85 3hog n HIS 71 Cb 0.45 -1.21 0.00 0.00 1.12 0.00 0.00 29.99 30.35 3hog n HIS 71 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3hog n HIS 80 N 1.08 0.00 -1.72 4.41 8.25 -1.26 -5.27 115.22 120.70 3hog n HIS 80 Ca 0.29 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.33 3hog n HIS 80 Cb 0.32 -0.22 -0.01 0.00 1.12 0.00 0.00 29.99 31.21 3hog n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hog n ALA 81 N 0.34 1.87 0.00 -1.41 0.00 -1.26 -1.17 120.51 118.88 3hog n ALA 81 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3hog n ALA 81 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.09 3hog n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hog n GLY 82 N 1.38 3.17 3.55 0.00 0.00 -1.26 -4.25 105.19 107.78 3hog n GLY 82 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 3hog n GLY 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hog s ASP 83 N -0.17 6.43 0.03 1.61 -1.08 -0.32 -0.61 116.67 122.56 3hog s ASP 83 Ca 0.00 -0.03 0.28 0.00 -0.52 0.00 0.00 52.55 52.28 3hog s ASP 83 Cb 0.00 -2.38 1.10 0.00 -1.46 0.00 0.00 42.92 40.18 3hog s ASP 83 CO 0.00 -0.87 1.85 0.18 0.52 0.00 0.00 175.17 176.85 3hog n LEU 84 N 6.64 0.16 0.00 -1.34 4.32 -0.21 -5.01 117.00 121.56 3hog n LEU 84 Ca 0.02 0.46 0.00 0.00 -0.02 0.00 0.00 56.01 56.47 3hog n LEU 84 Cb 0.48 -0.45 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 3hog n LEU 84 CO 0.58 -0.01 0.00 0.61 -1.22 0.00 0.00 177.39 177.34 3hog n GLY 85 N 1.47 2.48 3.77 -0.72 0.00 -1.24 -5.02 105.19 105.92 3hog n GLY 85 Ca 0.07 -1.72 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 3hog n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hog s ASN 86 N 0.00 6.29 0.16 1.61 0.02 -1.26 -4.02 114.94 117.75 3hog s ASN 86 Ca 0.00 2.69 0.08 0.00 -1.02 0.00 0.00 52.86 54.61 3hog s ASN 86 Cb 0.00 -2.64 -0.04 0.00 0.02 0.00 0.00 41.25 38.59 3hog s ASN 86 CO 0.00 -0.86 -0.08 0.27 0.02 0.00 0.00 177.10 176.44 3hog s ILE 87 N -1.25 3.30 -0.22 0.60 -4.36 -0.30 -4.93 121.20 114.05 3hog s ILE 87 Ca 0.57 -1.54 -0.04 0.00 -0.26 0.00 0.00 60.65 59.38 3hog s ILE 87 Cb -0.39 -2.62 -0.01 0.00 1.25 0.00 0.00 42.46 40.69 3hog s ILE 87 CO 0.50 -0.06 -0.02 -0.69 0.24 0.00 0.00 174.94 174.91 3hog s VAL 88 N -1.59 3.57 -0.02 8.37 1.01 -1.26 -0.67 120.40 129.81 3hog s VAL 88 Ca 0.24 -0.43 -0.26 0.00 0.00 0.00 0.00 61.98 61.53 3hog s VAL 88 Cb -0.09 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 3hog s VAL 88 CO 0.15 0.41 0.82 0.00 0.00 0.00 0.00 175.10 176.49 3hog s ALA 89 N 1.41 3.28 1.11 5.51 0.00 -0.61 -4.43 121.76 128.03 3hog s ALA 89 Ca 0.05 0.32 -0.16 0.00 0.00 0.00 0.00 51.96 52.17 3hog s ALA 89 Cb -0.14 -3.11 0.23 0.00 0.00 0.00 0.00 23.12 20.10 3hog s ALA 89 CO -0.01 -0.11 1.04 0.27 0.00 0.00 0.00 175.76 176.95 3hog n ASN 90 N 3.60 -0.95 0.17 0.00 0.23 0.22 -1.13 115.26 117.39 3hog n ASN 90 Ca 0.01 -1.24 0.12 0.00 -0.53 0.00 0.00 54.58 52.94 3hog n ASN 90 Cb 0.51 -0.87 0.60 0.00 -2.08 0.00 0.00 39.78 37.93 3hog n ASN 90 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hog h ALA 91 N -2.24 1.00 -0.13 -2.53 0.00 -1.97 0.16 119.26 113.54 3hog h ALA 91 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3hog h ALA 91 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3hog h ALA 91 CO 0.25 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.25 3hog n ASP 92 N -2.34 1.91 -0.01 0.00 8.00 -1.26 -4.84 116.55 118.00 3hog n ASP 92 Ca -0.00 -1.69 -0.00 0.00 0.71 0.00 0.00 54.79 53.80 3hog n ASP 92 Cb 0.12 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.15 3hog n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hog n GLY 93 N 1.20 0.43 3.54 0.44 0.00 0.55 -4.71 105.19 106.65 3hog n GLY 93 Ca 0.17 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 3hog n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hog s VAL 94 N -2.00 3.90 -0.28 1.61 1.01 -1.26 -1.74 120.40 121.65 3hog s VAL 94 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.62 3hog s VAL 94 Cb 0.00 -2.68 0.06 0.00 0.00 0.00 0.00 36.38 33.76 3hog s VAL 94 CO 0.00 0.53 -0.07 0.00 0.00 0.00 0.00 175.10 175.56 3hog s ALA 95 N -0.06 2.66 -0.27 5.51 0.00 0.24 -0.61 121.76 129.22 3hog s ALA 95 Ca 0.02 -1.77 -0.00 0.00 0.00 0.00 0.00 51.96 50.21 3hog s ALA 95 Cb -0.13 -1.72 0.08 0.00 0.00 0.00 0.00 23.12 21.35 3hog s ALA 95 CO 0.03 -1.23 0.04 -2.00 0.00 0.00 0.00 175.76 172.60 3hog s GLU 96 N 1.16 1.02 0.05 0.00 2.12 -1.26 -0.79 118.70 121.00 3hog s GLU 96 Ca -0.08 -1.04 -0.05 0.00 0.36 0.00 0.00 54.97 54.17 3hog s GLU 96 Cb -0.20 -2.31 -0.02 0.00 0.26 0.00 0.00 34.13 31.86 3hog s GLU 96 CO -0.03 -0.82 0.09 0.54 -0.54 0.00 0.00 175.26 174.49 3hog s VAL 97 N 1.52 0.15 -0.10 3.70 0.11 -0.46 -5.00 120.40 120.32 3hog s VAL 97 Ca 0.04 -1.28 0.04 0.00 -2.93 0.00 0.00 61.98 57.85 3hog s VAL 97 Cb -0.18 -1.13 0.00 0.00 -1.53 0.00 0.00 36.38 33.55 3hog s VAL 97 CO -0.15 -0.70 -0.23 -0.89 -3.33 0.00 0.00 175.10 169.79 3hog s THR 98 N -3.17 1.98 0.18 5.04 2.01 -1.26 -0.27 115.64 120.14 3hog s THR 98 Ca -0.00 -0.97 0.10 0.00 0.31 0.00 0.00 61.69 61.13 3hog s THR 98 Cb 0.02 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 3hog s THR 98 CO -0.07 0.54 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.42 3hog s LEU 99 N 0.39 2.43 -0.15 4.42 1.43 0.47 -4.97 118.68 122.69 3hog s LEU 99 Ca -0.18 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.07 3hog s LEU 99 Cb -0.18 -1.01 0.02 0.00 0.03 0.00 0.00 46.19 45.05 3hog s LEU 99 CO 0.08 0.05 -0.14 -0.69 0.23 0.00 0.00 176.35 175.89 3hog s VAL 100 N -1.78 1.57 -0.07 -1.59 1.01 -1.26 -0.15 120.40 118.13 3hog s VAL 100 Ca 0.18 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.54 3hog s VAL 100 Cb -0.07 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.82 3hog s VAL 100 CO 0.08 0.44 -0.18 -0.62 0.00 0.00 0.00 175.10 174.82 3hog s ASP 101 N 1.48 2.36 -0.14 3.32 -1.08 -0.06 -4.93 116.67 117.62 3hog s ASP 101 Ca 0.05 -0.41 0.08 0.00 -0.52 0.00 0.00 52.55 51.75 3hog s ASP 101 Cb -0.13 -0.95 0.48 0.00 -1.46 0.00 0.00 42.92 40.86 3hog s ASP 101 CO -0.11 0.12 1.25 0.59 0.52 0.00 0.00 175.17 177.54 3hog n ASN 102 N 3.50 3.78 -2.77 -0.34 3.02 -1.26 -0.62 115.26 120.57 3hog n ASN 102 Ca -0.20 -2.56 -0.03 0.00 -0.03 0.00 0.00 54.58 51.75 3hog n ASN 102 Cb 0.52 -0.61 0.05 0.00 -0.61 0.00 0.00 39.78 39.13 3hog n ASN 102 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hog n GLN 103 N 0.34 1.50 -3.60 3.52 6.02 -1.26 -4.95 117.38 118.95 3hog n GLN 103 Ca 0.17 -3.26 -0.28 0.00 -0.01 0.00 0.00 57.00 53.62 3hog n GLN 103 Cb 0.82 -1.34 -0.11 0.00 1.02 0.00 0.00 30.24 30.63 3hog n GLN 103 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3hog s ILE 104 N -3.28 1.17 0.18 5.09 1.01 -1.26 -4.38 121.20 119.74 3hog s ILE 104 Ca 0.26 -2.90 -0.30 0.00 0.00 0.00 0.00 60.65 57.71 3hog s ILE 104 Cb 0.38 -1.80 -0.08 0.00 0.01 0.00 0.00 42.46 40.97 3hog s ILE 104 CO -0.02 -1.07 1.12 -2.16 0.00 0.00 0.00 174.94 172.81 3hog s PRO 105 N -0.10 4.57 0.00 2.79 0.04 -1.26 -4.72 135.00 136.32 3hog s PRO 105 Ca 0.26 1.76 0.23 0.00 0.04 0.00 0.00 61.00 63.29 3hog s PRO 105 Cb -0.08 -3.26 0.23 0.00 0.04 0.00 0.00 34.50 31.42 3hog s PRO 105 CO -0.12 0.04 1.26 1.28 0.04 0.00 0.00 177.00 179.50 3hog n LEU 106 N 2.35 3.02 -4.24 -3.56 4.77 -1.26 -1.61 117.00 116.47 3hog n LEU 106 Ca 0.03 -1.10 -0.13 0.00 -0.03 0.00 0.00 56.01 54.77 3hog n LEU 106 Cb 0.46 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 3hog n LEU 106 CO 0.54 0.54 -0.35 0.42 -1.33 0.00 0.00 177.39 177.22 3hog s THR 107 N -1.82 0.76 0.00 -5.08 -4.23 -1.26 -4.77 115.64 99.24 3hog s THR 107 Ca 0.29 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 3hog s THR 107 Cb 0.20 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.99 3hog s THR 107 CO 0.29 -0.55 0.00 0.61 -0.54 0.00 0.00 174.62 174.43 3hog n GLY 108 N -0.22 -0.38 0.22 3.99 0.00 -1.26 -3.66 105.19 103.87 3hog n GLY 108 Ca -0.08 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.18 3hog n GLY 108 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hog h PRO 109 N 0.00 0.00 -0.48 1.61 0.11 -2.00 -2.41 132.00 128.83 3hog h PRO 109 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 3hog h PRO 109 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 3hog h PRO 109 CO 0.00 0.26 0.05 0.09 -0.21 0.00 0.00 178.00 178.18 3hog n ASN 110 N -3.92 4.74 -4.54 -2.05 5.03 -1.26 -5.01 115.26 108.25 3hog n ASN 110 Ca -0.02 -3.06 -0.41 0.00 0.87 0.00 0.00 54.58 51.96 3hog n ASN 110 Cb 0.34 -0.64 0.01 0.00 -1.02 0.00 0.00 39.78 38.47 3hog n ASN 110 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 3hog n SER 111 N -0.03 0.22 -0.16 6.41 2.88 -0.91 -4.78 113.62 117.24 3hog n SER 111 Ca 0.28 0.95 0.13 0.00 -1.33 0.00 0.00 58.87 58.91 3hog n SER 111 Cb 1.12 -1.25 0.46 0.00 -0.75 0.00 0.00 64.21 63.79 3hog n SER 111 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3hog n VAL 112 N -0.80 0.00 -1.73 2.46 0.24 -0.63 -4.80 118.33 113.06 3hog n VAL 112 Ca 0.11 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.34 61.90 3hog n VAL 112 Cb 0.40 0.16 -0.03 0.00 -1.47 0.00 0.00 33.84 32.90 3hog n VAL 112 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3hog s VAL 113 N -2.55 2.11 0.00 3.34 1.01 -1.26 -0.80 120.40 122.24 3hog s VAL 113 Ca 0.24 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.26 3hog s VAL 113 Cb 0.19 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.55 3hog s VAL 113 CO 0.52 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.23 3hog n GLY 114 N 4.00 0.96 0.00 4.51 0.00 0.98 -5.00 105.19 110.65 3hog n GLY 114 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3hog n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hog n ARG 115 N -2.00 3.12 -4.17 1.61 1.74 0.01 -2.13 116.66 114.85 3hog n ARG 115 Ca 0.00 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 3hog n ARG 115 Cb 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.33 3hog n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hog s ALA 116 N -2.05 1.09 -0.07 7.54 0.00 -1.01 -0.93 121.76 126.33 3hog s ALA 116 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.87 3hog s ALA 116 Cb 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 3hog s ALA 116 CO 0.00 0.03 -0.05 -0.51 0.00 0.00 0.00 175.76 175.23 3hog s LEU 117 N -2.14 3.27 -0.01 0.00 1.43 -0.70 -0.54 118.68 119.99 3hog s LEU 117 Ca 0.02 0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 3hog s LEU 117 Cb -0.06 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.44 3hog s LEU 117 CO 0.01 0.36 -0.04 -0.69 0.23 0.00 0.00 176.35 176.22 3hog s VAL 118 N -0.81 0.39 -0.20 -1.59 1.01 -0.24 -2.04 120.40 116.93 3hog s VAL 118 Ca 0.12 -0.16 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 3hog s VAL 118 Cb -0.11 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 3hog s VAL 118 CO 0.02 0.14 0.12 -0.69 0.00 0.00 0.00 175.10 174.68 3hog s VAL 119 N 0.22 5.32 0.01 2.92 1.01 -0.31 -1.69 120.40 127.88 3hog s VAL 119 Ca -0.02 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.15 3hog s VAL 119 Cb -0.06 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3hog s VAL 119 CO -0.00 0.44 -0.06 -1.00 0.00 0.00 0.00 175.10 174.48 3hog s HIS 120 N 0.35 2.91 0.21 5.22 3.76 0.20 -1.34 115.29 126.60 3hog s HIS 120 Ca 0.07 -0.02 -0.30 0.00 -0.15 0.00 0.00 55.06 54.66 3hog s HIS 120 Cb -0.11 -1.61 -0.08 0.00 1.11 0.00 0.00 32.58 31.88 3hog s HIS 120 CO -0.02 0.39 1.17 -2.00 -0.85 0.00 0.00 174.74 173.43 3hog s GLU 121 N -1.46 4.53 -0.65 1.40 2.12 -1.26 -0.78 118.70 122.59 3hog s GLU 121 Ca 0.18 1.85 0.03 0.00 0.36 0.00 0.00 54.97 57.39 3hog s GLU 121 Cb -0.11 -3.23 0.37 0.00 0.26 0.00 0.00 34.13 31.42 3hog s GLU 121 CO 0.08 -0.02 1.37 1.28 -0.54 0.00 0.00 175.26 177.44 3hog n LEU 122 N 2.19 5.66 0.00 2.70 4.32 -1.26 -4.77 117.00 125.83 3hog n LEU 122 Ca 0.03 -5.28 0.00 0.00 -0.02 0.00 0.00 56.01 50.74 3hog n LEU 122 Cb 0.45 -0.72 0.00 0.00 -1.62 0.00 0.00 43.42 41.53 3hog n LEU 122 CO 0.55 2.14 0.00 0.61 -1.22 0.00 0.00 177.39 179.47 3hog n GLY 142 N -0.37 0.53 3.45 -0.72 0.00 -1.26 -5.13 105.19 101.69 3hog n GLY 142 Ca 0.41 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 3hog n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hog s ARG 143 N 0.00 3.20 0.07 1.61 0.52 -1.26 -4.33 118.95 118.76 3hog s ARG 143 Ca 0.00 -1.03 -0.14 0.00 -0.52 0.00 0.00 55.73 54.03 3hog s ARG 143 Cb 0.00 -4.37 -0.21 0.00 0.52 0.00 0.00 34.95 30.88 3hog s ARG 143 CO 0.00 -1.80 1.21 -0.07 0.02 0.00 0.00 175.30 174.66 3hog h LEU 144 N 11.13 0.88 -7.28 2.53 3.38 -1.57 -3.45 115.31 120.94 3hog h LEU 144 Ca -0.20 -0.71 -0.05 0.00 0.09 0.00 0.00 57.88 57.01 3hog h LEU 144 Cb 1.06 -0.27 -0.13 0.00 0.09 0.00 0.00 40.66 41.41 3hog h LEU 144 CO 1.17 1.47 0.01 0.00 0.09 0.00 0.00 178.44 181.18 3hog s ALA 145 N -3.42 -1.14 0.10 1.53 0.00 -1.22 -4.00 121.76 113.60 3hog s ALA 145 Ca -0.10 0.15 -0.25 0.00 0.00 0.00 0.00 51.96 51.76 3hog s ALA 145 Cb 0.07 0.71 0.08 0.00 0.00 0.00 0.00 23.12 23.98 3hog s ALA 145 CO 0.91 -0.66 0.73 0.00 0.00 0.00 0.00 175.76 176.73 3hog s GLY 147 N -2.65 -0.57 -0.01 0.00 0.00 -0.86 -1.76 107.32 101.47 3hog s GLY 147 Ca 0.03 0.67 -0.17 0.00 0.00 0.00 0.00 44.72 45.25 3hog s GLY 147 CO -0.11 0.34 0.49 0.14 0.00 0.00 0.00 173.10 173.96 3hog s VAL 148 N -2.98 4.99 -0.33 1.40 1.01 -1.26 -1.72 120.40 121.50 3hog s VAL 148 Ca -0.03 1.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.67 3hog s VAL 148 Cb -0.01 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.58 3hog s VAL 148 CO -0.06 0.49 1.10 -0.69 0.00 0.00 0.00 175.10 175.93 3hog s VAL 149 N -0.52 4.46 0.27 2.92 1.01 -0.11 -4.40 120.40 124.03 3hog s VAL 149 Ca 0.26 1.67 0.11 0.00 0.00 0.00 0.00 61.98 64.02 3hog s VAL 149 Cb -0.17 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.75 3hog s VAL 149 CO 0.14 -0.52 -0.12 -0.83 0.00 0.00 0.00 175.10 173.77 3hog s GLY 150 N 1.79 1.78 0.54 4.51 0.00 0.21 -0.01 107.32 116.15 3hog s GLY 150 Ca 0.46 -1.77 -0.18 0.00 0.00 0.00 0.00 44.72 43.23 3hog s GLY 150 CO 0.17 -1.84 1.07 1.08 0.00 0.00 0.00 173.10 173.58 3hog s LEU 151 N -3.53 3.69 0.03 0.66 1.43 -1.26 -0.87 118.68 118.84 3hog s LEU 151 Ca 0.30 1.95 -0.07 0.00 -1.03 0.00 0.00 54.13 55.28 3hog s LEU 151 Cb -0.06 -4.56 -0.00 0.00 0.03 0.00 0.00 46.19 41.60 3hog s LEU 151 CO 0.17 -1.05 0.14 0.28 0.23 0.00 0.00 176.35 176.11 3hog s THR 152 N -2.10 0.12 0.22 5.49 -1.32 -1.11 -4.75 115.64 112.18 3hog s THR 152 Ca 0.67 -0.97 -0.31 0.00 -1.21 0.00 0.00 61.69 59.87 3hog s THR 152 Cb -0.18 -0.84 -0.14 0.00 -1.51 0.00 0.00 72.50 69.83 3hog s THR 152 CO 0.28 -0.53 1.24 -2.65 -2.21 0.00 0.00 174.62 170.74 3hog n PRO 153 N 0.83 1.54 0.00 7.08 -0.02 -1.26 -4.40 135.00 138.78 3hog n PRO 153 Ca -0.19 0.55 0.13 0.00 -2.02 0.00 0.00 63.50 61.97 3hog n PRO 153 Cb 0.58 -2.09 0.78 0.00 -0.02 0.00 0.00 33.50 32.76 3hog n PRO 153 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59