#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1foe s GLN 2 N 0.00 4.37 0.06 2.12 0.74 -1.26 -4.83 119.66 120.85 1foe s GLN 2 Ca 0.00 2.11 0.04 0.00 0.05 0.00 0.00 55.36 57.55 1foe s GLN 2 Cb 0.00 -3.17 -0.04 0.00 1.10 0.00 0.00 33.01 30.90 1foe s GLN 2 CO 0.00 -0.28 -0.00 0.00 -0.55 0.00 0.00 175.29 174.46 1foe s ALA 3 N 0.03 3.28 -0.04 1.58 0.00 -1.26 0.11 121.76 125.46 1foe s ALA 3 Ca 0.57 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 51.50 1foe s ALA 3 Cb -0.38 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.51 1foe s ALA 3 CO 0.40 0.68 -0.12 0.42 0.00 0.00 0.00 175.76 177.14 1foe s ILE 4 N -1.22 1.03 -0.17 0.00 -1.09 -0.41 -4.89 121.20 114.45 1foe s ILE 4 Ca 0.23 -0.48 -0.01 0.00 -2.23 0.00 0.00 60.65 58.16 1foe s ILE 4 Cb -0.12 -0.91 -0.00 0.00 -1.58 0.00 0.00 42.46 39.85 1foe s ILE 4 CO 0.15 0.31 -0.12 -0.75 -1.23 0.00 0.00 174.94 173.31 1foe s LYS 5 N 0.24 3.28 -0.16 2.79 2.47 -1.26 -0.10 119.74 127.00 1foe s LYS 5 Ca -0.05 -0.71 -0.01 0.00 -1.56 0.00 0.00 55.97 53.64 1foe s LYS 5 Cb -0.11 -2.73 -0.01 0.00 -1.46 0.00 0.00 37.83 33.52 1foe s LYS 5 CO 0.01 -0.02 -0.11 0.00 0.16 0.00 0.00 175.35 175.40 1foe s VAL 7 N 0.67 3.18 -0.22 0.00 1.01 -0.92 -1.30 120.40 122.82 1foe s VAL 7 Ca -0.05 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 1foe s VAL 7 Cb -0.15 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 1foe s VAL 7 CO 0.02 0.45 0.56 -0.69 0.00 0.00 0.00 175.10 175.45 1foe s VAL 8 N 1.32 5.06 0.43 2.92 1.01 -0.94 -1.81 120.40 128.39 1foe s VAL 8 Ca 0.04 1.02 0.03 0.00 0.00 0.00 0.00 61.98 63.07 1foe s VAL 8 Cb -0.14 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1foe s VAL 8 CO -0.04 0.12 0.06 0.68 0.00 0.00 0.00 175.10 175.92 1foe s VAL 9 N 2.00 1.11 0.00 2.92 -7.23 0.18 -3.95 120.40 115.42 1foe s VAL 9 Ca 0.25 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 1foe s VAL 9 Cb -0.16 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1foe s VAL 9 CO 0.09 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.49 1foe n GLY 10 N -0.99 3.55 2.28 2.32 0.00 -1.26 -1.16 105.19 109.93 1foe n GLY 10 Ca -0.09 -1.80 -0.27 0.00 0.00 0.00 0.00 46.02 43.85 1foe n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1foe n ASP 11 N 0.00 -2.54 -4.85 1.61 10.43 -1.26 -4.91 116.55 115.02 1foe n ASP 11 Ca 0.00 0.47 -0.32 0.00 2.57 0.00 0.00 54.79 57.51 1foe n ASP 11 Cb 0.00 -0.60 -0.02 0.00 1.84 0.00 0.00 41.12 42.34 1foe n ASP 11 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1foe s GLY 12 N -0.70 1.93 -0.67 0.44 0.00 -1.26 -3.83 107.32 103.23 1foe s GLY 12 Ca 0.40 0.06 -0.02 0.00 0.00 0.00 0.00 44.72 45.15 1foe s GLY 12 CO 0.46 0.32 0.33 0.00 0.00 0.00 0.00 173.10 174.21 1foe n ALA 13 N -1.89 -0.47 0.01 3.20 0.00 -1.26 -4.91 120.51 115.19 1foe n ALA 13 Ca 0.06 0.14 0.04 0.00 0.00 0.00 0.00 53.44 53.68 1foe n ALA 13 Cb 0.54 -2.18 -0.06 0.00 0.00 0.00 0.00 19.45 17.75 1foe n ALA 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1foe n VAL 14 N -3.76 0.00 0.00 0.00 0.31 -1.25 -4.90 118.33 108.74 1foe n VAL 14 Ca -0.04 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1foe n VAL 14 Cb 0.55 0.36 0.00 0.00 -0.91 0.00 0.00 33.84 33.84 1foe n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1foe n GLY 15 N 2.03 1.09 0.39 2.92 0.00 -1.26 -4.46 105.19 105.90 1foe n GLY 15 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1foe n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1foe n LYS 16 N -0.41 -0.41 -0.12 1.61 5.02 -1.26 0.51 118.16 123.10 1foe n LYS 16 Ca 0.00 1.46 -0.08 0.00 -2.02 0.00 0.00 58.31 57.67 1foe n LYS 16 Cb 0.00 -2.15 -0.00 0.00 -0.02 0.00 0.00 35.03 32.86 1foe n LYS 16 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1foe h THR 17 N 0.00 1.11 0.37 -0.18 2.02 -1.94 -0.72 112.91 113.56 1foe h THR 17 Ca 0.15 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1foe h THR 17 Cb 0.38 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1foe h THR 17 CO -0.87 0.11 -0.20 0.00 0.37 0.00 0.00 175.52 174.93 1foe h LEU 19 N -0.53 -1.34 -1.40 0.00 6.46 0.26 0.52 115.31 119.29 1foe h LEU 19 Ca -0.05 0.23 -0.00 0.00 -0.12 0.00 0.00 57.88 57.94 1foe h LEU 19 Cb 0.42 0.63 -0.03 0.00 -0.73 0.00 0.00 40.66 40.95 1foe h LEU 19 CO 0.06 -0.33 0.31 -0.07 -0.62 0.00 0.00 178.44 177.80 1foe h LEU 20 N -0.22 0.63 0.12 2.25 3.38 -0.94 -0.58 115.31 119.96 1foe h LEU 20 Ca 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1foe h LEU 20 Cb 0.56 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1foe h LEU 20 CO -0.67 0.49 -0.06 0.40 0.09 0.00 0.00 178.44 178.70 1foe h ILE 21 N 0.73 1.05 -0.53 1.22 2.04 0.58 -1.97 117.51 120.64 1foe h ILE 21 Ca 0.19 -1.10 0.11 0.00 1.00 0.00 0.00 64.86 65.06 1foe h ILE 21 Cb -0.02 1.70 -0.11 0.00 -0.74 0.00 0.00 36.82 37.65 1foe h ILE 21 CO -0.04 0.25 -0.23 -1.28 0.00 0.00 0.00 178.15 176.85 1foe h SER 22 N -0.72 -0.80 0.00 1.72 0.87 0.18 0.43 113.55 115.23 1foe h SER 22 Ca -0.02 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1foe h SER 22 Cb 0.53 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 1foe h SER 22 CO 0.03 -0.25 0.00 0.00 -0.53 0.00 0.00 176.83 176.08 1foe n TYR 23 N -5.42 0.00 0.24 2.24 9.36 -0.25 0.34 117.16 123.67 1foe n TYR 23 Ca 0.05 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.38 1foe n TYR 23 Cb 0.33 -0.38 0.60 0.00 -0.63 0.00 0.00 39.34 39.25 1foe n TYR 23 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1foe h THR 24 N 0.00 0.00 -0.00 2.97 1.35 -1.16 0.14 112.91 116.21 1foe h THR 24 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1foe h THR 24 Cb 0.00 0.48 0.00 0.00 -1.73 0.00 0.00 68.15 66.90 1foe h THR 24 CO 0.00 0.00 -0.47 1.07 -0.25 0.00 0.00 175.52 175.87 1foe n THR 25 N -2.44 0.00 -3.09 6.82 5.66 0.15 -4.99 114.28 116.39 1foe n THR 25 Ca -0.01 -0.27 -0.22 0.00 -3.05 0.00 0.00 64.05 60.50 1foe n THR 25 Cb 0.30 1.04 0.02 0.00 -1.55 0.00 0.00 70.33 70.15 1foe n THR 25 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1foe n ASN 26 N -0.96 -5.36 -3.56 1.09 3.02 0.15 -4.95 115.26 104.69 1foe n ASN 26 Ca 0.03 -0.30 -0.01 0.00 -0.03 0.00 0.00 54.58 54.27 1foe n ASN 26 Cb 0.21 -4.36 -0.06 0.00 -0.61 0.00 0.00 39.78 34.96 1foe n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1foe s ALA 27 N -3.09 -2.37 0.30 5.41 0.00 -0.90 -5.04 121.76 116.07 1foe s ALA 27 Ca 0.32 2.18 -0.30 0.00 0.00 0.00 0.00 51.96 54.16 1foe s ALA 27 Cb -0.15 -1.81 -0.12 0.00 0.00 0.00 0.00 23.12 21.04 1foe s ALA 27 CO 0.39 -0.59 1.48 0.34 0.00 0.00 0.00 175.76 177.38 1foe n PHE 28 N 4.29 2.58 -0.28 0.00 7.35 -1.26 -4.30 117.46 125.85 1foe n PHE 28 Ca -0.15 0.38 0.03 0.00 -0.76 0.00 0.00 57.45 56.95 1foe n PHE 28 Cb 0.55 -2.52 0.17 0.00 0.35 0.00 0.00 39.48 38.03 1foe n PHE 28 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1foe h PRO 29 N 4.01 0.68 0.00 -7.13 0.13 -1.88 -3.49 132.00 124.32 1foe h PRO 29 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1foe h PRO 29 Cb 1.25 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1foe h PRO 29 CO 0.73 0.45 0.00 0.41 -0.23 0.00 0.00 178.00 179.36 1foe n GLY 30 N -1.32 0.45 0.20 1.56 0.00 -1.26 -4.56 105.19 100.27 1foe n GLY 30 Ca 0.13 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.33 1foe n GLY 30 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1foe h GLU 31 N 0.00 0.53 -4.52 1.61 5.08 -2.05 -3.40 114.58 111.82 1foe h GLU 31 Ca 0.00 -0.41 -0.71 0.00 -1.00 0.00 0.00 59.36 57.24 1foe h GLU 31 Cb 0.00 0.08 -0.24 0.00 0.50 0.00 0.00 28.75 29.08 1foe h GLU 31 CO 0.00 1.03 -0.48 -0.47 -1.00 0.00 0.00 179.01 178.09 1foe s TYR 32 N -3.75 3.26 -0.42 4.33 5.04 -1.26 -5.05 117.35 119.49 1foe s TYR 32 Ca -0.07 -1.00 -0.17 0.00 -2.44 0.00 0.00 57.07 53.38 1foe s TYR 32 Cb 0.10 -2.61 0.02 0.00 0.35 0.00 0.00 41.96 39.83 1foe s TYR 32 CO 0.85 -0.69 0.43 0.42 -1.34 0.00 0.00 175.55 175.23 1foe s ILE 33 N 1.56 5.09 0.62 3.14 1.01 -1.26 -4.84 121.20 126.52 1foe s ILE 33 Ca 0.03 -0.39 -0.17 0.00 0.00 0.00 0.00 60.65 60.11 1foe s ILE 33 Cb -0.20 -4.05 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 1foe s ILE 33 CO 0.06 -0.44 0.51 -2.65 0.00 0.00 0.00 174.94 172.43 1foe n PRO 34 N 5.58 0.44 -0.04 2.79 -0.02 -1.26 -4.92 135.00 137.57 1foe n PRO 34 Ca -0.08 0.18 -0.10 0.00 -2.02 0.00 0.00 63.50 61.48 1foe n PRO 34 Cb 0.47 -1.73 -0.14 0.00 -0.02 0.00 0.00 33.50 32.08 1foe n PRO 34 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1foe n THR 35 N -1.92 1.56 -3.96 3.45 -1.04 -1.26 -4.77 114.28 106.35 1foe n THR 35 Ca 0.11 -0.79 -0.36 0.00 -2.04 0.00 0.00 64.05 60.97 1foe n THR 35 Cb 0.48 -0.96 -0.08 0.00 -1.82 0.00 0.00 70.33 67.95 1foe n THR 35 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1foe s VAL 36 N -2.56 5.16 -0.32 12.58 1.01 -1.26 -4.97 120.40 130.04 1foe s VAL 36 Ca -0.09 0.08 -0.00 0.00 0.00 0.00 0.00 61.98 61.97 1foe s VAL 36 Cb 0.07 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.29 1foe s VAL 36 CO 0.81 0.56 0.10 0.12 0.00 0.00 0.00 175.10 176.69 1foe s PHE 37 N -0.50 1.92 0.85 5.22 5.36 -1.26 -5.11 117.98 124.46 1foe s PHE 37 Ca 0.11 -1.89 -0.12 0.00 -0.96 0.00 0.00 56.93 54.07 1foe s PHE 37 Cb -0.12 -1.84 0.11 0.00 -0.34 0.00 0.00 43.02 40.83 1foe s PHE 37 CO 0.02 -0.88 1.18 -0.51 -1.46 0.00 0.00 175.22 173.57 1foe s ASP 38 N 1.49 3.32 0.04 6.13 1.01 -1.26 -4.51 116.67 122.89 1foe s ASP 38 Ca 0.10 2.28 -0.32 0.00 0.71 0.00 0.00 52.55 55.32 1foe s ASP 38 Cb -0.18 -2.58 -0.11 0.00 1.01 0.00 0.00 42.92 41.06 1foe s ASP 38 CO -0.22 -2.84 1.83 0.59 0.21 0.00 0.00 175.17 174.74 1foe n ASN 39 N -3.70 3.70 -4.91 0.27 3.02 -1.26 -4.86 115.26 107.52 1foe n ASN 39 Ca 0.13 0.98 -0.32 0.00 -0.03 0.00 0.00 54.58 55.34 1foe n ASN 39 Cb 0.51 -1.46 -0.04 0.00 -0.61 0.00 0.00 39.78 38.18 1foe n ASN 39 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1foe s TYR 40 N 3.16 3.53 -0.19 3.10 5.04 0.16 -4.94 117.35 127.21 1foe s TYR 40 Ca 0.86 0.34 -0.09 0.00 -2.44 0.00 0.00 57.07 55.73 1foe s TYR 40 Cb -0.58 -1.82 0.07 0.00 0.35 0.00 0.00 41.96 39.98 1foe s TYR 40 CO 0.43 0.60 0.45 0.45 -1.34 0.00 0.00 175.55 176.13 1foe s SER 41 N -2.26 -0.52 -0.06 4.32 0.15 -1.26 0.32 113.70 114.39 1foe s SER 41 Ca 0.33 1.00 -0.20 0.00 0.70 0.00 0.00 55.95 57.77 1foe s SER 41 Cb -0.13 0.99 0.04 0.00 -1.71 0.00 0.00 66.02 65.22 1foe s SER 41 CO 0.24 -0.21 0.46 0.00 1.20 0.00 0.00 173.24 174.93 1foe s ALA 42 N 1.72 -1.17 0.13 5.45 0.00 -0.38 -4.98 121.76 122.54 1foe s ALA 42 Ca -0.08 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.42 1foe s ALA 42 Cb -0.09 -0.12 -0.07 0.00 0.00 0.00 0.00 23.12 22.84 1foe s ALA 42 CO -0.14 -0.29 1.14 -0.80 0.00 0.00 0.00 175.76 175.67 1foe s ASN 43 N -0.97 7.19 -0.00 0.00 0.01 -1.26 0.33 114.94 120.23 1foe s ASN 43 Ca -0.10 2.06 0.00 0.00 -0.71 0.00 0.00 52.86 54.11 1foe s ASN 43 Cb -0.03 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.04 1foe s ASN 43 CO 0.05 -0.33 0.00 -0.69 -1.51 0.00 0.00 177.10 174.63 1foe s VAL 44 N 0.28 0.01 -0.15 1.60 1.01 0.38 -4.89 120.40 118.63 1foe s VAL 44 Ca 0.53 0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.49 1foe s VAL 44 Cb -0.29 -0.03 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 1foe s VAL 44 CO 0.33 0.02 -0.02 -0.32 0.00 0.00 0.00 175.10 175.10 1foe s MET 45 N 0.15 3.64 -0.05 2.72 1.75 -1.26 -0.00 119.30 126.24 1foe s MET 45 Ca -0.01 -0.49 -0.02 0.00 -1.25 0.00 0.00 55.69 53.92 1foe s MET 45 Cb -0.02 -2.93 0.04 0.00 2.84 0.00 0.00 34.83 34.75 1foe s MET 45 CO -0.00 0.29 0.09 0.08 -0.65 0.00 0.00 175.02 174.83 1foe s VAL 46 N 0.24 -0.14 -1.43 10.11 1.01 -0.24 -4.82 120.40 125.12 1foe s VAL 46 Ca -0.02 0.34 -0.10 0.00 0.00 0.00 0.00 61.98 62.21 1foe s VAL 46 Cb -0.14 -0.19 0.05 0.00 0.00 0.00 0.00 36.38 36.10 1foe s VAL 46 CO 0.02 0.14 1.03 0.47 0.00 0.00 0.00 175.10 176.77 1foe n ASP 47 N 4.99 -4.86 0.00 3.32 8.00 -1.26 -1.55 116.55 125.19 1foe n ASP 47 Ca -0.11 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.70 1foe n ASP 47 Cb 0.50 -4.38 0.00 0.00 -0.02 0.00 0.00 41.12 37.22 1foe n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1foe n GLY 48 N -1.77 2.11 3.65 0.44 0.00 -1.26 -4.98 105.19 103.38 1foe n GLY 48 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1foe n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1foe s LYS 49 N -0.02 4.12 0.08 1.61 1.02 -0.59 -5.07 119.74 120.89 1foe s LYS 49 Ca 0.00 0.08 -0.25 0.00 0.02 0.00 0.00 55.97 55.82 1foe s LYS 49 Cb 0.00 -3.56 -0.06 0.00 -0.52 0.00 0.00 37.83 33.68 1foe s LYS 49 CO 0.00 -0.08 0.79 -1.25 -0.92 0.00 0.00 175.35 173.89 1foe s PRO 50 N 1.44 4.53 0.08 -1.68 0.04 -1.26 -1.08 135.00 137.07 1foe s PRO 50 Ca 0.16 1.13 -0.08 0.00 0.04 0.00 0.00 61.00 62.25 1foe s PRO 50 Cb -0.15 -3.34 -0.00 0.00 0.04 0.00 0.00 34.50 31.05 1foe s PRO 50 CO 0.08 0.35 0.17 0.14 0.04 0.00 0.00 177.00 177.78 1foe s VAL 51 N -0.34 0.15 -0.42 -0.36 -7.23 1.00 -4.52 120.40 108.66 1foe s VAL 51 Ca 0.39 -1.21 -0.11 0.00 -1.81 0.00 0.00 61.98 59.24 1foe s VAL 51 Cb -0.21 -1.32 0.07 0.00 0.56 0.00 0.00 36.38 35.47 1foe s VAL 51 CO 0.24 -0.67 0.28 0.21 -0.31 0.00 0.00 175.10 174.86 1foe s ASN 52 N -2.81 5.75 -0.13 4.85 3.04 0.12 0.14 114.94 125.90 1foe s ASN 52 Ca 0.04 -1.41 -0.27 0.00 0.04 0.00 0.00 52.86 51.26 1foe s ASN 52 Cb 0.05 -2.03 -0.01 0.00 -1.54 0.00 0.00 41.25 37.71 1foe s ASN 52 CO -0.10 -0.54 0.92 -0.22 -3.04 0.00 0.00 177.10 174.11 1foe s LEU 53 N 1.48 4.23 -0.15 3.21 2.96 0.15 -1.29 118.68 129.27 1foe s LEU 53 Ca 0.03 1.37 -0.03 0.00 -0.22 0.00 0.00 54.13 55.28 1foe s LEU 53 Cb -0.23 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 1foe s LEU 53 CO 0.03 -0.40 -0.05 -0.83 -1.32 0.00 0.00 176.35 173.78 1foe s GLY 54 N 1.10 1.69 -0.12 7.98 0.00 0.86 -1.25 107.32 117.58 1foe s GLY 54 Ca 0.44 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 44.36 1foe s GLY 54 CO 0.16 -0.10 -0.22 1.08 0.00 0.00 0.00 173.10 174.01 1foe s LEU 55 N 0.32 2.08 -0.15 0.66 1.43 0.15 0.52 118.68 123.69 1foe s LEU 55 Ca -0.05 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1foe s LEU 55 Cb -0.14 -1.40 0.01 0.00 0.03 0.00 0.00 46.19 44.68 1foe s LEU 55 CO 0.03 0.11 -0.20 0.26 0.23 0.00 0.00 176.35 176.78 1foe s TRP 56 N 0.60 2.70 0.70 0.29 0.52 -0.42 -0.66 118.94 122.68 1foe s TRP 56 Ca -0.13 -1.33 -0.07 0.00 0.02 0.00 0.00 56.10 54.59 1foe s TRP 56 Cb -0.17 -1.84 0.05 0.00 -1.15 0.00 0.00 33.47 30.37 1foe s TRP 56 CO 0.03 -0.61 1.02 0.34 0.02 0.00 0.00 176.95 177.75 1foe s ASP 57 N 0.88 4.91 -0.00 2.95 -1.08 -1.26 -2.20 116.67 120.86 1foe s ASP 57 Ca -0.05 0.56 0.12 0.00 -0.52 0.00 0.00 52.55 52.66 1foe s ASP 57 Cb -0.15 -1.24 0.20 0.00 -1.46 0.00 0.00 42.92 40.27 1foe s ASP 57 CO -0.03 -1.55 1.08 0.35 0.52 0.00 0.00 175.17 175.54 1foe n THR 58 N -2.93 0.02 -1.95 1.71 -2.24 -1.25 -4.87 114.28 102.77 1foe n THR 58 Ca 0.07 -0.48 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1foe n THR 58 Cb 0.60 0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 69.54 1foe n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1foe s ALA 59 N -0.03 3.57 0.00 6.98 0.00 -1.26 -2.59 121.76 128.43 1foe s ALA 59 Ca 0.16 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.53 1foe s ALA 59 Cb 0.18 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1foe s ALA 59 CO -0.08 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.25 1foe n GLY 60 N 1.02 1.03 0.15 0.00 0.00 -1.26 -4.88 105.19 101.25 1foe n GLY 60 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.06 1foe n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1foe n GLN 61 N -2.00 1.41 0.20 1.61 10.64 -1.07 -4.69 117.38 123.48 1foe n GLN 61 Ca 0.00 -1.22 0.14 0.00 -1.83 0.00 0.00 57.00 54.09 1foe n GLN 61 Cb 0.00 -1.06 0.65 0.00 -0.86 0.00 0.00 30.24 28.97 1foe n GLN 61 CO 0.00 0.00 0.00 1.05 -1.83 0.00 0.00 177.06 176.28 1foe h GLU 62 N 0.55 0.00 -0.05 2.61 9.09 -1.90 -2.66 114.58 122.22 1foe h GLU 62 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1foe h GLU 62 Cb 0.37 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.47 1foe h GLU 62 CO 0.00 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.81 1foe n ASP 63 N -2.54 2.84 -4.06 3.06 8.00 -1.26 -4.74 116.55 117.85 1foe n ASP 63 Ca 0.00 -1.91 -0.35 0.00 0.71 0.00 0.00 54.79 53.25 1foe n ASP 63 Cb 0.18 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.18 1foe n ASP 63 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1foe s TYR 64 N -1.78 3.69 0.09 1.24 1.51 -1.00 -4.95 117.35 116.15 1foe s TYR 64 Ca 0.26 -3.01 0.10 0.00 -1.01 0.00 0.00 57.07 53.41 1foe s TYR 64 Cb 0.18 -3.13 0.53 0.00 -0.11 0.00 0.00 41.96 39.44 1foe s TYR 64 CO 0.27 -0.73 1.16 -0.40 -1.11 0.00 0.00 175.55 174.74 1foe n ASP 65 N 2.58 0.25 -0.00 2.29 5.75 -1.26 -0.69 116.55 125.47 1foe n ASP 65 Ca 0.17 0.48 0.06 0.00 -0.01 0.00 0.00 54.79 55.48 1foe n ASP 65 Cb 0.37 -0.38 -0.07 0.00 -1.03 0.00 0.00 41.12 40.00 1foe n ASP 65 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1foe n ARG 66 N -1.96 2.06 -0.09 0.11 3.00 -1.26 -4.53 116.66 113.98 1foe n ARG 66 Ca -0.01 -0.04 -0.18 0.00 -0.01 0.00 0.00 57.85 57.61 1foe n ARG 66 Cb 0.42 -1.13 -0.13 0.00 0.00 0.00 0.00 32.46 31.62 1foe n ARG 66 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1foe n LEU 67 N -1.53 2.56 -0.23 0.55 4.77 0.13 -4.52 117.00 118.72 1foe n LEU 67 Ca 0.00 -0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 55.93 1foe n LEU 67 Cb 0.23 -0.79 0.04 0.00 -2.33 0.00 0.00 43.42 40.57 1foe n LEU 67 CO 0.24 0.86 0.67 -0.09 -1.33 0.00 0.00 177.39 177.74 1foe h ARG 68 N 0.02 -0.08 0.00 3.23 2.43 -1.11 -0.99 114.38 117.89 1foe h ARG 68 Ca -0.53 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1foe h ARG 68 Cb 1.97 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1foe h ARG 68 CO -0.03 -0.05 0.00 -0.35 -1.51 0.00 0.00 179.97 178.03 1foe n PRO 69 N -5.46 0.72 0.20 0.20 -0.04 -1.26 -3.56 135.00 125.80 1foe n PRO 69 Ca 0.07 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.67 1foe n PRO 69 Cb 0.36 -1.22 0.53 0.00 -0.04 0.00 0.00 33.50 33.13 1foe n PRO 69 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1foe h LEU 70 N 0.00 0.00 0.00 1.53 3.38 -1.42 -2.97 115.31 115.83 1foe h LEU 70 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1foe h LEU 70 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1foe h LEU 70 CO 0.00 0.00 -1.18 -1.20 0.09 0.00 0.00 178.44 176.15 1foe n SER 71 N -2.70 0.56 -0.20 -0.43 7.64 -1.23 -4.53 113.62 112.72 1foe n SER 71 Ca 0.02 -0.10 -0.06 0.00 1.01 0.00 0.00 58.87 59.73 1foe n SER 71 Cb 0.32 0.94 0.03 0.00 -1.01 0.00 0.00 64.21 64.49 1foe n SER 71 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1foe h TYR 72 N 0.00 0.74 -3.40 1.43 0.99 -1.75 -3.44 116.97 111.54 1foe h TYR 72 Ca 0.00 0.01 -0.57 0.00 2.00 0.00 0.00 58.73 60.17 1foe h TYR 72 Cb 0.82 -0.25 0.14 0.00 1.00 0.00 0.00 36.73 38.44 1foe h TYR 72 CO 0.00 0.49 0.23 -2.30 -0.00 0.00 0.00 178.16 176.59 1foe n PRO 73 N -4.66 1.32 -2.50 4.88 -0.02 -1.26 -2.76 135.00 129.99 1foe n PRO 73 Ca 0.04 0.48 -0.20 0.00 -2.02 0.00 0.00 63.50 61.80 1foe n PRO 73 Cb 0.04 -2.18 -0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1foe n PRO 73 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1foe n GLN 74 N -0.36 -2.23 -3.88 -0.52 6.02 -1.26 -4.99 117.38 110.16 1foe n GLN 74 Ca 0.10 0.95 -0.36 0.00 -0.01 0.00 0.00 57.00 57.68 1foe n GLN 74 Cb 0.43 -5.59 -0.07 0.00 1.02 0.00 0.00 30.24 26.03 1foe n GLN 74 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1foe s THR 75 N -3.03 5.41 -0.11 5.09 2.01 -1.11 -4.80 115.64 119.10 1foe s THR 75 Ca 0.06 0.18 0.09 0.00 0.31 0.00 0.00 61.69 62.33 1foe s THR 75 Cb -0.03 -3.38 -0.24 0.00 0.01 0.00 0.00 72.50 68.87 1foe s THR 75 CO 0.07 0.58 0.40 0.47 -0.69 0.00 0.00 174.62 175.45 1foe n ASP 76 N 2.34 0.99 -3.78 3.53 9.92 -0.62 -4.92 116.55 124.02 1foe n ASP 76 Ca -0.19 0.24 -0.13 0.00 -0.53 0.00 0.00 54.79 54.18 1foe n ASP 76 Cb 0.54 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.91 1foe n ASP 76 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1foe s VAL 77 N -2.56 -0.00 -0.09 2.53 -7.23 -1.17 -4.08 120.40 107.79 1foe s VAL 77 Ca -0.12 0.01 -0.01 0.00 -1.81 0.00 0.00 61.98 60.06 1foe s VAL 77 Cb 0.07 -0.37 -0.03 0.00 0.56 0.00 0.00 36.38 36.61 1foe s VAL 77 CO 0.80 0.01 -0.05 -0.36 -0.31 0.00 0.00 175.10 175.18 1foe s PHE 78 N 0.25 2.99 -0.53 2.82 0.40 -0.85 -2.16 117.98 120.89 1foe s PHE 78 Ca -0.01 -0.05 -0.06 0.00 -0.60 0.00 0.00 56.93 56.21 1foe s PHE 78 Cb -0.03 -1.78 0.14 0.00 0.51 0.00 0.00 43.02 41.86 1foe s PHE 78 CO -0.01 0.25 0.38 -0.51 0.70 0.00 0.00 175.22 176.03 1foe s LEU 79 N -0.51 5.56 -0.55 -0.37 1.43 -0.75 -1.13 118.68 122.36 1foe s LEU 79 Ca 0.08 -2.29 -0.26 0.00 -1.03 0.00 0.00 54.13 50.63 1foe s LEU 79 Cb -0.12 -1.94 0.04 0.00 0.03 0.00 0.00 46.19 44.20 1foe s LEU 79 CO 0.02 -0.55 1.04 -0.63 0.23 0.00 0.00 176.35 176.45 1foe s ILE 80 N 0.79 4.26 0.64 -0.59 1.01 -0.82 -0.64 121.20 125.83 1foe s ILE 80 Ca 0.11 0.57 0.01 0.00 0.00 0.00 0.00 60.65 61.33 1foe s ILE 80 Cb -0.22 -4.60 0.08 0.00 0.01 0.00 0.00 42.46 37.73 1foe s ILE 80 CO -0.03 -1.17 0.88 0.00 0.00 0.00 0.00 174.94 174.62 1foe s PHE 82 N -2.94 -0.09 0.01 0.00 -0.12 -1.00 -4.58 117.98 109.26 1foe s PHE 82 Ca 0.62 0.21 -0.30 0.00 -0.05 0.00 0.00 56.93 57.41 1foe s PHE 82 Cb -0.08 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.75 1foe s PHE 82 CO 0.41 -0.05 1.07 0.45 -0.05 0.00 0.00 175.22 177.05 1foe s SER 83 N -0.21 7.25 0.53 1.98 0.15 -1.26 -0.41 113.70 121.72 1foe s SER 83 Ca 0.07 1.78 0.23 0.00 0.70 0.00 0.00 55.95 58.73 1foe s SER 83 Cb -0.04 -2.57 1.45 0.00 -1.71 0.00 0.00 66.02 63.15 1foe s SER 83 CO -0.13 -0.36 2.13 -0.07 1.20 0.00 0.00 173.24 176.02 1foe h LEU 84 N 6.94 0.00 -3.75 3.45 3.38 -0.94 -1.41 115.31 122.98 1foe h LEU 84 Ca -0.40 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.32 1foe h LEU 84 Cb 1.21 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 1foe h LEU 84 CO 0.78 0.07 0.30 1.33 0.09 0.00 0.00 178.44 181.02 1foe n VAL 85 N -4.02 2.96 -3.44 1.22 0.24 -1.26 -0.12 118.33 113.91 1foe n VAL 85 Ca -0.03 -1.70 -0.28 0.00 -2.04 0.00 0.00 64.34 60.29 1foe n VAL 85 Cb 0.16 -0.37 -0.11 0.00 -1.47 0.00 0.00 33.84 32.05 1foe n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1foe s SER 86 N -1.12 2.13 0.38 -1.34 0.15 -0.53 -4.93 113.70 108.44 1foe s SER 86 Ca 0.55 -2.75 0.19 0.00 0.70 0.00 0.00 55.95 54.64 1foe s SER 86 Cb 0.44 -0.47 1.14 0.00 -1.71 0.00 0.00 66.02 65.43 1foe s SER 86 CO 0.13 -0.22 1.70 -0.65 1.20 0.00 0.00 173.24 175.39 1foe h PRO 87 N 6.17 0.32 -0.03 5.44 0.11 -1.84 -0.85 132.00 141.32 1foe h PRO 87 Ca 0.18 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 1foe h PRO 87 Cb 0.93 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1foe h PRO 87 CO 0.34 0.21 0.01 0.00 -0.21 0.00 0.00 178.00 178.35 1foe h ALA 88 N 1.71 0.03 -0.12 -0.75 0.00 -1.94 0.52 119.26 118.71 1foe h ALA 88 Ca 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1foe h ALA 88 Cb 1.77 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.54 1foe h ALA 88 CO -0.45 -0.39 0.08 0.66 0.00 0.00 0.00 179.25 179.15 1foe h SER 89 N -0.11 0.12 0.25 0.00 4.64 -1.50 -1.54 113.55 115.41 1foe h SER 89 Ca 0.01 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1foe h SER 89 Cb 0.15 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1foe h SER 89 CO -0.00 0.09 -0.12 0.15 -0.87 0.00 0.00 176.83 176.08 1foe h PHE 90 N 0.15 -0.31 -0.65 4.77 3.57 -0.91 -3.03 116.94 120.54 1foe h PHE 90 Ca 0.04 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.63 1foe h PHE 90 Cb 0.00 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1foe h PHE 90 CO -0.00 0.00 0.43 1.49 -2.23 0.00 0.00 178.31 178.01 1foe h GLU 91 N -0.63 0.48 0.00 1.11 4.57 -0.12 -0.21 114.58 119.78 1foe h GLU 91 Ca -0.03 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1foe h GLU 91 Cb 0.45 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1foe h GLU 91 CO 0.06 0.32 0.00 -0.91 -1.18 0.00 0.00 179.01 177.29 1foe h ASN 92 N 0.49 0.00 -0.56 1.04 2.35 -1.18 -1.66 115.58 116.06 1foe h ASN 92 Ca 0.30 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.04 1foe h ASN 92 Cb 0.51 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 1foe h ASN 92 CO -0.09 0.00 0.32 0.58 -1.65 0.00 0.00 177.43 176.58 1foe h VAL 93 N 0.00 1.18 0.00 2.81 2.07 -1.03 0.52 116.25 121.80 1foe h VAL 93 Ca 0.00 -0.45 -0.26 0.00 0.82 0.00 0.00 66.70 66.81 1foe h VAL 93 Cb 0.17 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1foe h VAL 93 CO 0.00 0.19 -1.54 0.08 0.02 0.00 0.00 177.57 176.32 1foe h ARG 94 N 0.76 0.00 0.00 1.57 0.11 -1.54 -0.49 114.38 114.78 1foe h ARG 94 Ca 0.20 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.07 1foe h ARG 94 Cb 0.03 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.08 1foe h ARG 94 CO -0.03 0.54 -1.16 0.00 0.10 0.00 0.00 179.97 179.41 1foe h ALA 95 N 1.06 0.58 -1.23 0.08 0.00 -1.24 -3.41 119.26 115.10 1foe h ALA 95 Ca -0.22 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.73 1foe h ALA 95 Cb 1.91 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1foe h ALA 95 CO 0.08 1.16 0.00 1.17 0.00 0.00 0.00 179.25 181.67 1foe n LYS 96 N -3.17 0.00 -0.05 0.00 4.81 0.17 -4.87 118.16 115.05 1foe n LYS 96 Ca -0.06 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.31 1foe n LYS 96 Cb 0.91 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.95 1foe n LYS 96 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 1foe h TRP 97 N 0.00 -0.54 0.41 5.64 4.06 -1.37 -2.33 115.95 121.82 1foe h TRP 97 Ca 0.00 0.04 -0.02 0.00 2.06 0.00 0.00 58.89 60.97 1foe h TRP 97 Cb 0.00 0.28 0.00 0.00 -1.00 0.00 0.00 29.16 28.44 1foe h TRP 97 CO 0.00 -0.29 -0.20 -0.92 -3.56 0.00 0.00 178.44 173.48 1foe h TYR 98 N -0.20 -0.51 -0.95 0.49 3.20 -1.30 -0.47 116.97 117.22 1foe h TYR 98 Ca 0.14 -0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.15 1foe h TYR 98 Cb 0.42 0.17 -0.08 0.00 1.54 0.00 0.00 36.73 38.78 1foe h TYR 98 CO -0.38 -0.30 0.60 -1.35 -1.64 0.00 0.00 178.16 175.10 1foe h PRO 99 N -0.59 0.77 0.15 1.82 0.11 -1.76 -0.18 132.00 132.32 1foe h PRO 99 Ca -0.06 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 1foe h PRO 99 Cb 0.44 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.38 1foe h PRO 99 CO 0.09 0.51 -0.07 1.49 -0.21 0.00 0.00 178.00 179.81 1foe h GLU 100 N 0.79 -0.19 -0.96 1.05 4.81 -1.22 -2.21 114.58 116.64 1foe h GLU 100 Ca 0.49 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.77 1foe h GLU 100 Cb 0.70 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.07 1foe h GLU 100 CO -0.26 0.22 0.63 0.28 -0.73 0.00 0.00 179.01 179.16 1foe h VAL 101 N -0.68 1.17 -0.61 0.32 2.07 -0.64 -2.07 116.25 115.81 1foe h VAL 101 Ca -0.02 -0.42 -0.10 0.00 0.82 0.00 0.00 66.70 66.99 1foe h VAL 101 Cb 0.50 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1foe h VAL 101 CO 0.03 0.22 0.00 -0.09 0.02 0.00 0.00 177.57 177.76 1foe h ARG 102 N 1.22 1.07 -0.78 1.57 9.65 -1.09 0.55 114.38 126.56 1foe h ARG 102 Ca 0.38 -0.34 -0.03 0.00 -1.10 0.00 0.00 59.98 58.89 1foe h ARG 102 Cb -0.00 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.44 1foe h ARG 102 CO -0.12 1.04 0.36 1.25 2.80 0.00 0.00 179.97 185.30 1foe h HIS 103 N 0.97 1.14 0.00 2.20 2.76 -0.88 -1.85 115.15 119.49 1foe h HIS 103 Ca 0.17 -0.06 -0.08 0.00 -2.20 0.00 0.00 60.37 58.20 1foe h HIS 103 Cb 0.56 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1foe h HIS 103 CO 0.04 0.84 -0.85 0.45 -1.30 0.00 0.00 177.93 177.11 1foe h HIS 104 N 1.11 0.00 -2.28 5.26 3.86 -1.22 -3.41 115.15 118.47 1foe h HIS 104 Ca 0.27 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.91 1foe h HIS 104 Cb 0.14 0.00 -0.37 0.00 1.06 0.00 0.00 27.41 28.24 1foe h HIS 104 CO 0.01 0.31 -0.96 0.00 0.86 0.00 0.00 177.93 178.15 1foe h PRO 106 N 5.53 0.72 -0.35 0.00 0.11 -1.55 -2.91 132.00 133.55 1foe h PRO 106 Ca 0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1foe h PRO 106 Cb 0.92 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1foe h PRO 106 CO 0.36 0.48 0.00 0.09 -0.21 0.00 0.00 178.00 178.71 1foe n ASN 107 N -4.57 3.93 -4.68 -2.05 3.02 -1.26 -4.99 115.26 104.66 1foe n ASN 107 Ca 0.17 -2.71 -0.37 0.00 -0.03 0.00 0.00 54.58 51.64 1foe n ASN 107 Cb 0.45 -0.49 -0.08 0.00 -0.61 0.00 0.00 39.78 39.05 1foe n ASN 107 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1foe s THR 108 N -2.29 5.26 0.46 3.41 2.01 -1.10 -5.05 115.64 118.35 1foe s THR 108 Ca 0.40 0.53 -0.24 0.00 0.31 0.00 0.00 61.69 62.69 1foe s THR 108 Cb 0.30 -3.65 -0.08 0.00 0.01 0.00 0.00 72.50 69.07 1foe s THR 108 CO 0.13 0.30 1.28 -0.81 -0.69 0.00 0.00 174.62 174.83 1foe n PRO 109 N 4.25 1.84 -3.96 4.92 -0.04 -1.26 -4.84 135.00 135.92 1foe n PRO 109 Ca -0.11 0.66 -0.29 0.00 -0.04 0.00 0.00 63.50 63.73 1foe n PRO 109 Cb 0.51 -2.42 -0.17 0.00 -0.04 0.00 0.00 33.50 31.39 1foe n PRO 109 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1foe s ILE 110 N -1.24 1.32 -0.22 0.52 1.01 -1.26 -2.02 121.20 119.32 1foe s ILE 110 Ca 0.64 -0.57 -0.14 0.00 0.00 0.00 0.00 60.65 60.57 1foe s ILE 110 Cb -0.48 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 1foe s ILE 110 CO 0.56 0.33 0.33 -0.63 0.00 0.00 0.00 174.94 175.53 1foe s ILE 111 N 1.57 5.24 -0.70 2.92 1.09 -0.29 -0.77 121.20 130.27 1foe s ILE 111 Ca 0.03 0.56 -0.21 0.00 -1.10 0.00 0.00 60.65 59.93 1foe s ILE 111 Cb -0.14 -3.67 0.09 0.00 -1.06 0.00 0.00 42.46 37.69 1foe s ILE 111 CO -0.09 0.27 0.93 -0.22 -0.10 0.00 0.00 174.94 175.73 1foe s LEU 112 N 1.31 4.78 -0.07 2.97 2.96 -0.22 -1.95 118.68 128.46 1foe s LEU 112 Ca 0.16 -1.32 -0.21 0.00 -0.22 0.00 0.00 54.13 52.54 1foe s LEU 112 Cb -0.14 -2.38 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1foe s LEU 112 CO 0.07 -1.28 0.61 -0.69 -1.32 0.00 0.00 176.35 173.74 1foe s VAL 113 N 3.42 5.07 -0.21 1.68 1.01 -0.78 -2.31 120.40 128.29 1foe s VAL 113 Ca 0.21 1.25 -0.09 0.00 0.00 0.00 0.00 61.98 63.36 1foe s VAL 113 Cb -0.16 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 1foe s VAL 113 CO 0.05 0.30 0.10 -0.83 0.00 0.00 0.00 175.10 174.73 1foe s GLY 114 N 0.58 1.93 0.49 4.51 0.00 0.46 -2.37 107.32 112.92 1foe s GLY 114 Ca 0.33 -0.82 0.06 0.00 0.00 0.00 0.00 44.72 44.29 1foe s GLY 114 CO 0.15 0.22 0.34 -0.51 0.00 0.00 0.00 173.10 173.30 1foe s THR 115 N 0.70 1.96 -1.61 0.90 -4.23 0.45 -0.69 115.64 113.13 1foe s THR 115 Ca 0.05 -1.52 -0.04 0.00 -1.18 0.00 0.00 61.69 59.00 1foe s THR 115 Cb -0.13 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1foe s THR 115 CO 0.02 0.00 0.52 0.29 -0.54 0.00 0.00 174.62 174.90 1foe n LYS 116 N -1.60 -4.42 -0.18 3.99 4.01 -1.20 -0.32 118.16 118.44 1foe n LYS 116 Ca -0.01 0.93 -0.00 0.00 -0.51 0.00 0.00 58.31 58.72 1foe n LYS 116 Cb 0.64 -5.77 0.09 0.00 -0.51 0.00 0.00 35.03 29.47 1foe n LYS 116 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1foe h LEU 117 N -1.18 -0.18 -1.81 -0.35 5.85 -1.53 -1.37 115.31 114.75 1foe h LEU 117 Ca -0.53 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1foe h LEU 117 Cb 1.37 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1foe h LEU 117 CO 0.58 -0.07 0.13 -2.24 -0.34 0.00 0.00 178.44 176.50 1foe h ASP 118 N 0.15 0.00 -0.00 1.25 2.03 -1.90 0.36 116.42 118.31 1foe h ASP 118 Ca 0.29 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1foe h ASP 118 Cb 0.45 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.95 1foe h ASP 118 CO -0.45 0.00 -0.09 0.18 -1.03 0.00 0.00 179.24 177.85 1foe n LEU 119 N -2.54 2.26 -0.11 0.15 7.99 -0.52 -4.38 117.00 119.86 1foe n LEU 119 Ca -0.02 -0.76 -0.05 0.00 -0.01 0.00 0.00 56.01 55.17 1foe n LEU 119 Cb 0.17 -0.01 0.14 0.00 -0.11 0.00 0.00 43.42 43.61 1foe n LEU 119 CO 0.12 0.38 0.84 -0.09 -1.51 0.00 0.00 177.39 177.13 1foe h ARG 120 N 3.41 0.80 -1.05 3.23 2.43 -0.96 -3.11 114.38 119.12 1foe h ARG 120 Ca 0.00 -0.24 -0.58 0.00 -0.81 0.00 0.00 59.98 58.35 1foe h ARG 120 Cb 0.78 -0.08 -0.41 0.00 -0.42 0.00 0.00 29.97 29.84 1foe h ARG 120 CO 0.00 0.84 -0.54 -0.40 -1.51 0.00 0.00 179.97 178.36 1foe n ASP 121 N -4.19 5.27 -4.55 -3.80 5.75 -1.26 -4.84 116.55 108.92 1foe n ASP 121 Ca 0.02 -3.75 -0.36 0.00 -0.01 0.00 0.00 54.79 50.69 1foe n ASP 121 Cb 0.33 -0.47 -0.11 0.00 -1.03 0.00 0.00 41.12 39.84 1foe n ASP 121 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1foe s ASP 122 N -3.29 5.57 0.13 -1.12 2.15 -1.18 -5.02 116.67 113.92 1foe s ASP 122 Ca 0.52 -0.05 -0.29 0.00 0.43 0.00 0.00 52.55 53.16 1foe s ASP 122 Cb 0.42 -2.00 -0.05 0.00 -0.30 0.00 0.00 42.92 40.99 1foe s ASP 122 CO -0.05 0.03 1.58 0.11 -0.17 0.00 0.00 175.17 176.67 1foe h LYS 123 N 7.75 -0.46 -0.33 4.34 1.79 -1.94 0.12 116.57 127.83 1foe h LYS 123 Ca -0.37 0.03 0.05 0.00 -2.18 0.00 0.00 60.65 58.18 1foe h LYS 123 Cb 1.18 0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 31.89 1foe h LYS 123 CO 0.61 -0.30 0.07 -0.44 -1.08 0.00 0.00 179.45 178.31 1foe h ASP 124 N -0.47 0.02 0.03 0.86 3.32 -1.97 -0.70 116.42 117.51 1foe h ASP 124 Ca 0.08 0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.19 1foe h ASP 124 Cb 0.62 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 1foe h ASP 124 CO -0.43 0.05 -0.05 0.74 -1.72 0.00 0.00 179.24 177.83 1foe h THR 125 N 0.19 0.87 -0.47 0.35 2.02 -1.76 -0.49 112.91 113.62 1foe h THR 125 Ca 0.16 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.36 1foe h THR 125 Cb 0.17 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1foe h THR 125 CO -0.20 0.00 0.31 0.40 0.37 0.00 0.00 175.52 176.40 1foe h ILE 126 N -0.10 1.08 -0.07 3.11 2.04 -0.45 -1.31 117.51 121.81 1foe h ILE 126 Ca 0.01 -0.20 -0.14 0.00 1.00 0.00 0.00 64.86 65.54 1foe h ILE 126 Cb 0.11 0.46 0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1foe h ILE 126 CO -0.03 0.10 -0.50 -0.33 0.00 0.00 0.00 178.15 177.39 1foe h GLU 127 N 0.57 0.46 -0.57 2.37 5.08 -0.84 -1.51 114.58 120.14 1foe h GLU 127 Ca 0.18 -0.40 0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1foe h GLU 127 Cb 0.03 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 1foe h GLU 127 CO -0.04 1.04 0.22 -0.22 -1.00 0.00 0.00 179.01 179.01 1foe h LYS 128 N 0.00 0.40 -0.30 2.33 3.11 -0.62 0.15 116.57 121.64 1foe h LYS 128 Ca -0.04 -0.02 -0.10 0.00 -2.81 0.00 0.00 60.65 57.67 1foe h LYS 128 Cb 1.17 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 32.29 1foe h LYS 128 CO 0.10 0.26 -0.25 -0.07 -2.81 0.00 0.00 179.45 176.69 1foe h LEU 129 N 0.41 0.60 -1.05 5.20 3.38 -1.26 -2.73 115.31 119.86 1foe h LEU 129 Ca 0.28 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1foe h LEU 129 Cb 0.31 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1foe h LEU 129 CO -0.27 0.84 0.16 0.50 0.09 0.00 0.00 178.44 179.76 1foe h LYS 130 N 0.52 0.85 0.00 1.13 3.64 -0.07 0.55 116.57 123.18 1foe h LYS 130 Ca 0.07 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1foe h LYS 130 Cb 0.71 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1foe h LYS 130 CO 0.05 0.74 -0.01 0.93 -2.27 0.00 0.00 179.45 178.90 1foe h GLU 131 N 0.82 0.00 -0.34 1.90 5.08 -0.46 -0.79 114.58 120.79 1foe h GLU 131 Ca 0.19 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.47 1foe h GLU 131 Cb 0.26 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1foe h GLU 131 CO -0.01 0.01 0.02 1.63 -1.00 0.00 0.00 179.01 179.65 1foe n LYS 132 N -3.13 2.68 -3.87 2.33 5.02 -0.42 -4.94 118.16 115.83 1foe n LYS 132 Ca -0.02 -2.96 -0.25 0.00 -2.02 0.00 0.00 58.31 53.06 1foe n LYS 132 Cb 0.15 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.28 1foe n LYS 132 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1foe n LYS 133 N -0.66 -4.05 -4.32 1.97 4.01 -0.30 -4.97 118.16 109.83 1foe n LYS 133 Ca 0.27 0.50 -0.17 0.00 -0.51 0.00 0.00 58.31 58.40 1foe n LYS 133 Cb 0.99 -4.87 -0.10 0.00 -0.51 0.00 0.00 35.03 30.54 1foe n LYS 133 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1foe s LEU 134 N -6.90 2.23 -0.04 -0.35 1.43 0.18 -4.98 118.68 110.23 1foe s LEU 134 Ca 0.09 -1.20 -0.07 0.00 -1.03 0.00 0.00 54.13 51.93 1foe s LEU 134 Cb -0.05 -0.28 0.01 0.00 0.03 0.00 0.00 46.19 45.90 1foe s LEU 134 CO 0.86 -0.49 0.17 -0.89 0.23 0.00 0.00 176.35 176.23 1foe s THR 135 N -3.40 0.03 0.99 5.49 2.01 -1.26 -3.39 115.64 116.11 1foe s THR 135 Ca 0.27 -0.23 -0.11 0.00 0.31 0.00 0.00 61.69 61.93 1foe s THR 135 Cb 0.05 -0.32 0.16 0.00 0.01 0.00 0.00 72.50 72.41 1foe s THR 135 CO 0.08 -0.13 0.97 -2.65 -0.69 0.00 0.00 174.62 172.20 1foe n PRO 136 N 2.45 -0.96 -2.99 4.92 -0.02 -1.26 -4.73 135.00 132.42 1foe n PRO 136 Ca -0.16 -0.23 -0.40 0.00 -2.02 0.00 0.00 63.50 60.69 1foe n PRO 136 Cb 0.58 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.78 1foe n PRO 136 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1foe s ILE 137 N -2.53 4.92 0.33 4.25 1.09 0.83 -5.02 121.20 125.06 1foe s ILE 137 Ca 0.65 1.57 -0.06 0.00 -1.10 0.00 0.00 60.65 61.72 1foe s ILE 137 Cb -0.23 -4.10 -0.05 0.00 -1.06 0.00 0.00 42.46 37.02 1foe s ILE 137 CO 0.61 0.28 0.62 0.42 -0.10 0.00 0.00 174.94 176.78 1foe s THR 138 N 0.50 4.96 0.21 2.92 -4.23 -1.26 -4.90 115.64 113.84 1foe s THR 138 Ca 0.39 0.18 -0.12 0.00 -1.18 0.00 0.00 61.69 60.96 1foe s THR 138 Cb -0.19 -3.75 0.22 0.00 1.34 0.00 0.00 72.50 70.13 1foe s THR 138 CO 0.21 -0.41 1.64 0.22 -0.54 0.00 0.00 174.62 175.73 1foe h TYR 139 N 1.44 -0.23 -0.79 3.99 3.20 -1.99 0.17 116.97 122.77 1foe h TYR 139 Ca -0.48 0.05 0.12 0.00 3.14 0.00 0.00 58.73 61.57 1foe h TYR 139 Cb 1.19 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 39.61 1foe h TYR 139 CO 0.58 -0.24 0.52 -1.35 -1.64 0.00 0.00 178.16 176.03 1foe h PRO 140 N 0.04 0.58 -0.02 1.82 0.11 -1.99 0.14 132.00 132.68 1foe h PRO 140 Ca 0.31 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.38 1foe h PRO 140 Cb 0.50 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1foe h PRO 140 CO -0.61 0.38 -0.04 1.96 -0.21 0.00 0.00 178.00 179.48 1foe h GLN 141 N 0.60 0.05 -0.56 1.05 4.20 -1.12 -2.01 115.11 117.32 1foe h GLN 141 Ca 0.38 -0.04 0.10 0.00 0.06 0.00 0.00 58.65 59.16 1foe h GLN 141 Cb 0.65 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.35 1foe h GLN 141 CO -0.15 0.63 0.11 0.78 -0.67 0.00 0.00 178.83 179.54 1foe h GLY 142 N -0.52 0.70 0.92 3.46 0.00 -0.43 -0.20 103.07 107.01 1foe h GLY 142 Ca -0.00 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.33 1foe h GLY 142 CO 0.01 -0.10 0.37 -2.00 0.00 0.00 0.00 176.54 174.82 1foe h LEU 143 N 0.24 0.61 -0.38 3.11 6.46 -0.72 -0.32 115.31 124.31 1foe h LEU 143 Ca 0.29 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.04 1foe h LEU 143 Cb 0.42 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 1foe h LEU 143 CO -0.38 0.44 0.24 0.00 -0.62 0.00 0.00 178.44 178.12 1foe h ALA 144 N 1.24 0.49 -0.08 1.25 0.00 -0.51 0.72 119.26 122.37 1foe h ALA 144 Ca 0.23 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1foe h ALA 144 Cb -0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1foe h ALA 144 CO -0.08 -0.03 -0.12 1.98 0.00 0.00 0.00 179.25 181.00 1foe h MET 145 N 0.51 -0.16 -0.88 0.00 1.85 -0.59 0.40 114.93 116.06 1foe h MET 145 Ca 0.14 0.01 0.14 0.00 -0.61 0.00 0.00 59.70 59.38 1foe h MET 145 Cb -0.02 0.04 -0.09 0.00 0.43 0.00 0.00 31.60 31.96 1foe h MET 145 CO -0.03 -0.11 0.49 0.00 -0.40 0.00 0.00 176.91 176.87 1foe h ALA 146 N 0.87 1.33 -0.38 0.39 0.00 -0.53 0.58 119.26 121.53 1foe h ALA 146 Ca 0.07 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1foe h ALA 146 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1foe h ALA 146 CO -0.18 -0.01 -0.31 -0.22 0.00 0.00 0.00 179.25 178.53 1foe h LYS 147 N 0.72 0.84 -0.28 0.00 3.64 0.40 0.44 116.57 122.32 1foe h LYS 147 Ca 0.47 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1foe h LYS 147 Cb 0.60 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1foe h LYS 147 CO -0.33 1.03 0.17 1.49 -2.27 0.00 0.00 179.45 179.54 1foe h GLU 148 N 0.71 0.39 -0.08 1.90 4.81 0.20 -2.29 114.58 120.21 1foe h GLU 148 Ca 0.08 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1foe h GLU 148 Cb 0.87 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1foe h GLU 148 CO 0.08 0.30 0.00 0.44 -0.73 0.00 0.00 179.01 179.10 1foe n ILE 149 N -4.85 0.10 -3.28 2.32 -5.35 -0.56 -4.92 119.36 102.81 1foe n ILE 149 Ca -0.02 -0.20 -0.17 0.00 -0.27 0.00 0.00 62.75 62.09 1foe n ILE 149 Cb 0.05 0.12 0.06 0.00 -1.74 0.00 0.00 39.64 38.13 1foe n ILE 149 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1foe n GLY 150 N 1.02 -0.14 3.78 3.28 0.00 -0.79 -4.99 105.19 107.36 1foe n GLY 150 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1foe n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1foe s ALA 151 N -3.24 2.60 0.22 4.61 0.00 0.15 -4.78 121.76 121.32 1foe s ALA 151 Ca 0.39 0.60 0.06 0.00 0.00 0.00 0.00 51.96 53.01 1foe s ALA 151 Cb -0.17 -3.31 0.17 0.00 0.00 0.00 0.00 23.12 19.80 1foe s ALA 151 CO 0.53 -1.01 1.50 0.28 0.00 0.00 0.00 175.76 177.06 1foe h VAL 152 N 0.49 1.46 -2.92 0.00 2.07 -1.27 -3.45 116.25 112.64 1foe h VAL 152 Ca -0.48 -2.33 -0.07 0.00 0.82 0.00 0.00 66.70 64.64 1foe h VAL 152 Cb 1.24 2.25 -0.16 0.00 -1.52 0.00 0.00 31.29 33.11 1foe h VAL 152 CO 0.56 0.68 -0.03 -0.54 0.02 0.00 0.00 177.57 178.26 1foe s LYS 153 N -3.46 0.99 -0.28 1.57 -0.14 -1.25 -5.05 119.74 112.12 1foe s LYS 153 Ca -0.02 -0.32 0.02 0.00 -1.36 0.00 0.00 55.97 54.28 1foe s LYS 153 Cb 0.11 0.45 0.08 0.00 -1.68 0.00 0.00 37.83 36.79 1foe s LYS 153 CO 0.80 -0.35 -0.01 -0.47 -0.76 0.00 0.00 175.35 174.56 1foe s TYR 154 N -2.55 2.74 0.33 3.18 5.04 -1.26 -1.05 117.35 123.76 1foe s TYR 154 Ca -0.05 -2.14 0.09 0.00 -2.44 0.00 0.00 57.07 52.53 1foe s TYR 154 Cb -0.01 -1.99 -0.05 0.00 0.35 0.00 0.00 41.96 40.26 1foe s TYR 154 CO -0.03 -0.85 0.05 -0.51 -1.34 0.00 0.00 175.55 172.87 1foe s LEU 155 N 1.27 3.11 0.02 6.97 1.02 -0.98 -4.97 118.68 125.13 1foe s LEU 155 Ca 0.01 -0.86 0.02 0.00 0.02 0.00 0.00 54.13 53.33 1foe s LEU 155 Cb -0.19 -1.54 -0.02 0.00 0.02 0.00 0.00 46.19 44.47 1foe s LEU 155 CO -0.10 -0.21 -0.08 -1.61 0.02 0.00 0.00 176.35 174.37 1foe s GLU 156 N -3.75 0.57 0.31 1.70 2.02 -1.26 -0.40 118.70 117.89 1foe s GLU 156 Ca 0.35 -0.53 -0.04 0.00 0.02 0.00 0.00 54.97 54.77 1foe s GLU 156 Cb -0.02 -0.47 0.02 0.00 0.10 0.00 0.00 34.13 33.76 1foe s GLU 156 CO 0.20 0.11 0.47 0.00 0.02 0.00 0.00 175.26 176.07 1foe s SER 158 N -2.84 0.50 0.58 0.00 0.15 -0.86 -1.46 113.70 109.77 1foe s SER 158 Ca 0.22 0.25 0.34 0.00 0.70 0.00 0.00 55.95 57.47 1foe s SER 158 Cb -0.02 0.89 1.74 0.00 -1.71 0.00 0.00 66.02 66.92 1foe s SER 158 CO 0.16 -0.29 2.14 0.00 1.20 0.00 0.00 173.24 176.46 1foe h ALA 159 N 8.23 1.13 0.07 5.45 0.00 -1.92 1.43 119.26 133.64 1foe h ALA 159 Ca -0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1foe h ALA 159 Cb 1.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1foe h ALA 159 CO 0.24 0.06 -0.03 1.25 0.00 0.00 0.00 179.25 180.77 1foe h LEU 160 N 0.00 -0.08 -0.01 0.00 7.12 -1.96 -3.24 115.31 117.15 1foe h LEU 160 Ca -0.00 -0.55 0.00 0.00 0.13 0.00 0.00 57.88 57.46 1foe h LEU 160 Cb 0.27 0.02 0.00 0.00 -0.53 0.00 0.00 40.66 40.42 1foe h LEU 160 CO 0.01 0.60 0.00 0.41 -0.13 0.00 0.00 178.44 179.33 1foe n THR 161 N -4.80 0.54 -0.90 1.05 -1.04 -1.08 -4.79 114.28 103.26 1foe n THR 161 Ca -0.08 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 1foe n THR 161 Cb 0.30 -0.59 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 1foe n THR 161 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1foe n GLN 162 N -2.18 -1.58 -2.77 -2.82 7.27 0.49 -4.93 117.38 110.86 1foe n GLN 162 Ca 0.06 0.40 -0.41 0.00 0.07 0.00 0.00 57.00 57.11 1foe n GLN 162 Cb 0.42 -4.90 -0.04 0.00 2.41 0.00 0.00 30.24 28.13 1foe n GLN 162 CO 0.00 0.00 0.00 -0.98 0.07 0.00 0.00 177.06 176.15 1foe s ARG 163 N -1.79 4.58 0.00 3.69 1.70 -1.16 -3.62 118.95 122.35 1foe s ARG 163 Ca 0.00 1.35 0.00 0.00 -0.47 0.00 0.00 55.73 56.61 1foe s ARG 163 Cb 0.00 -3.43 0.00 0.00 -0.57 0.00 0.00 34.95 30.95 1foe s ARG 163 CO 0.00 0.06 0.00 0.41 -1.08 0.00 0.00 175.30 174.69 1foe n GLY 164 N 2.69 1.77 0.38 3.88 0.00 -1.26 -2.02 105.19 110.63 1foe n GLY 164 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1foe n GLY 164 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1foe h LEU 165 N 0.00 -0.81 -0.86 0.99 4.07 -1.87 -1.41 115.31 115.41 1foe h LEU 165 Ca 0.00 0.03 0.20 0.00 0.08 0.00 0.00 57.88 58.19 1foe h LEU 165 Cb 0.00 0.21 -0.12 0.00 1.08 0.00 0.00 40.66 41.83 1foe h LEU 165 CO 0.00 -0.56 0.37 0.11 -1.08 0.00 0.00 178.44 177.28 1foe h LYS 166 N -1.00 0.41 0.06 1.13 1.79 -1.93 0.38 116.57 117.41 1foe h LYS 166 Ca -0.10 -0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.37 1foe h LYS 166 Cb 0.74 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 31.26 1foe h LYS 166 CO 0.16 0.27 -0.25 1.15 -1.08 0.00 0.00 179.45 179.71 1foe h THR 167 N 0.42 0.45 -0.61 -0.16 2.02 -1.94 -0.75 112.91 112.34 1foe h THR 167 Ca 0.52 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.81 1foe h THR 167 Cb 0.93 0.45 -0.12 0.00 -1.74 0.00 0.00 68.15 67.67 1foe h THR 167 CO -0.49 0.00 -0.32 0.58 0.37 0.00 0.00 175.52 175.66 1foe h VAL 168 N -0.42 0.18 0.00 3.16 2.07 0.21 0.16 116.25 121.62 1foe h VAL 168 Ca 0.04 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.46 1foe h VAL 168 Cb 0.47 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1foe h VAL 168 CO -0.18 0.00 -0.51 -0.26 0.02 0.00 0.00 177.57 176.65 1foe h PHE 169 N -0.14 0.00 -0.07 1.57 -1.00 -1.17 -2.11 116.94 114.02 1foe h PHE 169 Ca 0.25 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.99 1foe h PHE 169 Cb 0.55 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.11 1foe h PHE 169 CO -0.63 0.51 -0.09 -0.44 -1.61 0.00 0.00 178.31 176.05 1foe h ASP 170 N 0.00 0.20 -0.43 2.17 5.19 -0.02 -1.25 116.42 122.27 1foe h ASP 170 Ca -0.01 -0.51 0.02 0.00 -0.62 0.00 0.00 57.03 55.92 1foe h ASP 170 Cb 1.06 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.49 1foe h ASP 170 CO 0.07 0.66 0.29 -0.33 -3.12 0.00 0.00 179.24 176.81 1foe h GLU 171 N -0.27 0.48 0.04 3.56 4.39 -0.72 0.27 114.58 122.34 1foe h GLU 171 Ca 0.01 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1foe h GLU 171 Cb 0.61 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1foe h GLU 171 CO 0.02 0.32 -0.02 0.00 -1.16 0.00 0.00 179.01 178.17 1foe h ALA 172 N 1.75 -0.06 -0.80 3.43 0.00 -1.16 0.11 119.26 122.54 1foe h ALA 172 Ca 0.17 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1foe h ALA 172 Cb 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1foe h ALA 172 CO -0.04 -0.49 0.32 0.82 0.00 0.00 0.00 179.25 179.86 1foe h ILE 173 N -0.14 1.26 -0.64 0.00 2.04 0.04 -2.47 117.51 117.61 1foe h ILE 173 Ca -0.01 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 1foe h ILE 173 Cb 0.12 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1foe h ILE 173 CO 0.01 0.34 0.34 0.03 0.00 0.00 0.00 178.15 178.86 1foe h ARG 174 N 1.16 0.91 -0.24 2.37 3.08 -0.18 -1.04 114.38 120.45 1foe h ARG 174 Ca 0.27 -0.12 0.07 0.00 0.07 0.00 0.00 59.98 60.27 1foe h ARG 174 Cb 0.22 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1foe h ARG 174 CO -0.02 0.70 0.37 0.00 -1.07 0.00 0.00 179.97 179.96 1foe h ALA 175 N 1.16 1.80 0.01 0.04 0.00 -0.30 -2.69 119.26 119.28 1foe h ALA 175 Ca 0.22 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.78 1foe h ALA 175 Cb 0.07 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1foe h ALA 175 CO -0.03 -0.50 -1.88 0.28 0.00 0.00 0.00 179.25 177.12 1foe n VAL 176 N -3.44 1.55 0.00 0.00 0.31 -0.53 -4.88 118.33 111.34 1foe n VAL 176 Ca 0.03 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1foe n VAL 176 Cb 0.50 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 1foe n VAL 176 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69