#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s66 n ILE 21 N 0.00 0.27 0.04 -0.61 -6.64 -1.26 -4.51 119.36 106.65 1s66 n ILE 21 Ca 0.00 -0.63 -0.15 0.00 -1.77 0.00 0.00 62.75 60.19 1s66 n ILE 21 Cb 0.00 1.21 -0.14 0.00 -1.44 0.00 0.00 39.64 39.27 1s66 n ILE 21 CO 0.00 0.00 0.00 -0.26 -1.77 0.00 0.00 176.55 174.52 1s66 h PHE 22 N 4.32 0.35 -0.03 4.28 0.04 -2.06 -2.86 116.94 120.97 1s66 h PHE 22 Ca 0.00 -0.25 -0.02 0.00 2.80 0.00 0.00 57.97 60.50 1s66 h PHE 22 Cb 0.94 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.08 1s66 h PHE 22 CO 0.13 1.34 -0.05 0.35 -0.60 0.00 0.00 178.31 179.47 1s66 h PHE 23 N 0.05 0.12 -0.08 -0.55 3.04 -2.01 -3.15 116.94 114.35 1s66 h PHE 23 Ca -0.25 -0.04 0.02 0.00 3.98 0.00 0.00 57.97 61.68 1s66 h PHE 23 Cb 2.00 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 40.48 1s66 h PHE 23 CO 0.05 0.62 0.12 -1.35 -2.02 0.00 0.00 178.31 175.73 1s66 h PRO 24 N -0.41 0.00 -0.10 6.41 0.11 -1.81 -1.32 132.00 134.88 1s66 h PRO 24 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 1s66 h PRO 24 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1s66 h PRO 24 CO 0.01 0.00 -0.17 0.00 -0.21 0.00 0.00 178.00 177.63 1s66 h ALA 25 N 1.84 0.15 0.00 -0.75 0.00 -1.47 -2.13 119.26 116.91 1s66 h ALA 25 Ca 0.04 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.43 1s66 h ALA 25 Cb 0.27 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1s66 h ALA 25 CO -0.00 0.07 -0.80 -0.07 0.00 0.00 0.00 179.25 178.45 1s66 h LEU 26 N -0.16 0.00 -0.57 0.00 3.38 -1.51 -2.86 115.31 113.60 1s66 h LEU 26 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1s66 h LEU 26 Cb 0.75 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1s66 h LEU 26 CO 0.04 0.80 -0.25 -0.08 0.09 0.00 0.00 178.44 179.04 1s66 h GLU 27 N 0.00 0.89 -0.69 1.13 4.57 -1.30 -3.21 114.58 115.97 1s66 h GLU 27 Ca -0.01 -0.38 -0.45 0.00 -1.18 0.00 0.00 59.36 57.34 1s66 h GLU 27 Cb 1.60 -0.03 -0.27 0.00 -0.16 0.00 0.00 28.75 29.90 1s66 h GLU 27 CO 0.10 1.03 -0.00 1.04 -1.18 0.00 0.00 179.01 180.00 1s66 n GLN 28 N -4.10 2.61 -3.35 1.92 6.02 -0.80 -4.31 117.38 115.37 1s66 n GLN 28 Ca -0.00 -3.50 -0.38 0.00 -0.01 0.00 0.00 57.00 53.11 1s66 n GLN 28 Cb 0.46 -2.10 -0.06 0.00 1.02 0.00 0.00 30.24 29.56 1s66 n GLN 28 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1s66 s ASN 29 N -2.58 6.96 0.45 1.08 3.84 -1.08 -4.96 114.94 118.66 1s66 s ASN 29 Ca 0.53 1.15 0.16 0.00 0.21 0.00 0.00 52.86 54.91 1s66 s ASN 29 Cb 0.44 -2.32 1.02 0.00 -0.55 0.00 0.00 41.25 39.85 1s66 s ASN 29 CO 0.02 0.27 1.99 0.00 -2.79 0.00 0.00 177.10 176.59 1s66 h MET 30 N 4.49 0.00 -6.71 0.43 -0.00 -1.92 -3.41 114.93 107.81 1s66 h MET 30 Ca -0.50 0.00 -0.50 0.00 -0.00 0.00 0.00 59.70 58.70 1s66 h MET 30 Cb 1.21 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.79 1s66 h MET 30 CO 0.63 0.19 0.30 -1.64 -0.00 0.00 0.00 176.91 176.40 1s66 s MET 31 N -4.56 4.74 0.83 -0.10 -1.94 -1.26 -4.83 119.30 112.19 1s66 s MET 31 Ca -0.04 1.38 -0.12 0.00 -1.71 0.00 0.00 55.69 55.19 1s66 s MET 31 Cb 0.15 -3.20 0.10 0.00 2.01 0.00 0.00 34.83 33.89 1s66 s MET 31 CO 0.69 0.50 1.19 0.20 -0.01 0.00 0.00 175.02 177.59 1s66 s GLY 32 N -1.24 2.03 -0.18 -0.03 0.00 -0.59 -4.70 107.32 102.61 1s66 s GLY 32 Ca 0.41 0.77 -0.04 0.00 0.00 0.00 0.00 44.72 45.86 1s66 s GLY 32 CO 0.29 1.19 0.20 0.00 0.00 0.00 0.00 173.10 174.78 1s66 s ALA 33 N -2.29 -0.19 -0.48 3.20 0.00 -1.26 -2.27 121.76 118.47 1s66 s ALA 33 Ca 0.71 0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.95 1s66 s ALA 33 Cb -0.27 -1.22 0.13 0.00 0.00 0.00 0.00 23.12 21.75 1s66 s ALA 33 CO 0.52 -1.12 0.22 0.08 0.00 0.00 0.00 175.76 175.47 1s66 s VAL 34 N 2.30 2.39 0.15 0.00 1.01 -1.17 -3.44 120.40 121.64 1s66 s VAL 34 Ca 0.06 -3.08 -0.26 0.00 0.00 0.00 0.00 61.98 58.70 1s66 s VAL 34 Cb -0.15 -2.68 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 1s66 s VAL 34 CO -0.11 -0.78 0.80 -0.22 0.00 0.00 0.00 175.10 174.79 1s66 s LEU 35 N -0.03 4.57 0.06 3.92 2.96 -1.14 -2.86 118.68 126.16 1s66 s LEU 35 Ca 0.16 1.65 0.06 0.00 -0.22 0.00 0.00 54.13 55.77 1s66 s LEU 35 Cb -0.25 -3.33 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 1s66 s LEU 35 CO -0.02 0.16 -0.16 0.27 -1.32 0.00 0.00 176.35 175.28 1s66 s ILE 36 N -0.89 1.29 0.08 6.68 -4.36 -0.93 -1.37 121.20 121.70 1s66 s ILE 36 Ca 0.37 -1.19 -0.00 0.00 -0.26 0.00 0.00 60.65 59.57 1s66 s ILE 36 Cb -0.23 -1.18 0.02 0.00 1.25 0.00 0.00 42.46 42.32 1s66 s ILE 36 CO 0.26 -0.03 0.11 -0.46 0.24 0.00 0.00 174.94 175.06 1s66 n ASN 37 N 1.62 0.11 -0.13 4.36 0.23 -0.83 -2.59 115.26 118.03 1s66 n ASN 37 Ca -0.19 -1.10 0.16 0.00 -0.53 0.00 0.00 54.58 52.91 1s66 n ASN 37 Cb 0.54 -0.07 0.53 0.00 -2.08 0.00 0.00 39.78 38.70 1s66 n ASN 37 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1s66 h GLU 38 N 0.00 0.34 -0.97 -3.83 9.09 -1.89 -2.17 114.58 115.16 1s66 h GLU 38 Ca -0.04 -0.02 -0.43 0.00 0.05 0.00 0.00 59.36 58.93 1s66 h GLU 38 Cb 0.12 -0.08 -0.26 0.00 -1.65 0.00 0.00 28.75 26.89 1s66 h GLU 38 CO 0.04 0.23 0.54 0.09 0.05 0.00 0.00 179.01 179.96 1s66 n ASN 39 N -4.46 3.82 -2.25 3.06 5.03 -1.26 -4.92 115.26 114.28 1s66 n ASN 39 Ca 0.13 -3.40 -0.17 0.00 0.87 0.00 0.00 54.58 52.01 1s66 n ASN 39 Cb 0.52 -0.80 -0.02 0.00 -1.02 0.00 0.00 39.78 38.46 1s66 n ASN 39 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1s66 n ASP 40 N -0.85 -4.96 -4.74 6.41 8.00 -0.81 -4.90 116.55 114.69 1s66 n ASP 40 Ca 0.52 0.14 -0.36 0.00 0.71 0.00 0.00 54.79 55.80 1s66 n ASP 40 Cb 1.53 -4.21 -0.08 0.00 -0.02 0.00 0.00 41.12 38.34 1s66 n ASP 40 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1s66 s GLU 41 N -4.75 4.14 -0.33 -1.24 2.02 -1.26 -0.98 118.70 116.30 1s66 s GLU 41 Ca 0.00 -0.11 -0.29 0.00 0.02 0.00 0.00 54.97 54.59 1s66 s GLU 41 Cb 0.00 -3.40 -0.01 0.00 0.10 0.00 0.00 34.13 30.82 1s66 s GLU 41 CO 0.00 0.33 1.56 0.08 0.02 0.00 0.00 175.26 177.25 1s66 s VAL 42 N 0.25 3.75 -0.19 2.63 1.01 -0.96 -1.97 120.40 124.91 1s66 s VAL 42 Ca 0.11 0.79 0.22 0.00 0.00 0.00 0.00 61.98 63.10 1s66 s VAL 42 Cb -0.12 -3.92 -0.07 0.00 0.00 0.00 0.00 36.38 32.28 1s66 s VAL 42 CO 0.00 -0.52 0.92 0.23 0.00 0.00 0.00 175.10 175.73 1s66 n MET 43 N 8.02 0.62 -3.79 2.72 0.00 -0.47 -2.26 117.12 121.95 1s66 n MET 43 Ca 0.19 0.09 -0.13 0.00 0.00 0.00 0.00 57.70 57.85 1s66 n MET 43 Cb 0.47 -1.78 -0.13 0.00 0.00 0.00 0.00 33.22 31.78 1s66 n MET 43 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 175.97 176.09 1s66 s PHE 44 N -3.31 -0.20 -0.39 2.03 5.99 -1.20 -4.98 117.98 115.91 1s66 s PHE 44 Ca -0.02 0.51 0.06 0.00 0.00 0.00 0.00 56.93 57.48 1s66 s PHE 44 Cb 0.10 0.04 0.17 0.00 0.00 0.00 0.00 43.02 43.33 1s66 s PHE 44 CO 0.81 -0.12 0.53 0.12 -0.00 0.00 0.00 175.22 176.56 1s66 s PHE 45 N 0.38 -1.16 0.84 10.12 5.36 -1.25 -2.87 117.98 129.39 1s66 s PHE 45 Ca -0.02 -0.18 -0.12 0.00 -0.96 0.00 0.00 56.93 55.65 1s66 s PHE 45 Cb -0.04 0.03 0.09 0.00 -0.34 0.00 0.00 43.02 42.77 1s66 s PHE 45 CO -0.02 -1.10 1.11 0.54 -1.46 0.00 0.00 175.22 174.30 1s66 s ASN 46 N 1.68 4.15 0.64 6.13 4.22 -1.22 -4.66 114.94 125.88 1s66 s ASN 46 Ca 0.16 1.19 0.41 0.00 -2.14 0.00 0.00 52.86 52.48 1s66 s ASN 46 Cb -0.09 -1.87 2.25 0.00 1.28 0.00 0.00 41.25 42.83 1s66 s ASN 46 CO -0.05 -2.17 2.33 -0.65 -2.04 0.00 0.00 177.10 174.51 1s66 h PRO 47 N -1.23 0.00 -0.36 3.55 0.11 -1.92 -2.01 132.00 130.14 1s66 h PRO 47 Ca -0.48 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 1s66 h PRO 47 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1s66 h PRO 47 CO 0.60 0.00 -0.35 0.00 -0.21 0.00 0.00 178.00 178.05 1s66 h ALA 48 N 2.00 0.71 0.00 -0.75 0.00 -1.85 -2.89 119.26 116.48 1s66 h ALA 48 Ca -0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1s66 h ALA 48 Cb 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1s66 h ALA 48 CO 0.00 0.66 -0.07 0.00 0.00 0.00 0.00 179.25 179.85 1s66 h ALA 49 N 0.92 0.99 -0.39 0.00 0.00 -1.65 -3.07 119.26 116.06 1s66 h ALA 49 Ca 0.07 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1s66 h ALA 49 Cb 0.90 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1s66 h ALA 49 CO 0.08 0.08 -0.20 0.93 0.00 0.00 0.00 179.25 180.15 1s66 h GLU 50 N 0.00 0.75 0.03 0.00 5.08 -1.27 -2.62 114.58 116.55 1s66 h GLU 50 Ca -0.00 -0.29 -0.22 0.00 -1.00 0.00 0.00 59.36 57.85 1s66 h GLU 50 Cb 0.74 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1s66 h GLU 50 CO 0.01 0.89 -1.03 0.87 -1.00 0.00 0.00 179.01 178.76 1s66 h LYS 51 N 0.66 0.09 -0.27 2.33 1.57 -1.51 -2.11 116.57 117.33 1s66 h LYS 51 Ca 0.10 -0.14 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1s66 h LYS 51 Cb 0.70 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1s66 h LYS 51 CO 0.05 1.03 -0.56 -0.07 -0.57 0.00 0.00 179.45 179.34 1s66 h LEU 52 N 0.03 0.94 0.00 2.94 3.38 -1.52 -3.34 115.31 117.74 1s66 h LEU 52 Ca -0.04 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1s66 h LEU 52 Cb 1.75 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1s66 h LEU 52 CO 0.15 1.30 -1.23 0.79 0.09 0.00 0.00 178.44 179.54 1s66 n TRP 53 N -4.00 0.00 -1.16 1.13 8.01 -0.99 -4.73 117.44 115.69 1s66 n TRP 53 Ca -0.04 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 56.09 1s66 n TRP 53 Cb 0.63 -0.14 -0.02 0.00 -2.01 0.00 0.00 31.31 29.77 1s66 n TRP 53 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1s66 n GLY 54 N 1.43 0.76 3.55 6.99 0.00 -0.80 -1.77 105.19 115.35 1s66 n GLY 54 Ca 0.02 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1s66 n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s66 s TYR 55 N -1.99 2.88 0.66 1.61 1.51 -1.19 -4.66 117.35 116.18 1s66 s TYR 55 Ca 0.00 -0.05 -0.11 0.00 -1.01 0.00 0.00 57.07 55.90 1s66 s TYR 55 Cb 0.00 -1.70 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1s66 s TYR 55 CO 0.00 0.27 1.05 0.15 -1.11 0.00 0.00 175.55 175.91 1s66 s LYS 56 N -0.72 3.18 0.50 -0.62 -0.14 -1.26 -4.29 119.74 116.39 1s66 s LYS 56 Ca 0.11 0.91 0.29 0.00 -1.36 0.00 0.00 55.97 55.92 1s66 s LYS 56 Cb -0.11 -2.02 1.16 0.00 -1.68 0.00 0.00 37.83 35.18 1s66 s LYS 56 CO 0.01 -0.91 1.92 0.07 -0.76 0.00 0.00 175.35 175.68 1s66 h ARG 57 N -0.49 0.00 -0.25 1.68 0.11 -1.93 -2.71 114.38 110.78 1s66 h ARG 57 Ca -0.44 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.52 1s66 h ARG 57 Cb 1.20 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.27 1s66 h ARG 57 CO 0.58 0.11 -0.33 0.93 0.10 0.00 0.00 179.97 181.37 1s66 h GLU 58 N 0.00 0.54 0.00 0.08 3.07 -1.93 -2.68 114.58 113.65 1s66 h GLU 58 Ca -0.00 -0.24 -0.04 0.00 -0.50 0.00 0.00 59.36 58.58 1s66 h GLU 58 Cb 0.61 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.50 1s66 h GLU 58 CO 0.01 0.80 -0.20 0.93 -1.40 0.00 0.00 179.01 179.15 1s66 h GLU 59 N 0.46 0.00 0.00 2.33 5.08 -1.87 -3.35 114.58 117.23 1s66 h GLU 59 Ca 0.05 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.05 1s66 h GLU 59 Cb 0.79 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.98 1s66 h GLU 59 CO 0.06 0.20 -2.36 0.28 -1.00 0.00 0.00 179.01 176.20 1s66 n VAL 60 N -3.27 1.36 -2.21 3.13 0.31 -1.18 -4.84 118.33 111.62 1s66 n VAL 60 Ca 0.01 -0.73 -0.42 0.00 -0.01 0.00 0.00 64.34 63.19 1s66 n VAL 60 Cb 0.48 -0.77 -0.03 0.00 -0.91 0.00 0.00 33.84 32.60 1s66 n VAL 60 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1s66 s ILE 61 N -2.48 3.53 0.00 2.52 -1.09 -1.02 -2.89 121.20 119.78 1s66 s ILE 61 Ca -0.17 1.05 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1s66 s ILE 61 Cb 0.07 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.28 1s66 s ILE 61 CO 0.72 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 175.09 1s66 n GLY 62 N 3.52 3.03 3.90 6.18 0.00 -0.96 -5.00 105.19 115.87 1s66 n GLY 62 Ca 0.12 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 1s66 n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1s66 s ASN 63 N 0.54 4.46 0.86 1.61 0.01 -1.14 -4.71 114.94 116.57 1s66 s ASN 63 Ca 0.00 0.72 -0.11 0.00 -0.71 0.00 0.00 52.86 52.75 1s66 s ASN 63 Cb 0.00 -1.20 0.11 0.00 0.41 0.00 0.00 41.25 40.56 1s66 s ASN 63 CO 0.00 -1.92 1.09 0.21 -1.51 0.00 0.00 177.10 174.97 1s66 s ASN 64 N -4.59 3.86 0.47 -1.22 2.47 -1.26 -2.26 114.94 112.40 1s66 s ASN 64 Ca 0.62 1.43 0.31 0.00 0.42 0.00 0.00 52.86 55.64 1s66 s ASN 64 Cb -0.11 -2.13 1.21 0.00 -1.45 0.00 0.00 41.25 38.77 1s66 s ASN 64 CO 0.49 -2.39 1.90 -0.29 -3.72 0.00 0.00 177.10 173.09 1s66 h ILE 65 N -1.37 0.00 -0.94 -5.21 2.10 -1.41 -3.33 117.51 107.35 1s66 h ILE 65 Ca -0.48 -0.47 0.28 0.00 1.08 0.00 0.00 64.86 65.27 1s66 h ILE 65 Cb 1.28 1.41 -0.15 0.00 -1.09 0.00 0.00 36.82 38.26 1s66 h ILE 65 CO 0.56 0.00 0.32 0.44 -1.08 0.00 0.00 178.15 178.40 1s66 h ASP 66 N 0.00 0.10 -0.46 2.19 3.45 -1.92 -1.63 116.42 118.15 1s66 h ASP 66 Ca 0.00 0.22 -0.05 0.00 0.43 0.00 0.00 57.03 57.63 1s66 h ASP 66 Cb 0.51 0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 39.52 1s66 h ASP 66 CO 0.00 -0.21 0.12 0.00 -1.57 0.00 0.00 179.24 177.58 1s66 h MET 67 N 0.18 0.79 0.00 3.56 -0.00 -1.98 -2.48 114.93 115.00 1s66 h MET 67 Ca 0.64 -0.16 0.00 0.00 -0.00 0.00 0.00 59.70 60.18 1s66 h MET 67 Cb 1.41 -0.12 0.00 0.00 -0.00 0.00 0.00 31.60 32.89 1s66 h MET 67 CO -0.70 0.72 0.00 1.28 -0.00 0.00 0.00 176.91 178.21 1s66 n LEU 68 N -4.28 0.70 -4.79 -0.10 4.77 -0.62 -4.74 117.00 107.94 1s66 n LEU 68 Ca 0.04 0.60 -0.39 0.00 -0.03 0.00 0.00 56.01 56.23 1s66 n LEU 68 Cb 0.22 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 1s66 n LEU 68 CO 0.40 -0.30 0.39 -0.63 -1.33 0.00 0.00 177.39 175.92 1s66 s ILE 69 N -3.16 4.54 0.58 -0.08 -1.09 -0.94 -4.74 121.20 116.30 1s66 s ILE 69 Ca 0.09 1.50 -0.19 0.00 -2.23 0.00 0.00 60.65 59.82 1s66 s ILE 69 Cb 0.12 -4.04 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 1s66 s ILE 69 CO 0.52 0.53 0.96 -2.65 -1.23 0.00 0.00 174.94 173.07 1s66 n PRO 70 N 1.72 0.95 0.17 2.79 -0.02 -1.26 -4.80 135.00 134.55 1s66 n PRO 70 Ca -0.07 0.37 0.03 0.00 -2.02 0.00 0.00 63.50 61.80 1s66 n PRO 70 Cb 0.50 -2.15 0.39 0.00 -0.02 0.00 0.00 33.50 32.22 1s66 n PRO 70 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s66 h ARG 71 N 0.61 0.07 0.00 -0.52 3.08 -1.93 -1.85 114.38 113.84 1s66 h ARG 71 Ca -0.48 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1s66 h ARG 71 Cb 1.36 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1s66 h ARG 71 CO 0.51 0.34 0.00 0.38 -1.07 0.00 0.00 179.97 180.14 1s66 h ASP 72 N 0.06 0.00 -0.33 7.04 -0.00 -2.02 -3.12 116.42 118.05 1s66 h ASP 72 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.04 1s66 h ASP 72 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.85 1s66 h ASP 72 CO 0.04 0.00 0.00 -0.11 -0.00 0.00 0.00 179.24 179.17 1s66 n LEU 73 N -2.88 2.98 -0.00 0.15 7.94 -0.79 -4.72 117.00 119.67 1s66 n LEU 73 Ca 0.03 -1.66 -0.10 0.00 -1.11 0.00 0.00 56.01 53.16 1s66 n LEU 73 Cb 0.40 -0.22 -0.05 0.00 0.53 0.00 0.00 43.42 44.08 1s66 n LEU 73 CO 0.29 0.69 0.88 -0.09 -1.11 0.00 0.00 177.39 178.05 1s66 h ARG 74 N 2.96 0.07 -0.43 1.96 9.65 -1.30 -2.71 114.38 124.59 1s66 h ARG 74 Ca 0.00 -0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.79 1s66 h ARG 74 Cb 0.77 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.32 1s66 h ARG 74 CO 0.00 0.05 -0.07 -1.35 2.80 0.00 0.00 179.97 181.40 1s66 h PRO 75 N 0.07 0.73 0.00 0.20 0.11 -1.84 -3.32 132.00 127.95 1s66 h PRO 75 Ca 0.05 -0.22 -0.21 0.00 0.11 0.00 0.00 66.00 65.73 1s66 h PRO 75 Cb 0.04 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.04 1s66 h PRO 75 CO -0.06 0.79 -1.18 0.00 -0.21 0.00 0.00 178.00 177.34 1s66 h ALA 76 N 1.25 0.56 -0.51 -0.75 0.00 -1.88 -3.40 119.26 114.53 1s66 h ALA 76 Ca 0.12 -0.99 -0.11 0.00 0.00 0.00 0.00 54.91 53.93 1s66 h ALA 76 Cb 0.52 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1s66 h ALA 76 CO 0.03 1.21 -0.12 1.25 0.00 0.00 0.00 179.25 181.62 1s66 h HIS 77 N 0.00 1.06 -0.20 0.00 6.17 -1.58 -2.98 115.15 117.62 1s66 h HIS 77 Ca -0.11 -0.21 0.06 0.00 0.71 0.00 0.00 60.37 60.82 1s66 h HIS 77 Cb 1.76 -0.26 -0.01 0.00 2.52 0.00 0.00 27.41 31.42 1s66 h HIS 77 CO 0.00 1.00 0.15 -1.35 0.71 0.00 0.00 177.93 178.44 1s66 h PRO 78 N 0.85 0.00 0.00 5.26 0.11 -1.77 -2.19 132.00 134.25 1s66 h PRO 78 Ca 0.13 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.07 1s66 h PRO 78 Cb 0.66 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1s66 h PRO 78 CO 0.05 0.00 -0.82 1.49 -0.21 0.00 0.00 178.00 178.50 1s66 h GLU 79 N 0.00 0.02 -0.13 1.05 4.57 -1.79 -2.80 114.58 115.50 1s66 h GLU 79 Ca 0.10 -0.03 -0.13 0.00 -1.18 0.00 0.00 59.36 58.12 1s66 h GLU 79 Cb 0.40 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 1s66 h GLU 79 CO -0.00 0.83 -0.47 1.88 -1.18 0.00 0.00 179.01 180.07 1s66 h TYR 80 N 0.01 0.41 -0.11 0.92 0.05 -1.44 -2.19 116.97 114.63 1s66 h TYR 80 Ca -0.01 -0.13 -0.20 0.00 0.05 0.00 0.00 58.73 58.44 1s66 h TYR 80 Cb 1.45 -0.08 0.01 0.00 1.01 0.00 0.00 36.73 39.11 1s66 h TYR 80 CO 0.00 0.75 -0.71 0.82 -1.05 0.00 0.00 178.16 177.97 1s66 h ILE 81 N 0.27 1.32 -0.27 -2.88 2.04 -1.54 -3.00 117.51 113.45 1s66 h ILE 81 Ca 0.02 -1.97 -0.06 0.00 1.00 0.00 0.00 64.86 63.85 1s66 h ILE 81 Cb 0.94 2.15 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 1s66 h ILE 81 CO 0.08 0.61 -0.07 -0.09 0.00 0.00 0.00 178.15 178.67 1s66 h ARG 82 N 0.34 0.44 -0.07 2.37 2.43 -1.48 -2.52 114.38 115.89 1s66 h ARG 82 Ca -0.06 -0.10 -0.16 0.00 -0.81 0.00 0.00 59.98 58.85 1s66 h ARG 82 Cb 1.36 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1s66 h ARG 82 CO 0.15 0.52 -0.65 1.25 -1.51 0.00 0.00 179.97 179.73 1s66 h HIS 83 N 0.41 0.35 -0.05 2.20 2.76 -1.44 -2.93 115.15 116.46 1s66 h HIS 83 Ca 0.08 -0.14 -0.14 0.00 -2.20 0.00 0.00 60.37 57.97 1s66 h HIS 83 Cb 0.39 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 1s66 h HIS 83 CO 0.01 0.84 -0.59 -0.97 -1.30 0.00 0.00 177.93 175.92 1s66 h ASN 84 N 0.19 0.18 -0.24 3.26 -0.73 -1.33 -2.81 115.58 114.11 1s66 h ASN 84 Ca -0.01 -0.10 -0.16 0.00 1.87 0.00 0.00 56.30 57.90 1s66 h ASN 84 Cb 1.17 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.71 1s66 h ASN 84 CO 0.10 0.73 -0.46 0.03 -0.37 0.00 0.00 177.43 177.46 1s66 h ARG 85 N 0.12 0.73 0.00 6.67 3.08 -1.40 -3.18 114.38 120.40 1s66 h ARG 85 Ca -0.00 -0.47 -0.01 0.00 0.07 0.00 0.00 59.98 59.57 1s66 h ARG 85 Cb 1.07 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 1s66 h ARG 85 CO 0.09 1.10 -0.03 0.93 -1.07 0.00 0.00 179.97 180.98 1s66 h GLU 86 N 0.46 0.00 -0.14 0.04 5.08 -1.55 -3.28 114.58 115.19 1s66 h GLU 86 Ca 0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1s66 h GLU 86 Cb 1.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1s66 h GLU 86 CO 0.10 0.03 -0.06 0.78 -1.00 0.00 0.00 179.01 178.87 1s66 h GLY 87 N 2.80 0.32 0.00 -3.84 0.00 -1.47 -3.48 103.07 97.40 1s66 h GLY 87 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1s66 h GLY 87 CO 0.00 0.25 0.00 0.61 0.00 0.00 0.00 176.54 177.41 1s66 n GLY 88 N -0.04 2.98 3.15 4.60 0.00 -1.24 -5.05 105.19 109.60 1s66 n GLY 88 Ca -0.06 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.49 1s66 n GLY 88 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1s66 n LYS 89 N -0.05 0.00 -0.04 1.61 0.00 -1.26 -4.94 118.16 113.48 1s66 n LYS 89 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.23 1s66 n LYS 89 Cb 0.00 -1.05 -0.07 0.00 -0.00 0.00 0.00 35.03 33.92 1s66 n LYS 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1s66 h ALA 90 N 1.43 -0.05 -2.49 0.58 0.00 -1.96 -3.45 119.26 113.32 1s66 h ALA 90 Ca -0.32 -0.25 -0.53 0.00 0.00 0.00 0.00 54.91 53.82 1s66 h ALA 90 Cb 1.32 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1s66 h ALA 90 CO 0.54 -0.06 0.40 1.03 0.00 0.00 0.00 179.25 181.16 1s66 s ARG 91 N -2.18 4.59 -0.30 0.00 1.81 -1.26 -4.14 118.95 117.47 1s66 s ARG 91 Ca -0.10 1.50 -0.18 0.00 -1.72 0.00 0.00 55.73 55.22 1s66 s ARG 91 Cb -0.01 -3.41 -0.02 0.00 -0.45 0.00 0.00 34.95 31.07 1s66 s ARG 91 CO 0.37 0.02 0.54 0.08 -0.68 0.00 0.00 175.30 175.62 1s66 s VAL 92 N 0.61 5.02 -0.33 3.52 1.01 -1.26 -4.95 120.40 124.02 1s66 s VAL 92 Ca 0.51 0.70 0.23 0.00 0.00 0.00 0.00 61.98 63.42 1s66 s VAL 92 Cb -0.23 -3.91 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 1s66 s VAL 92 CO 0.29 -0.06 0.98 -0.62 0.00 0.00 0.00 175.10 175.69 1s66 n GLU 93 N 5.69 0.51 -1.56 2.72 1.02 -1.26 -4.86 120.64 122.89 1s66 n GLU 93 Ca -0.04 0.04 -0.29 0.00 -0.02 0.00 0.00 57.16 56.85 1s66 n GLU 93 Cb 0.49 -1.71 0.12 0.00 -0.02 0.00 0.00 31.44 30.32 1s66 n GLU 93 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1s66 s GLY 94 N -4.15 1.59 -1.25 0.62 0.00 -1.26 -4.28 107.32 98.59 1s66 s GLY 94 Ca -0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 44.72 44.25 1s66 s GLY 94 CO 0.81 0.08 0.75 1.03 0.00 0.00 0.00 173.10 175.77 1s66 n MET 95 N -3.65 -4.20 -0.02 2.90 2.81 -1.26 -4.77 117.12 108.93 1s66 n MET 95 Ca 0.07 0.64 -0.20 0.00 -1.81 0.00 0.00 57.70 56.39 1s66 n MET 95 Cb 0.58 -5.14 -0.14 0.00 -0.71 0.00 0.00 33.22 27.81 1s66 n MET 95 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1s66 n SER 96 N -3.03 2.03 -5.01 7.83 3.41 -1.26 -4.53 113.62 113.07 1s66 n SER 96 Ca -0.25 0.14 -0.21 0.00 -0.26 0.00 0.00 58.87 58.30 1s66 n SER 96 Cb 0.66 -0.73 0.05 0.00 -0.26 0.00 0.00 64.21 63.93 1s66 n SER 96 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1s66 s ARG 97 N -2.55 2.32 0.39 4.33 1.81 -1.26 -4.84 118.95 119.15 1s66 s ARG 97 Ca -0.24 -1.68 -0.27 0.00 -1.72 0.00 0.00 55.73 51.82 1s66 s ARG 97 Cb 0.07 -2.57 -0.11 0.00 -0.45 0.00 0.00 34.95 31.90 1s66 s ARG 97 CO 0.74 -0.79 1.36 0.39 -0.68 0.00 0.00 175.30 176.32 1s66 n GLU 98 N -2.15 2.25 -4.06 3.54 4.71 -1.26 -4.69 120.64 118.98 1s66 n GLU 98 Ca 0.13 0.79 -0.13 0.00 -0.01 0.00 0.00 57.16 57.94 1s66 n GLU 98 Cb 0.62 -2.49 -0.11 0.00 -1.01 0.00 0.00 31.44 28.45 1s66 n GLU 98 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1s66 s LEU 99 N -1.76 2.26 -0.54 -4.62 1.43 -1.15 -4.99 118.68 109.31 1s66 s LEU 99 Ca 0.57 -0.56 -0.22 0.00 -1.03 0.00 0.00 54.13 52.89 1s66 s LEU 99 Cb -0.51 -0.17 0.05 0.00 0.03 0.00 0.00 46.19 45.59 1s66 s LEU 99 CO 0.61 -0.21 0.82 -1.58 0.23 0.00 0.00 176.35 176.23 1s66 s GLN 100 N -1.61 3.25 0.28 1.70 0.74 -1.26 -2.40 119.66 120.36 1s66 s GLN 100 Ca -0.10 -0.51 -0.29 0.00 0.05 0.00 0.00 55.36 54.52 1s66 s GLN 100 Cb -0.10 -4.07 -0.09 0.00 1.10 0.00 0.00 33.01 29.85 1s66 s GLN 100 CO 0.00 -1.39 1.02 -1.17 -0.55 0.00 0.00 175.29 173.20 1s66 s LEU 101 N 3.45 4.53 -0.18 3.68 0.20 -0.83 -4.81 118.68 124.73 1s66 s LEU 101 Ca 0.24 2.09 -0.03 0.00 0.69 0.00 0.00 54.13 57.12 1s66 s LEU 101 Cb -0.15 -3.70 -0.02 0.00 -0.43 0.00 0.00 46.19 41.89 1s66 s LEU 101 CO 0.16 -0.05 -0.06 -0.70 -0.29 0.00 0.00 176.35 175.41 1s66 s GLU 102 N -1.49 3.47 0.95 1.98 2.12 -1.26 -2.66 118.70 121.81 1s66 s GLU 102 Ca 0.45 -0.60 -0.15 0.00 0.36 0.00 0.00 54.97 55.02 1s66 s GLU 102 Cb -0.28 -2.91 0.22 0.00 0.26 0.00 0.00 34.13 31.42 1s66 s GLU 102 CO 0.35 0.02 1.29 1.63 -0.54 0.00 0.00 175.26 178.01 1s66 n LYS 103 N 4.16 -1.20 -0.13 4.30 5.02 -0.97 -4.82 118.16 124.53 1s66 n LYS 103 Ca -0.18 -2.09 -0.11 0.00 -2.02 0.00 0.00 58.31 53.91 1s66 n LYS 103 Cb 0.52 -1.30 -0.02 0.00 -0.02 0.00 0.00 35.03 34.20 1s66 n LYS 103 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1s66 h LYS 104 N 0.00 0.70 0.00 1.97 3.64 -1.61 -3.14 116.57 118.13 1s66 h LYS 104 Ca -0.42 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.70 1s66 h LYS 104 Cb 1.18 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1s66 h LYS 104 CO 0.30 0.85 0.00 -0.40 -2.27 0.00 0.00 179.45 177.94 1s66 n ASP 105 N -4.39 0.00 0.00 4.20 5.75 -1.26 -4.89 116.55 115.95 1s66 n ASP 105 Ca -0.02 0.33 0.00 0.00 -0.01 0.00 0.00 54.79 55.09 1s66 n ASP 105 Cb 0.34 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1s66 n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s66 n GLY 106 N 0.46 2.29 3.65 6.12 0.00 -1.19 -5.08 105.19 111.43 1s66 n GLY 106 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1s66 n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1s66 s SER 107 N -1.48 2.49 -0.02 1.61 1.04 -1.26 -4.77 113.70 111.31 1s66 s SER 107 Ca 0.00 1.38 0.02 0.00 0.48 0.00 0.00 55.95 57.83 1s66 s SER 107 Cb 0.00 -2.06 0.01 0.00 0.10 0.00 0.00 66.02 64.06 1s66 s SER 107 CO 0.00 -3.24 -0.06 -0.54 0.98 0.00 0.00 173.24 170.38 1s66 s LYS 108 N -4.83 0.65 0.16 4.02 1.02 -1.26 -2.29 119.74 117.20 1s66 s LYS 108 Ca 0.66 -0.17 0.08 0.00 0.02 0.00 0.00 55.97 56.56 1s66 s LYS 108 Cb -0.20 -0.65 -0.04 0.00 -0.52 0.00 0.00 37.83 36.42 1s66 s LYS 108 CO 0.59 0.04 -0.18 0.96 -0.92 0.00 0.00 175.35 175.85 1s66 s ILE 109 N 0.33 1.77 0.11 2.17 -4.36 -1.09 -5.02 121.20 115.11 1s66 s ILE 109 Ca -0.04 -1.92 -0.11 0.00 -0.26 0.00 0.00 60.65 58.32 1s66 s ILE 109 Cb -0.08 -1.83 -0.06 0.00 1.25 0.00 0.00 42.46 41.74 1s66 s ILE 109 CO -0.00 -0.35 0.46 0.26 0.24 0.00 0.00 174.94 175.55 1s66 s TRP 110 N -2.12 3.58 0.35 1.37 0.52 -1.26 -1.96 118.94 119.42 1s66 s TRP 110 Ca 0.16 0.88 0.02 0.00 0.02 0.00 0.00 56.10 57.17 1s66 s TRP 110 Cb -0.05 -2.23 -0.01 0.00 -1.15 0.00 0.00 33.47 30.03 1s66 s TRP 110 CO 0.06 0.48 0.41 0.95 0.02 0.00 0.00 176.95 178.87 1s66 s THR 111 N -1.44 0.00 -0.04 2.01 -4.23 -1.01 -2.09 115.64 108.84 1s66 s THR 111 Ca 0.35 -1.74 -0.01 0.00 -1.18 0.00 0.00 61.69 59.11 1s66 s THR 111 Cb -0.14 -2.62 0.03 0.00 1.34 0.00 0.00 72.50 71.11 1s66 s THR 111 CO 0.19 0.00 0.04 -0.60 -0.54 0.00 0.00 174.62 173.71 1s66 s ARG 112 N -3.11 0.09 -0.06 3.99 6.06 -1.02 -2.95 118.95 121.95 1s66 s ARG 112 Ca 0.34 0.27 -0.03 0.00 -2.50 0.00 0.00 55.73 53.82 1s66 s ARG 112 Cb 0.00 -0.55 -0.04 0.00 0.06 0.00 0.00 34.95 34.43 1s66 s ARG 112 CO 0.24 -0.28 0.07 -0.06 -2.50 0.00 0.00 175.30 172.77 1s66 s PHE 113 N 1.85 3.33 -0.55 5.12 0.08 -1.26 -2.79 117.98 123.76 1s66 s PHE 113 Ca 0.01 0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.39 1s66 s PHE 113 Cb -0.12 -1.81 0.15 0.00 -0.57 0.00 0.00 43.02 40.67 1s66 s PHE 113 CO -0.03 0.58 0.36 0.00 -0.10 0.00 0.00 175.22 176.03 1s66 s ALA 114 N -1.06 2.85 0.25 5.36 0.00 -0.70 -4.67 121.76 123.79 1s66 s ALA 114 Ca 0.18 -3.17 -0.26 0.00 0.00 0.00 0.00 51.96 48.71 1s66 s ALA 114 Cb -0.12 -1.99 -0.09 0.00 0.00 0.00 0.00 23.12 20.93 1s66 s ALA 114 CO 0.08 -2.05 0.87 -1.17 0.00 0.00 0.00 175.76 173.48 1s66 s LEU 115 N -0.53 4.48 -0.07 0.00 2.96 -1.26 -3.39 118.68 120.87 1s66 s LEU 115 Ca 0.23 1.75 -0.03 0.00 -0.22 0.00 0.00 54.13 55.86 1s66 s LEU 115 Cb -0.11 -3.67 0.04 0.00 0.50 0.00 0.00 46.19 42.95 1s66 s LEU 115 CO -0.10 0.07 0.16 -0.44 -1.32 0.00 0.00 176.35 174.72 1s66 s SER 116 N -1.40 0.02 0.12 3.68 0.01 -1.03 -4.53 113.70 110.57 1s66 s SER 116 Ca 0.43 0.34 -0.30 0.00 1.31 0.00 0.00 55.95 57.73 1s66 s SER 116 Cb -0.21 0.24 -0.06 0.00 0.21 0.00 0.00 66.02 66.19 1s66 s SER 116 CO 0.26 -0.17 1.04 -0.75 0.41 0.00 0.00 173.24 174.04 1s66 s LYS 117 N 1.39 4.62 -0.29 12.44 2.20 -1.26 -2.13 119.74 136.70 1s66 s LYS 117 Ca -0.07 1.59 0.00 0.00 -0.36 0.00 0.00 55.97 57.13 1s66 s LYS 117 Cb -0.12 -3.34 0.09 0.00 -1.51 0.00 0.00 37.83 32.95 1s66 s LYS 117 CO -0.06 0.09 0.06 0.08 -0.36 0.00 0.00 175.35 175.15 1s66 s VAL 118 N 0.09 1.21 -0.74 4.02 1.01 -1.10 -4.99 120.40 119.90 1s66 s VAL 118 Ca 0.50 -1.47 -0.26 0.00 0.00 0.00 0.00 61.98 60.74 1s66 s VAL 118 Cb -0.26 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.30 1s66 s VAL 118 CO 0.32 -0.53 1.63 -0.55 0.00 0.00 0.00 175.10 175.96 1s66 s SER 119 N 1.47 5.69 -0.03 3.32 0.15 -1.26 -2.13 113.70 120.91 1s66 s SER 119 Ca 0.07 -0.25 0.01 0.00 0.70 0.00 0.00 55.95 56.48 1s66 s SER 119 Cb -0.18 -2.55 0.02 0.00 -1.71 0.00 0.00 66.02 61.60 1s66 s SER 119 CO -0.18 -2.15 -0.03 0.00 1.20 0.00 0.00 173.24 172.08 1s66 s ALA 120 N 7.64 0.49 -1.26 5.45 0.00 -1.05 -4.85 121.76 128.18 1s66 s ALA 120 Ca 0.54 -0.03 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 1s66 s ALA 120 Cb -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1s66 s ALA 120 CO 0.13 0.01 0.01 0.39 0.00 0.00 0.00 175.76 176.29 1s66 n GLU 121 N 3.74 -1.20 -1.69 0.00 1.02 -1.26 -2.65 120.64 118.60 1s66 n GLU 121 Ca -0.22 0.71 -0.10 0.00 -0.02 0.00 0.00 57.16 57.53 1s66 n GLU 121 Cb 0.53 -5.03 -0.02 0.00 -0.02 0.00 0.00 31.44 26.89 1s66 n GLU 121 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s66 n GLY 122 N -1.02 0.60 3.31 0.62 0.00 -1.26 -5.01 105.19 102.44 1s66 n GLY 122 Ca -0.17 -0.55 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 1s66 n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s66 s LYS 123 N -3.57 1.63 -0.15 1.61 1.02 -1.08 -5.16 119.74 114.04 1s66 s LYS 123 Ca 0.00 -1.84 -0.05 0.00 0.02 0.00 0.00 55.97 54.10 1s66 s LYS 123 Cb 0.00 0.34 -0.04 0.00 -0.52 0.00 0.00 37.83 37.61 1s66 s LYS 123 CO 0.00 -0.61 0.03 0.08 -0.92 0.00 0.00 175.35 173.93 1s66 s VAL 124 N -3.58 4.49 0.45 3.17 1.01 -1.26 -2.51 120.40 122.17 1s66 s VAL 124 Ca 0.38 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.23 1s66 s VAL 124 Cb 0.03 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1s66 s VAL 124 CO 0.22 0.51 0.06 -0.31 0.00 0.00 0.00 175.10 175.57 1s66 s TYR 125 N 0.05 1.88 -0.17 5.22 1.51 -0.90 -3.06 117.35 121.87 1s66 s TYR 125 Ca 0.04 -1.08 -0.05 0.00 -1.01 0.00 0.00 57.07 54.97 1s66 s TYR 125 Cb -0.13 -1.42 0.08 0.00 -0.11 0.00 0.00 41.96 40.39 1s66 s TYR 125 CO 0.01 0.01 0.33 0.71 -1.11 0.00 0.00 175.55 175.51 1s66 s TYR 126 N -3.02 -0.60 -0.26 2.71 1.51 -1.07 -2.73 117.35 113.90 1s66 s TYR 126 Ca 0.16 1.13 -0.08 0.00 -1.01 0.00 0.00 57.07 57.27 1s66 s TYR 126 Cb 0.03 0.08 -0.03 0.00 -0.11 0.00 0.00 41.96 41.93 1s66 s TYR 126 CO 0.09 -0.45 0.09 -1.17 -1.11 0.00 0.00 175.55 173.00 1s66 s LEU 127 N 2.50 3.58 -0.44 -1.29 2.96 -0.91 -2.19 118.68 122.90 1s66 s LEU 127 Ca 0.02 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.61 1s66 s LEU 127 Cb -0.13 -1.96 0.08 0.00 0.50 0.00 0.00 46.19 44.69 1s66 s LEU 127 CO -0.11 -0.05 0.30 0.00 -1.32 0.00 0.00 176.35 175.17 1s66 s ALA 128 N 1.63 3.36 -0.27 5.97 0.00 -1.14 -2.47 121.76 128.85 1s66 s ALA 128 Ca 0.06 -2.21 -0.23 0.00 0.00 0.00 0.00 51.96 49.59 1s66 s ALA 128 Cb -0.15 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.19 1s66 s ALA 128 CO 0.05 -1.71 0.74 -0.51 0.00 0.00 0.00 175.76 174.33 1s66 s LEU 129 N 1.46 4.08 0.14 0.00 1.43 -1.22 -3.03 118.68 121.54 1s66 s LEU 129 Ca 0.04 0.79 0.11 0.00 -1.03 0.00 0.00 54.13 54.03 1s66 s LEU 129 Cb -0.24 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 1s66 s LEU 129 CO 0.02 -0.50 -0.25 -0.69 0.23 0.00 0.00 176.35 175.17 1s66 s VAL 130 N 2.76 2.39 0.20 -1.59 1.01 -0.96 -1.72 120.40 122.48 1s66 s VAL 130 Ca 0.31 -1.77 -0.07 0.00 0.00 0.00 0.00 61.98 60.45 1s66 s VAL 130 Cb -0.15 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 1s66 s VAL 130 CO 0.09 0.05 0.27 0.00 0.00 0.00 0.00 175.10 175.51 1s66 s ARG 131 N -2.21 1.26 -0.28 2.72 1.70 -1.12 -1.54 118.95 119.48 1s66 s ARG 131 Ca 0.16 -1.37 -0.23 0.00 -0.47 0.00 0.00 55.73 53.82 1s66 s ARG 131 Cb -0.10 0.36 -0.01 0.00 -0.57 0.00 0.00 34.95 34.63 1s66 s ARG 131 CO 0.08 -0.46 0.76 0.34 -1.08 0.00 0.00 175.30 174.93 1s66 s ASP 132 N -3.05 6.68 -0.49 -2.89 3.68 -1.26 -2.43 116.67 116.91 1s66 s ASP 132 Ca 0.27 0.75 0.02 0.00 2.13 0.00 0.00 52.55 55.72 1s66 s ASP 132 Cb 0.04 -2.40 0.45 0.00 -1.45 0.00 0.00 42.92 39.56 1s66 s ASP 132 CO 0.07 -0.53 1.61 0.00 0.13 0.00 0.00 175.17 176.45 1s66 n ALA 133 N 6.04 5.69 1.58 3.66 0.00 -0.89 -4.93 120.51 131.66 1s66 n ALA 133 Ca 0.03 -3.66 0.13 0.00 0.00 0.00 0.00 53.44 49.93 1s66 n ALA 133 Cb 0.48 -1.06 0.75 0.00 0.00 0.00 0.00 19.45 19.62 1s66 n ALA 133 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93