#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyp s THR 24 N 0.00 4.01 -0.23 2.61 -4.23 -1.26 -5.05 115.64 111.49 3hyp s THR 24 Ca 0.00 1.66 -0.08 0.00 -1.18 0.00 0.00 61.69 62.09 3hyp s THR 24 Cb 0.00 -3.92 -0.04 0.00 1.34 0.00 0.00 72.50 69.89 3hyp s THR 24 CO 0.00 0.13 0.08 -0.63 -0.54 0.00 0.00 174.62 173.66 3hyp s ILE 25 N -1.58 4.59 0.37 2.99 1.01 -1.26 -5.10 121.20 122.23 3hyp s ILE 25 Ca 0.52 -0.08 -0.25 0.00 0.00 0.00 0.00 60.65 60.84 3hyp s ILE 25 Cb -0.21 -3.13 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 3hyp s ILE 25 CO 0.26 0.36 1.02 -1.00 0.00 0.00 0.00 174.94 175.59 3hyp s HIS 26 N 1.24 3.39 -0.06 3.97 3.76 -1.26 -5.07 115.29 121.26 3hyp s HIS 26 Ca 0.05 1.68 0.06 0.00 -0.15 0.00 0.00 55.06 56.69 3hyp s HIS 26 Cb -0.14 -3.08 -0.01 0.00 1.11 0.00 0.00 32.58 30.46 3hyp s HIS 26 CO 0.04 -0.40 -0.24 -0.51 -0.85 0.00 0.00 174.74 172.77 3hyp s LEU 27 N -2.45 2.06 0.72 0.89 1.43 -1.26 -5.08 118.68 114.99 3hyp s LEU 27 Ca 0.55 -0.51 -0.07 0.00 -1.03 0.00 0.00 54.13 53.07 3hyp s LEU 27 Cb -0.21 -1.35 0.07 0.00 0.03 0.00 0.00 46.19 44.72 3hyp s LEU 27 CO 0.27 0.22 1.03 0.42 0.23 0.00 0.00 176.35 178.52 3hyp s THR 28 N -0.05 2.25 0.21 5.49 -4.23 -1.26 -4.91 115.64 113.13 3hyp s THR 28 Ca -0.07 -0.26 -0.10 0.00 -1.18 0.00 0.00 61.69 60.09 3hyp s THR 28 Cb -0.14 -2.98 0.16 0.00 1.34 0.00 0.00 72.50 70.87 3hyp s THR 28 CO 0.05 0.00 1.85 -0.09 -0.54 0.00 0.00 174.62 175.89 3hyp h ARG 29 N -0.66 1.05 -0.44 3.99 2.43 -2.00 0.83 114.38 119.57 3hyp h ARG 29 Ca -0.44 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 58.55 3hyp h ARG 29 Cb 1.31 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 3hyp h ARG 29 CO 0.59 0.74 -0.05 0.00 -1.51 0.00 0.00 179.97 179.74 3hyp h ALA 30 N 1.25 1.07 -0.40 2.80 0.00 -2.00 -1.16 119.26 120.82 3hyp h ALA 30 Ca 0.28 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 3hyp h ALA 30 Cb -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hyp h ALA 30 CO -0.05 0.58 -0.33 0.93 0.00 0.00 0.00 179.25 180.37 3hyp h GLU 31 N 0.70 0.92 -0.84 0.00 5.08 -1.87 -2.94 114.58 115.63 3hyp h GLU 31 Ca 0.13 -0.45 0.16 0.00 -1.00 0.00 0.00 59.36 58.19 3hyp h GLU 31 Cb 0.51 -0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.66 3hyp h GLU 31 CO 0.03 1.11 0.41 0.35 -1.00 0.00 0.00 179.01 179.91 3hyp h PHE 32 N 0.77 0.72 0.00 4.33 3.57 -0.07 0.16 116.94 126.42 3hyp h PHE 32 Ca 0.08 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 3hyp h PHE 32 Cb 0.91 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 3hyp h PHE 32 CO 0.06 0.13 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.01 3hyp h LEU 33 N 0.57 0.00 0.11 0.59 3.38 -1.07 0.18 115.31 119.08 3hyp h LEU 33 Ca 0.47 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.10 3hyp h LEU 33 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3hyp h LEU 33 CO -0.39 0.19 -1.85 0.11 0.09 0.00 0.00 178.44 176.58 3hyp h LYS 34 N 0.00 0.24 0.00 1.13 1.57 -0.96 -3.26 116.57 115.29 3hyp h LYS 34 Ca -0.00 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3hyp h LYS 34 Cb 0.55 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.01 3hyp h LYS 34 CO 0.02 1.10 -1.24 1.63 -0.57 0.00 0.00 179.45 180.40 3hyp n LYS 35 N -3.43 0.89 0.00 3.15 5.02 0.37 -4.89 118.16 119.28 3hyp n LYS 35 Ca -0.26 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 55.96 3hyp n LYS 35 Cb 1.05 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 34.90 3hyp n LYS 35 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3hyp n ILE 36 N -1.71 0.00 -3.77 -0.18 2.08 0.60 -5.04 119.36 111.34 3hyp n ILE 36 Ca -0.01 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.17 3hyp n ILE 36 Cb 0.21 -0.61 -0.13 0.00 -0.75 0.00 0.00 39.64 38.36 3hyp n ILE 36 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3hyp s ALA 37 N -3.63 -0.37 -1.34 -1.39 0.00 -0.96 -5.01 121.76 109.06 3hyp s ALA 37 Ca 0.00 0.64 -0.17 0.00 0.00 0.00 0.00 51.96 52.43 3hyp s ALA 37 Cb 0.00 -0.41 0.05 0.00 0.00 0.00 0.00 23.12 22.76 3hyp s ALA 37 CO 0.00 -0.13 1.91 -3.47 0.00 0.00 0.00 175.76 174.07 3hyp n ASP 38 N 3.71 4.47 0.08 0.00 2.03 -1.23 -4.11 116.55 121.49 3hyp n ASP 38 Ca -0.20 -2.88 -0.10 0.00 0.52 0.00 0.00 54.79 52.12 3hyp n ASP 38 Cb 0.55 -1.71 -0.09 0.00 -0.72 0.00 0.00 41.12 39.15 3hyp n ASP 38 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 3hyp h TYR 39 N 7.15 0.23 -4.17 -0.67 -0.00 -1.93 -3.46 116.97 114.12 3hyp h TYR 39 Ca 0.48 -0.15 -0.53 0.00 -0.00 0.00 0.00 58.73 58.53 3hyp h TYR 39 Cb 0.79 -0.01 0.14 0.00 -0.00 0.00 0.00 36.73 37.65 3hyp h TYR 39 CO 1.43 1.08 0.40 -1.21 -0.00 0.00 0.00 178.16 179.86 3hyp s GLU 40 N -2.83 2.37 -1.57 0.10 0.41 -1.26 -4.89 118.70 111.03 3hyp s GLU 40 Ca -0.02 1.72 -0.10 0.00 -0.41 0.00 0.00 54.97 56.17 3hyp s GLU 40 Cb 0.09 -1.87 -0.05 0.00 -1.78 0.00 0.00 34.13 30.53 3hyp s GLU 40 CO 0.84 -1.65 2.80 0.09 -0.49 0.00 0.00 175.26 176.85 3hyp n ASN 41 N -2.49 8.14 -0.18 -0.19 3.02 -1.26 -4.34 115.26 117.96 3hyp n ASN 41 Ca 0.13 -2.68 0.06 0.00 -0.03 0.00 0.00 54.58 52.06 3hyp n ASN 41 Cb 0.50 -1.54 0.09 0.00 -0.61 0.00 0.00 39.78 38.22 3hyp n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hyp n HIS 42 N 3.59 0.00 0.58 3.10 1.44 -1.26 -4.70 115.22 117.96 3hyp n HIS 42 Ca 0.73 -0.65 0.09 0.00 -2.01 0.00 0.00 57.72 55.88 3hyp n HIS 42 Cb 0.25 -0.11 -0.12 0.00 0.12 0.00 0.00 29.99 30.13 3hyp n HIS 42 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 3hyp n SER 43 N -0.93 0.76 -4.66 4.39 7.64 -1.26 -5.00 113.62 114.56 3hyp n SER 43 Ca 0.10 -0.61 -0.53 0.00 1.01 0.00 0.00 58.87 58.83 3hyp n SER 43 Cb 0.63 1.32 -0.06 0.00 -1.01 0.00 0.00 64.21 65.09 3hyp n SER 43 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3hyp n LYS 44 N -1.71 1.35 -4.84 1.43 3.00 -1.26 -4.96 118.16 111.17 3hyp n LYS 44 Ca 0.01 0.49 -0.33 0.00 -0.00 0.00 0.00 58.31 58.48 3hyp n LYS 44 Cb 0.37 -2.18 -0.14 0.00 0.00 0.00 0.00 35.03 33.08 3hyp n LYS 44 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 3hyp s GLU 45 N 2.23 3.08 -0.26 1.64 2.02 -1.26 -5.06 118.70 121.08 3hyp s GLU 45 Ca 0.91 -0.70 -0.28 0.00 0.02 0.00 0.00 54.97 54.92 3hyp s GLU 45 Cb -0.95 -2.53 -0.03 0.00 0.10 0.00 0.00 34.13 30.71 3hyp s GLU 45 CO 0.55 0.35 1.94 -0.46 0.02 0.00 0.00 175.26 177.65 3hyp s TRP 46 N -0.00 1.58 -0.56 1.61 -0.11 -1.26 -4.92 118.94 115.28 3hyp s TRP 46 Ca -0.04 0.54 0.04 0.00 1.22 0.00 0.00 56.10 57.86 3hyp s TRP 46 Cb -0.14 -4.05 0.14 0.00 -1.50 0.00 0.00 33.47 27.92 3hyp s TRP 46 CO 0.04 -3.46 0.32 0.21 -4.62 0.00 0.00 176.95 169.43 3hyp s LYS 47 N 5.76 2.06 0.31 5.86 2.20 -1.26 -4.86 119.74 129.81 3hyp s LYS 47 Ca 0.87 -2.77 -0.29 0.00 -0.36 0.00 0.00 55.97 53.42 3hyp s LYS 47 Cb -0.27 -3.28 -0.13 0.00 -1.51 0.00 0.00 37.83 32.63 3hyp s LYS 47 CO 0.34 -1.16 1.22 0.98 -0.36 0.00 0.00 175.35 176.37 3hyp n TYR 48 N 2.84 1.93 0.60 4.03 9.36 -1.26 -4.93 117.16 129.73 3hyp n TYR 48 Ca 0.09 0.59 0.07 0.00 3.32 0.00 0.00 57.90 61.97 3hyp n TYR 48 Cb 0.33 -2.37 -0.09 0.00 -0.63 0.00 0.00 39.34 36.58 3hyp n TYR 48 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3hyp n LEU 49 N 1.14 0.60 -4.78 2.98 4.77 -1.26 -5.00 117.00 115.44 3hyp n LEU 49 Ca 0.07 -0.41 -0.29 0.00 -0.03 0.00 0.00 56.01 55.36 3hyp n LEU 49 Cb 0.34 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.57 3hyp n LEU 49 CO 0.62 0.15 0.71 -0.83 -1.33 0.00 0.00 177.39 176.71 3hyp s GLY 50 N -2.72 1.57 0.00 -0.72 0.00 -1.26 -4.98 107.32 99.22 3hyp s GLY 50 Ca 0.04 -0.52 0.18 0.00 0.00 0.00 0.00 44.72 44.41 3hyp s GLY 50 CO 0.64 0.04 0.97 2.09 0.00 0.00 0.00 173.10 176.84 3hyp n ASP 51 N -3.80 2.01 -4.05 1.64 5.68 -1.26 -4.95 116.55 111.82 3hyp n ASP 51 Ca 0.06 -1.51 -0.10 0.00 -0.50 0.00 0.00 54.79 52.75 3hyp n ASP 51 Cb 0.59 0.29 -0.11 0.00 -1.14 0.00 0.00 41.12 40.76 3hyp n ASP 51 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3hyp s LYS 52 N -1.82 0.51 0.76 0.11 1.02 -1.26 -5.13 119.74 113.92 3hyp s LYS 52 Ca 0.17 -0.88 -0.15 0.00 0.02 0.00 0.00 55.97 55.12 3hyp s LYS 52 Cb 0.14 -0.04 0.01 0.00 -0.52 0.00 0.00 37.83 37.42 3hyp s LYS 52 CO 0.36 -0.03 0.79 -2.30 -0.92 0.00 0.00 175.35 173.25 3hyp n PRO 53 N 1.02 0.29 -3.79 -1.68 -0.02 -1.26 -4.71 135.00 124.85 3hyp n PRO 53 Ca -0.20 0.15 -0.13 0.00 -2.02 0.00 0.00 63.50 61.31 3hyp n PRO 53 Cb 0.57 -2.08 -0.10 0.00 -0.02 0.00 0.00 33.50 31.87 3hyp n PRO 53 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hyp s ALA 54 N -1.97 -0.66 -0.18 3.55 0.00 -0.76 -1.74 121.76 120.00 3hyp s ALA 54 Ca 0.69 0.35 -0.09 0.00 0.00 0.00 0.00 51.96 52.90 3hyp s ALA 54 Cb -0.32 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 3hyp s ALA 54 CO 0.55 -0.22 0.12 0.42 0.00 0.00 0.00 175.76 176.63 3hyp s ILE 55 N -0.96 5.28 -0.29 0.00 1.01 -0.38 -0.33 121.20 125.54 3hyp s ILE 55 Ca -0.10 0.14 -0.05 0.00 0.00 0.00 0.00 60.65 60.64 3hyp s ILE 55 Cb -0.05 -3.39 0.02 0.00 0.01 0.00 0.00 42.46 39.05 3hyp s ILE 55 CO 0.03 0.47 0.04 -0.69 0.00 0.00 0.00 174.94 174.79 3hyp s VAL 56 N 0.13 3.57 -0.31 2.92 1.01 -0.34 0.20 120.40 127.57 3hyp s VAL 56 Ca 0.08 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.05 3hyp s VAL 56 Cb -0.11 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 3hyp s VAL 56 CO -0.01 0.06 0.21 -0.62 0.00 0.00 0.00 175.10 174.75 3hyp s ASP 57 N 1.42 6.00 -0.14 3.32 2.15 0.13 -0.37 116.67 129.18 3hyp s ASP 57 Ca 0.01 -0.27 -0.20 0.00 0.43 0.00 0.00 52.55 52.52 3hyp s ASP 57 Cb -0.18 -2.12 -0.03 0.00 -0.30 0.00 0.00 42.92 40.29 3hyp s ASP 57 CO 0.00 -0.16 0.58 -0.36 -0.17 0.00 0.00 175.17 175.07 3hyp s PHE 58 N 1.73 3.47 0.22 -5.34 0.08 -0.29 0.61 117.98 118.46 3hyp s PHE 58 Ca 0.06 0.97 -0.03 0.00 0.12 0.00 0.00 56.93 58.06 3hyp s PHE 58 Cb -0.17 -2.70 -0.03 0.00 -0.57 0.00 0.00 43.02 39.55 3hyp s PHE 58 CO 0.10 0.01 0.21 1.52 -0.10 0.00 0.00 175.22 176.96 3hyp s TYR 59 N 1.18 1.04 0.08 0.36 -0.85 -0.04 -3.32 117.35 115.81 3hyp s TYR 59 Ca 0.29 -1.27 -0.17 0.00 -0.52 0.00 0.00 57.07 55.40 3hyp s TYR 59 Cb -0.16 -0.42 0.03 0.00 0.38 0.00 0.00 41.96 41.79 3hyp s TYR 59 CO 0.12 -0.72 0.40 0.00 -1.52 0.00 0.00 175.55 173.82 3hyp s ALA 60 N -4.08 -0.94 0.20 9.51 0.00 -1.26 -1.45 121.76 123.74 3hyp s ALA 60 Ca 0.36 0.11 0.19 0.00 0.00 0.00 0.00 51.96 52.62 3hyp s ALA 60 Cb 0.05 0.51 0.76 0.00 0.00 0.00 0.00 23.12 24.44 3hyp s ALA 60 CO 0.12 -0.54 1.77 -0.44 0.00 0.00 0.00 175.76 176.67 3hyp h ASP 61 N 2.71 0.00 0.02 0.00 3.32 -2.00 -2.23 116.42 118.24 3hyp h ASP 61 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3hyp h ASP 61 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3hyp h ASP 61 CO 0.46 0.34 0.00 -2.67 -1.72 0.00 0.00 179.24 175.65 3hyp n TRP 62 N -3.57 0.00 -3.05 4.55 4.27 -1.26 -4.77 117.44 113.62 3hyp n TRP 62 Ca -0.00 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.18 3hyp n TRP 62 Cb 0.47 -0.01 -0.06 0.00 -1.36 0.00 0.00 31.31 30.35 3hyp n TRP 62 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3hyp h GLY 64 N 9.94 -1.12 0.68 0.00 0.00 -1.88 -3.22 103.07 107.48 3hyp h GLY 64 Ca -0.25 0.44 0.13 0.00 0.00 0.00 0.00 47.33 47.65 3hyp h GLY 64 CO 0.94 -0.39 0.52 -2.55 0.00 0.00 0.00 176.54 175.06 3hyp h PRO 65 N -1.00 0.55 -0.86 4.80 0.11 -1.93 0.72 132.00 134.39 3hyp h PRO 65 Ca -0.09 -0.03 0.22 0.00 0.11 0.00 0.00 66.00 66.20 3hyp h PRO 65 Cb 0.78 -0.12 -0.13 0.00 0.11 0.00 0.00 31.00 31.64 3hyp h PRO 65 CO 0.12 0.36 0.29 0.00 -0.21 0.00 0.00 178.00 178.57 3hyp h LYS 67 N 0.30 0.21 -0.01 0.00 1.57 -0.93 0.86 116.57 118.56 3hyp h LYS 67 Ca 0.53 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 3hyp h LYS 67 Cb 1.03 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.29 3hyp h LYS 67 CO -0.58 0.14 -0.30 0.00 -0.57 0.00 0.00 179.45 178.13 3hyp n MET 68 N -5.20 0.89 -0.01 3.15 0.00 -0.39 -3.78 117.12 111.77 3hyp n MET 68 Ca 0.25 -0.57 -0.06 0.00 0.00 0.00 0.00 57.70 57.32 3hyp n MET 68 Cb 0.81 -1.49 -0.13 0.00 0.00 0.00 0.00 33.22 32.42 3hyp n MET 68 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 3hyp n VAL 69 N -0.56 1.47 0.38 3.17 0.31 0.27 -4.27 118.33 119.11 3hyp n VAL 69 Ca 0.12 -0.77 -0.17 0.00 -0.01 0.00 0.00 64.34 63.50 3hyp n VAL 69 Cb 0.37 -0.91 -0.09 0.00 -0.91 0.00 0.00 33.84 32.30 3hyp n VAL 69 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hyp h ALA 70 N 1.12 -1.23 -0.61 3.52 0.00 -0.90 -1.99 119.26 119.17 3hyp h ALA 70 Ca -0.27 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.54 3hyp h ALA 70 Cb 1.91 0.55 -0.12 0.00 0.00 0.00 0.00 17.79 20.13 3hyp h ALA 70 CO 0.07 -1.19 -0.18 -1.00 0.00 0.00 0.00 179.25 176.94 3hyp h PRO 71 N -1.06 -0.03 0.09 0.00 0.13 -1.77 0.01 132.00 129.37 3hyp h PRO 71 Ca -0.09 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.05 3hyp h PRO 71 Cb 0.85 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 31.94 3hyp h PRO 71 CO 0.09 -0.02 -0.52 0.82 -0.23 0.00 0.00 178.00 178.14 3hyp h ILE 72 N -0.03 0.00 -0.63 -3.56 2.04 -1.72 -1.26 117.51 112.35 3hyp h ILE 72 Ca 0.29 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.28 3hyp h ILE 72 Cb 0.47 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.43 3hyp h ILE 72 CO -0.64 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 177.32 3hyp h LEU 73 N -0.73 -0.51 -0.46 1.44 3.38 -0.25 0.23 115.31 118.41 3hyp h LEU 73 Ca -0.00 0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.23 3hyp h LEU 73 Cb 0.74 0.36 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 3hyp h LEU 73 CO -0.30 -0.19 0.01 -0.33 0.09 0.00 0.00 178.44 177.73 3hyp h GLU 74 N 0.02 0.12 -0.03 1.13 4.39 -0.89 0.76 114.58 120.09 3hyp h GLU 74 Ca 0.31 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 60.04 3hyp h GLU 74 Cb 0.48 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.05 3hyp h GLU 74 CO -0.62 0.08 -0.28 0.93 -1.16 0.00 0.00 179.01 177.96 3hyp h GLU 75 N 0.13 -0.39 -0.31 2.33 5.08 0.57 -1.57 114.58 120.41 3hyp h GLU 75 Ca 0.23 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.71 3hyp h GLU 75 Cb 0.33 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3hyp h GLU 75 CO -0.37 -0.26 0.23 -0.07 -1.00 0.00 0.00 179.01 177.54 3hyp h LEU 76 N -0.41 0.00 -1.20 1.33 3.38 -0.38 -0.53 115.31 117.50 3hyp h LEU 76 Ca 0.07 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.09 3hyp h LEU 76 Cb 0.51 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 3hyp h LEU 76 CO -0.27 0.00 0.56 -1.28 0.09 0.00 0.00 178.44 177.54 3hyp h SER 77 N 0.00 0.87 0.23 -0.43 0.87 0.17 -1.63 113.55 113.64 3hyp h SER 77 Ca 0.15 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 3hyp h SER 77 Cb 0.61 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 3hyp h SER 77 CO -0.00 0.58 -0.11 0.11 -0.53 0.00 0.00 176.83 176.88 3hyp h LYS 78 N 1.00 -0.30 -0.79 2.24 1.79 -1.00 -1.44 116.57 118.08 3hyp h LYS 78 Ca 0.35 0.02 0.23 0.00 -2.18 0.00 0.00 60.65 59.07 3hyp h LYS 78 Cb 0.12 0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.81 3hyp h LYS 78 CO -0.12 -0.20 0.79 1.49 -1.08 0.00 0.00 179.45 180.34 3hyp h GLU 79 N -1.08 0.00 0.00 3.15 4.81 -1.29 0.13 114.58 120.30 3hyp h GLU 79 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3hyp h GLU 79 Cb 0.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3hyp h GLU 79 CO 0.05 0.00 -0.01 0.66 -0.73 0.00 0.00 179.01 178.99 3hyp n TYR 80 N -3.64 0.00 -1.45 0.92 4.01 -0.62 -5.05 117.16 111.32 3hyp n TYR 80 Ca 0.17 -0.52 -0.42 0.00 -0.16 0.00 0.00 57.90 56.97 3hyp n TYR 80 Cb 1.06 -0.06 0.01 0.00 -0.31 0.00 0.00 39.34 40.04 3hyp n TYR 80 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hyp n ALA 81 N -0.57 -1.55 0.00 -0.72 0.00 0.45 -1.57 120.51 116.54 3hyp n ALA 81 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.62 3hyp n ALA 81 Cb 0.32 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 18.01 3hyp n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hyp n GLY 82 N 1.80 2.01 0.12 0.00 0.00 -1.26 -4.67 105.19 103.19 3hyp n GLY 82 Ca 0.11 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 3hyp n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hyp n LYS 83 N 0.00 0.72 -4.00 1.61 5.02 -0.61 -4.98 118.16 115.92 3hyp n LYS 83 Ca 0.00 0.26 -0.08 0.00 -2.02 0.00 0.00 58.31 56.47 3hyp n LYS 83 Cb 0.00 -1.72 -0.10 0.00 -0.02 0.00 0.00 35.03 33.19 3hyp n LYS 83 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3hyp s ILE 84 N -2.57 0.15 0.06 -0.18 -4.36 -1.01 -4.22 121.20 109.07 3hyp s ILE 84 Ca -0.18 -1.22 -0.05 0.00 -0.26 0.00 0.00 60.65 58.94 3hyp s ILE 84 Cb 0.07 -0.76 -0.05 0.00 1.25 0.00 0.00 42.46 42.97 3hyp s ILE 84 CO 0.78 -0.67 0.30 -0.31 0.24 0.00 0.00 174.94 175.28 3hyp s TYR 85 N -2.41 3.53 -0.27 1.37 2.02 -0.71 -4.62 117.35 116.26 3hyp s TYR 85 Ca -0.07 0.52 0.03 0.00 -0.37 0.00 0.00 57.07 57.17 3hyp s TYR 85 Cb -0.03 -1.96 0.07 0.00 -0.40 0.00 0.00 41.96 39.64 3hyp s TYR 85 CO -0.04 0.55 -0.07 0.42 -1.57 0.00 0.00 175.55 174.84 3hyp s ILE 86 N -1.45 2.02 0.11 2.71 1.01 -1.26 -1.25 121.20 123.08 3hyp s ILE 86 Ca 0.33 -1.65 0.01 0.00 0.00 0.00 0.00 60.65 59.34 3hyp s ILE 86 Cb -0.13 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 3hyp s ILE 86 CO 0.21 -0.15 0.26 -0.31 0.00 0.00 0.00 174.94 174.95 3hyp s TYR 87 N 1.15 3.50 -0.07 3.97 2.02 0.13 -4.97 117.35 123.08 3hyp s TYR 87 Ca -0.05 0.22 0.03 0.00 -0.37 0.00 0.00 57.07 56.90 3hyp s TYR 87 Cb -0.20 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 39.63 3hyp s TYR 87 CO -0.06 0.54 -0.17 0.15 -1.57 0.00 0.00 175.55 174.44 3hyp s LYS 88 N -2.85 2.11 -0.14 -0.62 1.02 -1.26 0.18 119.74 118.18 3hyp s LYS 88 Ca 0.35 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.78 3hyp s LYS 88 Cb -0.12 -1.69 0.01 0.00 -0.52 0.00 0.00 37.83 35.50 3hyp s LYS 88 CO 0.28 0.11 -0.22 0.08 -0.92 0.00 0.00 175.35 174.69 3hyp s VAL 89 N 0.45 2.09 -0.57 3.17 1.01 0.20 -4.92 120.40 121.83 3hyp s VAL 89 Ca -0.14 -0.97 -0.22 0.00 0.00 0.00 0.00 61.98 60.66 3hyp s VAL 89 Cb -0.16 -1.84 0.06 0.00 0.00 0.00 0.00 36.38 34.45 3hyp s VAL 89 CO 0.05 0.55 0.82 0.21 0.00 0.00 0.00 175.10 176.72 3hyp s ASN 90 N 0.84 6.24 0.58 3.32 2.47 -1.26 -0.86 114.94 126.27 3hyp s ASN 90 Ca -0.06 -0.81 0.28 0.00 0.42 0.00 0.00 52.86 52.69 3hyp s ASN 90 Cb -0.15 -2.37 1.66 0.00 -1.45 0.00 0.00 41.25 38.94 3hyp s ASN 90 CO -0.02 -1.16 2.13 -0.37 -3.72 0.00 0.00 177.10 173.96 3hyp h VAL 91 N 5.95 0.52 0.00 -5.21 -1.51 -1.55 -0.58 116.25 113.86 3hyp h VAL 91 Ca -0.28 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.11 3hyp h VAL 91 Cb 1.08 0.87 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 3hyp h VAL 91 CO 1.07 0.00 -0.40 0.44 -1.23 0.00 0.00 177.57 177.45 3hyp h ASP 92 N 0.00 0.00 -0.01 4.19 3.32 -1.91 -2.99 116.42 119.01 3hyp h ASP 92 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3hyp h ASP 92 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3hyp h ASP 92 CO -0.00 0.40 -0.53 0.29 -1.72 0.00 0.00 179.24 177.68 3hyp n LYS 93 N -3.76 1.15 -3.21 3.56 5.02 -0.28 -4.56 118.16 116.09 3hyp n LYS 93 Ca -0.01 -0.83 -0.23 0.00 -2.02 0.00 0.00 58.31 55.22 3hyp n LYS 93 Cb 0.47 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 3hyp n LYS 93 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3hyp n GLU 94 N -0.25 1.31 -0.19 1.97 -0.58 -0.87 -4.97 120.64 117.06 3hyp n GLU 94 Ca 0.08 -3.65 -0.07 0.00 -0.42 0.00 0.00 57.16 53.09 3hyp n GLU 94 Cb 0.43 -1.61 0.02 0.00 -0.57 0.00 0.00 31.44 29.71 3hyp n GLU 94 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 3hyp h PRO 95 N 3.67 0.76 -0.63 3.49 0.11 -1.80 -2.46 132.00 135.15 3hyp h PRO 95 Ca 0.10 -0.10 0.05 0.00 0.11 0.00 0.00 66.00 66.16 3hyp h PRO 95 Cb 0.83 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 31.75 3hyp h PRO 95 CO 0.57 0.61 0.36 1.49 -0.21 0.00 0.00 178.00 180.82 3hyp h GLU 96 N 0.72 0.66 0.08 1.05 4.81 -1.93 0.33 114.58 120.30 3hyp h GLU 96 Ca 0.19 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3hyp h GLU 96 Cb 0.09 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3hyp h GLU 96 CO -0.03 0.44 -0.04 1.25 -0.73 0.00 0.00 179.01 179.90 3hyp h LEU 97 N 0.68 -0.11 0.47 1.64 5.85 -1.90 0.70 115.31 122.65 3hyp h LEU 97 Ca 0.27 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 3hyp h LEU 97 Cb 0.12 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3hyp h LEU 97 CO -0.15 -0.07 -0.38 0.00 -0.34 0.00 0.00 178.44 177.49 3hyp h ALA 98 N 0.81 -0.88 0.22 1.25 0.00 -0.93 -2.32 119.26 117.40 3hyp h ALA 98 Ca -0.01 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.76 3hyp h ALA 98 Cb 0.10 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3hyp h ALA 98 CO 0.01 -1.03 -0.42 -0.09 0.00 0.00 0.00 179.25 177.72 3hyp h ARG 99 N -0.85 -0.70 -1.05 0.00 2.43 -0.13 -2.36 114.38 111.72 3hyp h ARG 99 Ca -0.05 0.05 0.27 0.00 -0.81 0.00 0.00 59.98 59.44 3hyp h ARG 99 Cb 0.73 0.16 -0.10 0.00 -0.42 0.00 0.00 29.97 30.33 3hyp h ARG 99 CO -0.01 -0.47 0.66 -0.44 -1.51 0.00 0.00 179.97 178.20 3hyp h ASP 100 N -0.73 0.49 -0.62 -3.80 5.19 0.47 0.09 116.42 117.52 3hyp h ASP 100 Ca -0.00 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 3hyp h ASP 100 Cb 0.71 0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.25 3hyp h ASP 100 CO -0.18 0.07 0.00 0.49 -3.12 0.00 0.00 179.24 176.49 3hyp n PHE 101 N -4.70 0.86 -3.66 4.55 3.72 -0.88 -4.95 117.46 112.40 3hyp n PHE 101 Ca 0.27 -0.42 -0.25 0.00 -0.05 0.00 0.00 57.45 57.00 3hyp n PHE 101 Cb 0.89 -0.01 0.07 0.00 -0.94 0.00 0.00 39.48 39.48 3hyp n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hyp n GLY 102 N 1.45 -0.53 3.62 1.37 0.00 0.02 -4.88 105.19 106.24 3hyp n GLY 102 Ca 0.21 0.24 -0.49 0.00 0.00 0.00 0.00 46.02 45.98 3hyp n GLY 102 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hyp n ILE 103 N -4.90 0.44 -0.01 -0.61 2.08 -1.07 -4.87 119.36 110.43 3hyp n ILE 103 Ca -0.00 -0.19 -0.11 0.00 0.56 0.00 0.00 62.75 63.01 3hyp n ILE 103 Cb 0.56 -1.90 -0.14 0.00 -0.75 0.00 0.00 39.64 37.41 3hyp n ILE 103 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 3hyp h GLN 104 N 10.77 0.05 -2.61 0.38 4.20 -1.93 -3.48 115.11 122.50 3hyp h GLN 104 Ca -0.42 -0.09 0.13 0.00 0.06 0.00 0.00 58.65 58.33 3hyp h GLN 104 Cb 1.28 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.07 3hyp h GLN 104 CO 0.97 0.66 0.54 0.20 -0.67 0.00 0.00 178.83 180.53 3hyp s GLY 105 N -5.15 0.15 -0.03 3.46 0.00 -1.26 -5.17 107.32 99.32 3hyp s GLY 105 Ca -0.07 -0.40 0.03 0.00 0.00 0.00 0.00 44.72 44.28 3hyp s GLY 105 CO 0.82 2.00 -0.12 -0.42 0.00 0.00 0.00 173.10 175.38 3hyp s ILE 106 N -2.21 1.00 0.19 0.90 -1.09 -1.26 -3.50 121.20 115.23 3hyp s ILE 106 Ca 0.21 -0.49 -0.18 0.00 -2.23 0.00 0.00 60.65 57.95 3hyp s ILE 106 Cb -0.03 -0.87 -0.08 0.00 -1.58 0.00 0.00 42.46 39.90 3hyp s ILE 106 CO 0.06 0.30 0.68 -2.16 -1.23 0.00 0.00 174.94 172.59 3hyp s PRO 107 N 0.06 4.19 -0.06 2.79 0.04 -1.26 -4.83 135.00 135.92 3hyp s PRO 107 Ca -0.02 0.78 -0.02 0.00 0.04 0.00 0.00 61.00 61.78 3hyp s PRO 107 Cb -0.09 -2.92 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 3hyp s PRO 107 CO 0.01 0.43 0.07 0.99 0.04 0.00 0.00 177.00 178.53 3hyp s THR 108 N -1.48 4.76 -0.03 1.26 2.01 -1.21 -0.41 115.64 120.54 3hyp s THR 108 Ca 0.41 -0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.24 3hyp s THR 108 Cb -0.17 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.26 3hyp s THR 108 CO 0.21 0.51 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.91 3hyp s ILE 109 N -1.04 0.92 -0.06 1.82 1.01 -0.29 -1.14 121.20 122.42 3hyp s ILE 109 Ca 0.17 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.40 3hyp s ILE 109 Cb -0.12 -0.81 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 3hyp s ILE 109 CO 0.07 0.28 -0.07 0.26 0.00 0.00 0.00 174.94 175.48 3hyp s TRP 110 N 0.18 2.92 -0.29 3.97 0.52 0.51 -1.64 118.94 125.10 3hyp s TRP 110 Ca -0.04 0.01 -0.04 0.00 0.02 0.00 0.00 56.10 56.06 3hyp s TRP 110 Cb -0.09 -1.70 0.03 0.00 -1.15 0.00 0.00 33.47 30.56 3hyp s TRP 110 CO 0.01 0.33 0.02 -0.06 0.02 0.00 0.00 176.95 177.27 3hyp s PHE 111 N -0.82 3.18 -0.39 -1.98 0.08 -0.07 -1.20 117.98 116.78 3hyp s PHE 111 Ca 0.13 -1.50 -0.07 0.00 0.12 0.00 0.00 56.93 55.60 3hyp s PHE 111 Cb -0.11 -2.16 0.07 0.00 -0.57 0.00 0.00 43.02 40.25 3hyp s PHE 111 CO 0.02 -0.72 0.19 0.08 -0.10 0.00 0.00 175.22 174.69 3hyp s VAL 112 N 1.36 3.96 0.83 -0.44 1.01 0.55 -1.42 120.40 126.25 3hyp s VAL 112 Ca -0.01 -1.37 -0.14 0.00 0.00 0.00 0.00 61.98 60.46 3hyp s VAL 112 Cb -0.18 -3.38 0.21 0.00 0.00 0.00 0.00 36.38 33.03 3hyp s VAL 112 CO -0.00 -0.40 0.54 -0.81 0.00 0.00 0.00 175.10 174.42 3hyp n PRO 113 N 4.84 -3.40 0.06 2.72 -0.04 -1.26 -1.84 135.00 136.08 3hyp n PRO 113 Ca -0.10 -0.89 0.11 0.00 -0.04 0.00 0.00 63.50 62.58 3hyp n PRO 113 Cb 0.43 -1.08 -0.04 0.00 -0.04 0.00 0.00 33.50 32.78 3hyp n PRO 113 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3hyp n MET 114 N -4.08 0.54 -3.83 0.54 2.81 -1.26 -4.73 117.12 107.11 3hyp n MET 114 Ca 0.08 0.01 -0.12 0.00 -1.81 0.00 0.00 57.70 55.86 3hyp n MET 114 Cb 0.35 -1.69 -0.10 0.00 -0.71 0.00 0.00 33.22 31.07 3hyp n MET 114 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3hyp s LYS 115 N -3.37 0.46 0.00 0.03 -0.14 -1.26 -4.80 119.74 110.66 3hyp s LYS 115 Ca -0.01 -0.18 0.00 0.00 -1.36 0.00 0.00 55.97 54.41 3hyp s LYS 115 Cb 0.12 0.20 0.00 0.00 -1.68 0.00 0.00 37.83 36.47 3hyp s LYS 115 CO 0.82 -0.11 0.00 0.41 -0.76 0.00 0.00 175.35 175.72 3hyp n GLY 116 N 1.81 1.24 3.79 -3.33 0.00 -1.26 -5.01 105.19 102.42 3hyp n GLY 116 Ca -0.20 -1.91 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 3hyp n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hyp s GLU 117 N -2.36 4.33 0.33 1.61 0.41 -1.26 -4.63 118.70 117.13 3hyp s GLU 117 Ca 0.00 1.38 -0.29 0.00 -0.41 0.00 0.00 54.97 55.64 3hyp s GLU 117 Cb 0.00 -2.58 -0.11 0.00 -1.78 0.00 0.00 34.13 29.66 3hyp s GLU 117 CO 0.00 0.04 1.55 -2.14 -0.49 0.00 0.00 175.26 174.22 3hyp s PRO 118 N -2.45 4.11 -0.07 0.39 0.02 -1.26 -4.75 135.00 130.99 3hyp s PRO 118 Ca 0.56 2.58 -0.28 0.00 0.02 0.00 0.00 61.00 63.88 3hyp s PRO 118 Cb -0.18 -3.00 -0.02 0.00 0.02 0.00 0.00 34.50 31.31 3hyp s PRO 118 CO 0.24 -0.60 0.91 -0.65 -0.33 0.00 0.00 177.00 176.57 3hyp s GLN 119 N -1.17 4.45 -0.18 5.54 -1.52 -0.51 -4.90 119.66 121.38 3hyp s GLN 119 Ca 0.59 1.24 -0.04 0.00 -1.95 0.00 0.00 55.36 55.20 3hyp s GLN 119 Cb -0.47 -3.50 -0.02 0.00 -0.22 0.00 0.00 33.01 28.79 3hyp s GLN 119 CO 0.54 -0.15 -0.04 0.08 -0.25 0.00 0.00 175.29 175.47 3hyp s VAL 120 N 1.45 3.67 -0.09 1.09 1.01 -1.26 -0.89 120.40 125.38 3hyp s VAL 120 Ca 0.46 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.06 3hyp s VAL 120 Cb -0.19 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.57 3hyp s VAL 120 CO 0.21 0.47 -0.22 0.21 0.00 0.00 0.00 175.10 175.76 3hyp s ASN 121 N 0.77 2.87 0.52 3.32 3.84 -0.65 -5.01 114.94 120.59 3hyp s ASN 121 Ca -0.02 -0.51 -0.05 0.00 0.21 0.00 0.00 52.86 52.49 3hyp s ASN 121 Cb -0.15 -1.25 -0.02 0.00 -0.55 0.00 0.00 41.25 39.28 3hyp s ASN 121 CO 0.02 0.15 0.82 -0.04 -2.79 0.00 0.00 177.10 175.26 3hyp s MET 122 N 0.34 3.35 0.10 0.43 -1.94 -1.26 -1.14 119.30 119.17 3hyp s MET 122 Ca -0.17 0.13 0.00 0.00 -1.71 0.00 0.00 55.69 53.95 3hyp s MET 122 Cb -0.17 -2.34 0.00 0.00 2.01 0.00 0.00 34.83 34.33 3hyp s MET 122 CO 0.08 -0.36 0.00 0.41 -0.01 0.00 0.00 175.02 175.14 3hyp n GLY 123 N -2.36 -2.84 3.44 -0.03 0.00 0.45 -4.94 105.19 98.91 3hyp n GLY 123 Ca 0.02 -1.33 -0.28 0.00 0.00 0.00 0.00 46.02 44.43 3hyp n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hyp s ALA 124 N -3.59 -0.76 0.32 4.61 0.00 -1.26 -4.80 121.76 116.29 3hyp s ALA 124 Ca 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 51.76 3hyp s ALA 124 Cb 0.00 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 3hyp s ALA 124 CO 0.00 -4.10 0.35 1.28 0.00 0.00 0.00 175.76 173.30 3hyp n LEU 125 N -5.12 0.00 -4.36 0.00 4.77 -1.26 -5.11 117.00 105.92 3hyp n LEU 125 Ca 0.03 -2.84 -0.26 0.00 -0.03 0.00 0.00 56.01 52.91 3hyp n LEU 125 Cb 0.55 1.94 -0.12 0.00 -2.33 0.00 0.00 43.42 43.46 3hyp n LEU 125 CO 0.56 -0.55 -0.53 -0.94 -1.33 0.00 0.00 177.39 174.60 3hyp s SER 126 N -3.12 3.05 0.26 -1.43 1.04 -1.26 -4.93 113.70 107.31 3hyp s SER 126 Ca 0.33 -0.79 -0.04 0.00 0.48 0.00 0.00 55.95 55.93 3hyp s SER 126 Cb 0.01 -0.20 0.51 0.00 0.10 0.00 0.00 66.02 66.44 3hyp s SER 126 CO 0.23 0.10 1.37 1.17 0.98 0.00 0.00 173.24 177.09 3hyp n LYS 127 N 0.66 -0.08 0.05 4.02 3.00 -1.26 0.10 118.16 124.66 3hyp n LYS 127 Ca -0.16 1.35 -0.13 0.00 -0.00 0.00 0.00 58.31 59.38 3hyp n LYS 127 Cb 0.55 -2.07 -0.08 0.00 0.00 0.00 0.00 35.03 33.43 3hyp n LYS 127 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 3hyp h GLU 128 N 0.00 -0.06 -0.23 1.64 4.81 -1.99 -0.75 114.58 118.00 3hyp h GLU 128 Ca 0.47 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.69 3hyp h GLU 128 Cb 0.82 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 3hyp h GLU 128 CO -0.87 0.07 0.11 1.96 -0.73 0.00 0.00 179.01 179.54 3hyp h GLN 129 N -0.18 0.33 0.31 1.92 4.20 -1.04 -0.17 115.11 120.48 3hyp h GLN 129 Ca -0.01 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3hyp h GLN 129 Cb 0.16 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3hyp h GLN 129 CO 0.01 0.35 -0.28 -0.07 -0.67 0.00 0.00 178.83 178.17 3hyp h LEU 130 N 0.23 -0.76 -0.99 1.46 3.38 -0.30 -0.46 115.31 117.87 3hyp h LEU 130 Ca 0.08 0.06 0.36 0.00 0.09 0.00 0.00 57.88 58.46 3hyp h LEU 130 Cb 0.13 0.25 -0.17 0.00 0.09 0.00 0.00 40.66 40.96 3hyp h LEU 130 CO -0.01 -0.38 0.47 0.11 0.09 0.00 0.00 178.44 178.72 3hyp h LYS 131 N -0.58 0.12 0.09 1.13 1.57 -1.11 0.72 116.57 118.51 3hyp h LYS 131 Ca -0.04 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3hyp h LYS 131 Cb 0.50 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 3hyp h LYS 131 CO -0.02 0.08 -0.36 0.78 -0.57 0.00 0.00 179.45 179.36 3hyp h GLY 132 N 0.12 -0.69 1.67 3.86 0.00 -0.09 -0.24 103.07 107.71 3hyp h GLY 132 Ca 0.76 0.43 -0.07 0.00 0.00 0.00 0.00 47.33 48.46 3hyp h GLY 132 CO -0.72 -0.25 -0.14 -0.97 0.00 0.00 0.00 176.54 174.45 3hyp h TYR 133 N -0.57 0.43 -0.19 5.60 0.05 0.18 -2.18 116.97 120.28 3hyp h TYR 133 Ca 0.03 -0.06 -0.15 0.00 0.05 0.00 0.00 58.73 58.60 3hyp h TYR 133 Cb 0.62 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 3hyp h TYR 133 CO -0.33 0.53 -0.52 0.82 -1.05 0.00 0.00 178.16 177.61 3hyp h ILE 134 N 0.37 1.32 0.15 -2.88 2.04 0.07 -0.10 117.51 118.47 3hyp h ILE 134 Ca 0.07 -1.75 -0.29 0.00 1.00 0.00 0.00 64.86 63.88 3hyp h ILE 134 Cb 0.48 1.73 0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3hyp h ILE 134 CO 0.03 0.55 -1.45 0.44 0.00 0.00 0.00 178.15 177.71 3hyp h ASP 135 N 0.42 0.49 0.01 1.72 3.32 -0.98 -3.11 116.42 118.30 3hyp h ASP 135 Ca 0.01 -0.90 -0.00 0.00 0.02 0.00 0.00 57.03 56.17 3hyp h ASP 135 Cb 1.05 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.44 3hyp h ASP 135 CO 0.10 1.65 -0.01 0.50 -1.72 0.00 0.00 179.24 179.76 3hyp h LYS 136 N -0.16 -0.02 0.10 3.56 3.64 -1.46 -3.11 116.57 119.12 3hyp h LYS 136 Ca -0.29 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.78 3hyp h LYS 136 Cb 1.87 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.68 3hyp h LYS 136 CO 0.12 0.77 -1.61 0.28 -2.27 0.00 0.00 179.45 176.74 3hyp h VAL 137 N -0.91 1.04 0.08 2.00 2.07 -1.21 -3.37 116.25 115.96 3hyp h VAL 137 Ca -0.00 -2.73 -0.31 0.00 0.82 0.00 0.00 66.70 64.48 3hyp h VAL 137 Cb 0.80 2.67 -0.02 0.00 -1.52 0.00 0.00 31.29 33.22 3hyp h VAL 137 CO 0.00 0.78 -1.64 -0.07 0.02 0.00 0.00 177.57 176.66 3hyp h LEU 138 N 0.06 0.28 -0.28 2.57 3.38 -1.48 -3.43 115.31 116.40 3hyp h LEU 138 Ca -0.27 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.24 3hyp h LEU 138 Cb 2.01 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.67 3hyp h LEU 138 CO 0.14 1.40 0.00 0.18 0.09 0.00 0.00 178.44 180.24