#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a33 s LYS 10 N 0.00 4.32 0.29 3.69 2.20 -1.26 -5.05 119.74 123.92 2a33 s LYS 10 Ca 0.00 0.43 -0.30 0.00 -0.36 0.00 0.00 55.97 55.74 2a33 s LYS 10 Cb 0.00 -3.42 -0.12 0.00 -1.51 0.00 0.00 37.83 32.77 2a33 s LYS 10 CO 0.00 0.19 1.45 0.45 -0.36 0.00 0.00 175.35 177.08 2a33 n SER 11 N 3.56 3.20 0.00 1.43 2.88 -1.26 -4.90 113.62 118.52 2a33 n SER 11 Ca -0.08 1.16 0.13 0.00 -1.33 0.00 0.00 58.87 58.76 2a33 n SER 11 Cb 0.52 -1.51 0.76 0.00 -0.75 0.00 0.00 64.21 63.23 2a33 n SER 11 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2a33 n LYS 12 N 1.64 0.75 -4.25 -1.46 2.85 -1.26 -4.80 118.16 111.63 2a33 n LYS 12 Ca 0.08 0.01 -0.34 0.00 -1.05 0.00 0.00 58.31 57.01 2a33 n LYS 12 Cb 0.35 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 33.11 2a33 n LYS 12 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2a33 s PHE 13 N -2.10 3.06 -0.07 5.58 0.08 -1.26 -4.98 117.98 118.29 2a33 s PHE 13 Ca 0.37 -0.29 -0.10 0.00 0.12 0.00 0.00 56.93 57.04 2a33 s PHE 13 Cb 0.18 -2.01 -0.29 0.00 -0.57 0.00 0.00 43.02 40.32 2a33 s PHE 13 CO 0.32 -0.06 0.58 0.00 -0.10 0.00 0.00 175.22 175.96 2a33 h ARG 14 N 6.93 0.36 -4.09 0.44 3.08 -1.90 -3.43 114.38 115.76 2a33 h ARG 14 Ca -0.33 -0.61 -0.29 0.00 0.07 0.00 0.00 59.98 58.82 2a33 h ARG 14 Cb 1.18 0.23 -0.28 0.00 0.08 0.00 0.00 29.97 31.18 2a33 h ARG 14 CO 0.63 1.29 -0.74 1.03 -1.07 0.00 0.00 179.97 181.11 2a33 s ARG 15 N -2.57 0.27 -0.07 0.04 0.52 -1.26 -0.80 118.95 115.07 2a33 s ARG 15 Ca -0.18 -0.12 0.04 0.00 -0.52 0.00 0.00 55.73 54.95 2a33 s ARG 15 Cb 0.06 -0.26 -0.02 0.00 0.52 0.00 0.00 34.95 35.25 2a33 s ARG 15 CO 0.83 0.07 -0.18 0.42 0.02 0.00 0.00 175.30 176.46 2a33 s ILE 16 N -0.09 2.70 -0.19 1.52 1.01 -0.44 -0.66 121.20 125.06 2a33 s ILE 16 Ca 0.01 -0.83 -0.16 0.00 0.00 0.00 0.00 60.65 59.67 2a33 s ILE 16 Cb -0.01 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 2a33 s ILE 16 CO -0.00 0.57 0.40 0.00 0.00 0.00 0.00 174.94 175.91 2a33 s VAL 18 N 1.14 3.41 -0.18 0.00 1.01 -0.35 -0.77 120.40 124.66 2a33 s VAL 18 Ca 0.20 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 61.56 2a33 s VAL 18 Cb -0.15 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 2a33 s VAL 18 CO 0.08 0.44 0.24 -0.36 0.00 0.00 0.00 175.10 175.49 2a33 s PHE 19 N 1.26 3.44 0.17 5.22 0.08 -0.06 -4.37 117.98 123.72 2a33 s PHE 19 Ca 0.03 0.49 -0.23 0.00 0.12 0.00 0.00 56.93 57.35 2a33 s PHE 19 Cb -0.14 -2.28 0.06 0.00 -0.57 0.00 0.00 43.02 40.09 2a33 s PHE 19 CO -0.02 0.24 0.66 0.00 -0.10 0.00 0.00 175.22 176.01 2a33 n GLY 21 N -0.39 0.56 0.12 0.00 0.00 -0.48 -4.81 105.19 100.19 2a33 n GLY 21 Ca -0.13 0.36 0.13 0.00 0.00 0.00 0.00 46.02 46.38 2a33 n GLY 21 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a33 h SER 22 N 2.91 0.00 -3.67 1.61 4.64 -1.92 -1.94 113.55 115.19 2a33 h SER 22 Ca -0.45 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.37 2a33 h SER 22 Cb 1.29 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.39 2a33 h SER 22 CO 0.66 0.00 0.12 -0.44 -0.87 0.00 0.00 176.83 176.30 2a33 s SER 23 N -4.54 6.41 0.30 4.97 0.01 -1.26 -2.94 113.70 116.65 2a33 s SER 23 Ca 0.09 1.06 0.16 0.00 1.31 0.00 0.00 55.95 58.57 2a33 s SER 23 Cb 0.11 -2.30 0.10 0.00 0.21 0.00 0.00 66.02 64.15 2a33 s SER 23 CO 0.55 -0.48 1.45 1.56 0.41 0.00 0.00 173.24 176.73 2a33 h GLN 24 N 0.83 0.00 0.00 12.44 4.20 -1.87 -2.71 115.11 127.99 2a33 h GLN 24 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2a33 h GLN 24 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2a33 h GLN 24 CO 0.63 0.41 0.00 0.41 -0.67 0.00 0.00 178.83 179.61 2a33 n GLY 25 N 1.21 -2.21 0.12 3.46 0.00 -1.26 -4.49 105.19 102.01 2a33 n GLY 25 Ca 0.02 -1.48 -0.00 0.00 0.00 0.00 0.00 46.02 44.55 2a33 n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a33 h LYS 26 N 0.00 0.00 -5.63 1.61 1.57 -2.03 -3.46 116.57 108.63 2a33 h LYS 26 Ca 0.00 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.12 2a33 h LYS 26 Cb 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.21 2a33 h LYS 26 CO 0.00 0.60 -0.52 0.15 -0.57 0.00 0.00 179.45 179.12 2a33 s LYS 27 N -2.89 3.49 0.56 3.15 1.02 -1.26 -4.97 119.74 118.84 2a33 s LYS 27 Ca 0.03 -0.21 0.33 0.00 0.02 0.00 0.00 55.97 56.13 2a33 s LYS 27 Cb 0.08 -3.14 1.66 0.00 -0.52 0.00 0.00 37.83 35.91 2a33 s LYS 27 CO 0.77 0.66 2.12 0.66 -0.92 0.00 0.00 175.35 178.65 2a33 h SER 28 N 5.36 0.00 -0.76 2.83 4.64 -1.94 -1.67 113.55 122.01 2a33 h SER 28 Ca -0.51 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 60.94 2a33 h SER 28 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 2a33 h SER 28 CO 0.60 0.06 0.50 0.77 -0.87 0.00 0.00 176.83 177.90 2a33 h SER 29 N 0.00 0.49 -0.30 4.97 4.64 -1.98 -0.62 113.55 120.75 2a33 h SER 29 Ca -0.00 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2a33 h SER 29 Cb 0.30 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2a33 h SER 29 CO 0.01 0.27 0.13 1.88 -0.87 0.00 0.00 176.83 178.25 2a33 h TYR 30 N 0.53 0.44 -0.36 4.77 0.05 -1.63 -1.14 116.97 119.62 2a33 h TYR 30 Ca 0.37 -0.03 -0.12 0.00 0.05 0.00 0.00 58.73 59.00 2a33 h TYR 30 Cb 0.69 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 2a33 h TYR 30 CO -0.00 0.41 -0.24 1.96 -1.05 0.00 0.00 178.16 179.23 2a33 h GLN 31 N 0.34 0.81 -0.77 4.88 7.50 -1.43 -2.15 115.11 124.28 2a33 h GLN 31 Ca 0.10 -0.38 0.10 0.00 0.50 0.00 0.00 58.65 58.97 2a33 h GLN 31 Cb 0.14 -0.01 -0.07 0.00 0.05 0.00 0.00 27.48 27.59 2a33 h GLN 31 CO -0.01 1.01 0.41 -0.44 -1.50 0.00 0.00 178.83 178.30 2a33 h ASP 32 N 0.60 0.55 -0.44 1.46 3.32 -1.06 -2.10 116.42 118.75 2a33 h ASP 32 Ca 0.07 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 2a33 h ASP 32 Cb 0.81 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 2a33 h ASP 32 CO 0.07 0.31 -0.10 0.00 -1.72 0.00 0.00 179.24 177.79 2a33 h ALA 33 N 1.45 0.89 -0.39 3.45 0.00 -0.94 0.14 119.26 123.87 2a33 h ALA 33 Ca 0.38 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2a33 h ALA 33 Cb 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2a33 h ALA 33 CO -0.27 0.64 0.03 0.00 0.00 0.00 0.00 179.25 179.64 2a33 h ALA 34 N 1.07 0.52 -0.45 0.00 0.00 -0.87 0.24 119.26 119.77 2a33 h ALA 34 Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2a33 h ALA 34 Cb 0.62 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2a33 h ALA 34 CO 0.04 0.27 0.22 0.28 0.00 0.00 0.00 179.25 180.06 2a33 h VAL 35 N 0.51 1.18 -0.82 0.00 2.07 -1.23 -2.32 116.25 115.65 2a33 h VAL 35 Ca 0.11 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 2a33 h VAL 35 Cb 0.43 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2a33 h VAL 35 CO 0.01 0.20 0.50 0.44 0.02 0.00 0.00 177.57 178.75 2a33 h ASP 36 N 0.59 0.97 -0.40 0.57 3.32 -0.56 -0.64 116.42 120.27 2a33 h ASP 36 Ca 0.16 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 2a33 h ASP 36 Cb 0.12 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2a33 h ASP 36 CO -0.02 0.74 0.06 0.25 -1.72 0.00 0.00 179.24 178.55 2a33 h LEU 37 N 1.12 0.64 -0.29 1.55 5.85 -0.85 0.71 115.31 124.04 2a33 h LEU 37 Ca 0.29 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.78 2a33 h LEU 37 Cb -0.06 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 2a33 h LEU 37 CO -0.06 0.74 0.12 1.23 -0.34 0.00 0.00 178.44 180.13 2a33 h GLY 38 N 0.51 0.37 1.79 3.75 0.00 -0.79 -0.80 103.07 107.90 2a33 h GLY 38 Ca 0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.32 2a33 h GLY 38 CO 0.01 0.05 -0.14 3.43 0.00 0.00 0.00 176.54 179.89 2a33 h ASN 39 N 0.26 0.25 -0.38 0.19 2.35 -0.98 -1.50 115.58 115.77 2a33 h ASN 39 Ca 0.13 -0.05 -0.12 0.00 -0.55 0.00 0.00 56.30 55.70 2a33 h ASN 39 Cb 0.08 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2a33 h ASN 39 CO -0.12 0.41 -0.24 -0.08 -1.65 0.00 0.00 177.43 175.75 2a33 h GLU 40 N 0.25 0.83 -0.03 0.81 4.57 -0.20 -0.95 114.58 119.86 2a33 h GLU 40 Ca 0.05 -0.39 -0.00 0.00 -1.18 0.00 0.00 59.36 57.84 2a33 h GLU 40 Cb 0.40 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.98 2a33 h GLU 40 CO 0.02 1.03 0.02 -0.07 -1.18 0.00 0.00 179.01 178.83 2a33 h LEU 41 N 0.63 0.04 -0.56 1.64 3.38 -0.94 -2.53 115.31 116.97 2a33 h LEU 41 Ca 0.08 -0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.08 2a33 h LEU 41 Cb 0.81 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 2a33 h LEU 41 CO 0.07 0.10 0.11 0.58 0.09 0.00 0.00 178.44 179.39 2a33 h VAL 42 N -0.02 0.67 0.00 1.22 2.07 -1.20 -0.53 116.25 118.46 2a33 h VAL 42 Ca 0.01 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2a33 h VAL 42 Cb 0.07 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2a33 h VAL 42 CO -0.00 0.05 -0.06 0.77 0.02 0.00 0.00 177.57 178.34 2a33 h SER 43 N 0.25 0.00 -0.50 0.57 4.64 -1.04 -2.02 113.55 115.45 2a33 h SER 43 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2a33 h SER 43 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2a33 h SER 43 CO -0.37 0.06 0.00 0.54 -0.87 0.00 0.00 176.83 176.19 2a33 n ARG 44 N -3.95 2.56 -3.67 4.77 1.74 -0.64 -4.96 116.66 112.51 2a33 n ARG 44 Ca -0.03 -2.38 -0.26 0.00 -0.77 0.00 0.00 57.85 54.42 2a33 n ARG 44 Cb 0.15 -1.51 0.07 0.00 -1.02 0.00 0.00 32.46 30.15 2a33 n ARG 44 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2a33 n ASN 45 N 1.46 -6.00 -4.60 0.55 3.02 -0.74 -4.60 115.26 104.35 2a33 n ASN 45 Ca 0.20 -0.60 -0.34 0.00 -0.03 0.00 0.00 54.58 53.81 2a33 n ASN 45 Cb 0.59 -4.73 -0.10 0.00 -0.61 0.00 0.00 39.78 34.92 2a33 n ASN 45 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2a33 s ILE 46 N -3.31 4.38 0.63 2.41 1.01 -0.30 -4.89 121.20 121.13 2a33 s ILE 46 Ca 0.61 -0.19 -0.07 0.00 0.00 0.00 0.00 60.65 61.00 2a33 s ILE 46 Cb -0.28 -2.92 0.02 0.00 0.01 0.00 0.00 42.46 39.29 2a33 s ILE 46 CO 0.75 0.51 0.95 -1.81 0.00 0.00 0.00 174.94 175.34 2a33 s ASP 47 N 0.04 5.43 -0.13 3.58 1.01 0.02 -4.19 116.67 122.42 2a33 s ASP 47 Ca 0.03 0.72 -0.03 0.00 0.71 0.00 0.00 52.55 53.98 2a33 s ASP 47 Cb -0.13 -1.62 -0.03 0.00 1.01 0.00 0.00 42.92 42.15 2a33 s ASP 47 CO 0.02 -1.20 -0.02 -0.22 0.21 0.00 0.00 175.17 173.95 2a33 s LEU 48 N -5.09 3.37 -0.09 1.23 2.96 -0.92 -1.32 118.68 118.82 2a33 s LEU 48 Ca 0.56 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 2a33 s LEU 48 Cb -0.11 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 2a33 s LEU 48 CO 0.46 0.24 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.95 2a33 s VAL 49 N -0.04 3.54 0.33 1.68 1.01 0.13 -1.10 120.40 125.95 2a33 s VAL 49 Ca 0.02 -0.52 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 2a33 s VAL 49 Cb -0.13 -2.47 0.01 0.00 0.00 0.00 0.00 36.38 33.80 2a33 s VAL 49 CO 0.02 0.57 0.56 -0.72 0.00 0.00 0.00 175.10 175.53 2a33 s TYR 50 N -0.39 0.64 -1.83 5.22 -0.00 -0.46 -1.21 117.35 119.32 2a33 s TYR 50 Ca 0.05 -1.02 0.06 0.00 -0.00 0.00 0.00 57.07 56.17 2a33 s TYR 50 Cb -0.12 0.23 0.19 0.00 -0.00 0.00 0.00 41.96 42.26 2a33 s TYR 50 CO 0.02 -1.22 1.11 0.41 -0.00 0.00 0.00 175.55 175.87 2a33 n GLY 51 N -0.51 0.25 2.19 5.49 0.00 -1.26 -1.03 105.19 110.32 2a33 n GLY 51 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2a33 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a33 n GLY 52 N 0.74 0.86 3.49 -0.02 0.00 -1.26 -4.45 105.19 104.55 2a33 n GLY 52 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 2a33 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a33 n GLY 53 N -2.01 -1.39 0.86 -0.02 0.00 -1.26 -4.93 105.19 96.44 2a33 n GLY 53 Ca 0.00 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.66 2a33 n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2a33 n SER 54 N -0.80 3.03 -4.70 1.61 3.41 -1.26 -4.18 113.62 110.74 2a33 n SER 54 Ca 0.10 -1.89 -0.23 0.00 -0.26 0.00 0.00 58.87 56.59 2a33 n SER 54 Cb 0.50 -0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 2a33 n SER 54 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2a33 s ILE 55 N -1.15 3.44 0.00 -1.33 -4.36 -1.26 -4.28 121.20 112.25 2a33 s ILE 55 Ca 0.29 -1.76 0.00 0.00 -0.26 0.00 0.00 60.65 58.92 2a33 s ILE 55 Cb 0.17 -2.97 0.00 0.00 1.25 0.00 0.00 42.46 40.90 2a33 s ILE 55 CO 0.23 -0.30 0.00 0.61 0.24 0.00 0.00 174.94 175.72 2a33 n GLY 56 N -1.03 0.93 1.81 6.27 0.00 -1.15 -1.54 105.19 110.48 2a33 n GLY 56 Ca -0.05 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2a33 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2a33 n LEU 57 N 0.00 1.95 0.00 0.99 4.77 -0.73 -2.24 117.00 121.74 2a33 n LEU 57 Ca 0.00 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 55.10 2a33 n LEU 57 Cb 0.00 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 2a33 n LEU 57 CO 0.00 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2a33 n GLY 59 N 1.81 0.00 0.07 -0.72 0.00 -0.59 -1.33 105.19 104.42 2a33 n GLY 59 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2a33 n GLY 59 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2a33 h LEU 60 N 0.00 0.07 -0.76 0.99 3.38 -1.72 -1.66 115.31 115.62 2a33 h LEU 60 Ca 0.00 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 2a33 h LEU 60 Cb 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2a33 h LEU 60 CO 0.00 0.34 0.22 1.62 0.09 0.00 0.00 178.44 180.71 2a33 h VAL 61 N -0.20 1.26 -0.16 1.22 3.04 -1.33 -1.48 116.25 118.61 2a33 h VAL 61 Ca 0.01 -0.93 -0.10 0.00 -1.01 0.00 0.00 66.70 64.67 2a33 h VAL 61 Cb 0.30 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.04 2a33 h VAL 61 CO 0.00 0.36 -0.30 0.77 -1.01 0.00 0.00 177.57 177.39 2a33 h SER 62 N 1.11 0.54 -0.66 3.17 4.64 -1.80 -1.84 113.55 118.71 2a33 h SER 62 Ca 0.24 -0.55 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2a33 h SER 62 Cb 0.33 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 2a33 h SER 62 CO -0.01 0.99 0.43 -0.61 -0.87 0.00 0.00 176.83 176.76 2a33 h GLN 63 N 0.12 0.88 -0.54 4.77 5.75 -1.30 -0.30 115.11 124.49 2a33 h GLN 63 Ca 0.01 -0.06 0.05 0.00 -0.15 0.00 0.00 58.65 58.50 2a33 h GLN 63 Cb 0.90 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 29.20 2a33 h GLN 63 CO 0.07 0.60 0.26 0.00 -2.65 0.00 0.00 178.83 177.10 2a33 h ALA 64 N 1.23 0.69 -0.49 3.38 0.00 -1.15 0.61 119.26 123.54 2a33 h ALA 64 Ca 0.24 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2a33 h ALA 64 Cb -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2a33 h ALA 64 CO -0.05 -0.10 -0.19 0.28 0.00 0.00 0.00 179.25 179.19 2a33 h VAL 65 N 0.49 1.27 0.53 0.00 2.07 -0.90 -1.68 116.25 118.04 2a33 h VAL 65 Ca 0.24 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2a33 h VAL 65 Cb 0.18 1.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2a33 h VAL 65 CO -0.19 0.47 -0.26 -0.74 0.02 0.00 0.00 177.57 176.87 2a33 h HIS 66 N 0.84 -0.66 -0.99 1.57 6.17 -0.82 -2.50 115.15 118.76 2a33 h HIS 66 Ca 0.11 -0.02 0.20 0.00 0.71 0.00 0.00 60.37 61.38 2a33 h HIS 66 Cb 0.76 0.22 -0.10 0.00 2.52 0.00 0.00 27.41 30.81 2a33 h HIS 66 CO 0.05 -0.38 0.62 -0.44 0.71 0.00 0.00 177.93 178.49 2a33 h ASP 67 N -0.81 0.70 0.39 3.26 5.19 -0.85 -0.38 116.42 123.92 2a33 h ASP 67 Ca -0.07 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2a33 h ASP 67 Cb 0.59 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.06 2a33 h ASP 67 CO 0.12 0.24 0.00 0.61 -3.12 0.00 0.00 179.24 177.09 2a33 n GLY 68 N -1.37 -0.90 0.48 2.75 0.00 -0.63 -4.90 105.19 100.62 2a33 n GLY 68 Ca 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2a33 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a33 n GLY 69 N 0.01 0.69 3.99 -0.02 0.00 -0.15 -5.01 105.19 104.69 2a33 n GLY 69 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 2a33 n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a33 s ARG 70 N -0.82 2.81 0.09 1.61 1.81 -0.95 -5.04 118.95 118.45 2a33 s ARG 70 Ca 0.00 -0.95 -0.12 0.00 -1.72 0.00 0.00 55.73 52.95 2a33 s ARG 70 Cb 0.00 -2.65 -0.06 0.00 -0.45 0.00 0.00 34.95 31.79 2a33 s ARG 70 CO 0.00 -0.37 0.44 -1.58 -0.68 0.00 0.00 175.30 173.11 2a33 s HIS 71 N -2.49 3.61 -0.10 -0.53 2.46 -1.26 -4.23 115.29 112.75 2a33 s HIS 71 Ca 0.53 0.88 0.04 0.00 0.47 0.00 0.00 55.06 56.99 2a33 s HIS 71 Cb -0.10 -2.23 0.00 0.00 -0.13 0.00 0.00 32.58 30.12 2a33 s HIS 71 CO 0.35 0.51 -0.23 0.08 -2.47 0.00 0.00 174.74 172.98 2a33 s VAL 72 N -1.37 2.01 -0.29 0.89 1.01 -1.26 -2.16 120.40 119.24 2a33 s VAL 72 Ca 0.33 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 2a33 s VAL 72 Cb -0.15 -1.74 0.04 0.00 0.00 0.00 0.00 36.38 34.53 2a33 s VAL 72 CO 0.18 0.55 -0.01 -0.63 0.00 0.00 0.00 175.10 175.18 2a33 s ILE 73 N 0.34 3.00 -0.16 2.22 1.01 -0.26 -0.22 121.20 127.13 2a33 s ILE 73 Ca -0.18 -1.25 -0.11 0.00 0.00 0.00 0.00 60.65 59.10 2a33 s ILE 73 Cb -0.18 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.58 2a33 s ILE 73 CO 0.09 -0.01 0.21 -0.83 0.00 0.00 0.00 174.94 174.39 2a33 s GLY 74 N 1.28 2.15 -0.17 6.18 0.00 -0.15 -1.35 107.32 115.27 2a33 s GLY 74 Ca -0.03 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.14 2a33 s GLY 74 CO -0.02 0.16 -0.20 -0.42 0.00 0.00 0.00 173.10 172.62 2a33 s ILE 75 N 0.07 2.02 0.10 0.90 1.01 -0.19 -0.29 121.20 124.82 2a33 s ILE 75 Ca 0.13 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.92 2a33 s ILE 75 Cb -0.12 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2a33 s ILE 75 CO 0.02 0.54 -0.16 0.27 0.00 0.00 0.00 174.94 175.60 2a33 s ILE 76 N 1.21 1.37 0.44 2.92 -4.36 0.27 -4.20 121.20 118.85 2a33 s ILE 76 Ca 0.03 -1.50 -0.24 0.00 -0.26 0.00 0.00 60.65 58.67 2a33 s ILE 76 Cb -0.13 -1.36 -0.08 0.00 1.25 0.00 0.00 42.46 42.14 2a33 s ILE 76 CO -0.11 -0.22 1.21 -2.84 0.24 0.00 0.00 174.94 173.22 2a33 s PRO 77 N -2.05 3.84 0.62 0.37 0.02 -1.26 -1.17 135.00 135.36 2a33 s PRO 77 Ca 0.04 1.92 0.40 0.00 0.02 0.00 0.00 61.00 63.38 2a33 s PRO 77 Cb -0.09 -2.55 1.98 0.00 0.02 0.00 0.00 34.50 33.87 2a33 s PRO 77 CO 0.03 -0.53 2.21 -0.22 -0.33 0.00 0.00 177.00 178.17 2a33 h LYS 78 N 2.31 0.00 0.73 5.54 3.64 -0.47 -2.94 116.57 125.38 2a33 h LYS 78 Ca -0.49 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.85 2a33 h LYS 78 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2a33 h LYS 78 CO 0.61 0.00 -0.38 1.79 -2.27 0.00 0.00 179.45 179.20 2a33 h THR 79 N 0.00 0.22 0.00 1.00 1.35 -1.84 -3.49 112.91 110.15 2a33 h THR 79 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2a33 h THR 79 Cb 0.22 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 66.86 2a33 h THR 79 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2a33 n LEU 80 N -5.54 0.00 0.00 3.87 -0.00 -1.11 -5.24 117.00 108.98 2a33 n LEU 80 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 2a33 n LEU 80 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 2a33 n LEU 80 CO 0.37 0.00 0.00 1.33 -0.00 0.00 0.00 177.39 179.09 2a33 n VAL 90 N 0.00 0.00 0.00 1.47 0.24 -1.26 -4.87 118.33 113.91 2a33 n VAL 90 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2a33 n VAL 90 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2a33 n VAL 90 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2a33 n GLY 91 N 0.00 -1.18 3.74 7.63 0.00 -1.26 -4.85 105.19 109.27 2a33 n GLY 91 Ca 0.00 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 2a33 n GLY 91 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a33 s GLU 92 N -1.15 4.42 -0.22 1.61 2.12 0.69 -4.92 118.70 121.25 2a33 s GLU 92 Ca 0.00 1.98 -0.07 0.00 0.36 0.00 0.00 54.97 57.25 2a33 s GLU 92 Cb 0.00 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 31.14 2a33 s GLU 92 CO 0.00 -0.21 0.04 0.08 -0.54 0.00 0.00 175.26 174.64 2a33 s VAL 93 N 0.14 4.24 -0.25 3.70 1.01 -1.26 -0.97 120.40 127.00 2a33 s VAL 93 Ca 0.56 -0.21 -0.04 0.00 0.00 0.00 0.00 61.98 62.29 2a33 s VAL 93 Cb -0.35 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2a33 s VAL 93 CO 0.37 0.38 -0.00 -0.13 0.00 0.00 0.00 175.10 175.72 2a33 s ARG 94 N 1.26 3.21 -0.24 2.72 0.52 0.61 -4.98 118.95 122.04 2a33 s ARG 94 Ca 0.04 -0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 54.40 2a33 s ARG 94 Cb -0.15 -3.13 -0.05 0.00 0.52 0.00 0.00 34.95 32.15 2a33 s ARG 94 CO 0.03 -0.30 0.18 0.00 0.02 0.00 0.00 175.30 175.23 2a33 s ALA 95 N 1.47 3.59 0.35 2.13 0.00 -1.26 -0.57 121.76 127.48 2a33 s ALA 95 Ca 0.04 -0.90 0.08 0.00 0.00 0.00 0.00 51.96 51.18 2a33 s ALA 95 Cb -0.16 -2.37 -0.07 0.00 0.00 0.00 0.00 23.12 20.52 2a33 s ALA 95 CO -0.01 -0.27 -0.04 0.14 0.00 0.00 0.00 175.76 175.58 2a33 s VAL 96 N 1.20 1.95 0.14 0.00 -7.23 -0.32 -4.74 120.40 111.40 2a33 s VAL 96 Ca 0.08 -2.10 -0.29 0.00 -1.81 0.00 0.00 61.98 57.86 2a33 s VAL 96 Cb -0.14 -2.75 -0.05 0.00 0.56 0.00 0.00 36.38 34.00 2a33 s VAL 96 CO 0.06 -0.13 1.57 0.00 -0.31 0.00 0.00 175.10 176.29 2a33 h ALA 97 N 1.99 -0.59 -3.00 1.32 0.00 -1.94 0.34 119.26 117.38 2a33 h ALA 97 Ca -0.42 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2a33 h ALA 97 Cb 1.24 0.86 0.00 0.00 0.00 0.00 0.00 17.79 19.90 2a33 h ALA 97 CO 0.73 -0.93 0.00 -0.40 0.00 0.00 0.00 179.25 178.65 2a33 n ASP 98 N -5.43 0.00 0.00 0.00 5.68 -1.26 -4.20 116.55 111.34 2a33 n ASP 98 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.26 2a33 n ASP 98 Cb 0.36 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 2a33 n ASP 98 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2a33 n HIS 100 N 0.00 0.00 -0.13 2.11 8.25 -1.26 -0.97 115.22 123.22 2a33 n HIS 100 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 2a33 n HIS 100 Cb 0.00 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.27 2a33 n HIS 100 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2a33 h GLN 101 N 0.00 0.83 -0.06 -0.41 1.08 -1.97 -1.67 115.11 112.91 2a33 h GLN 101 Ca 0.00 -0.20 0.02 0.00 -1.45 0.00 0.00 58.65 57.02 2a33 h GLN 101 Cb 0.00 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.30 2a33 h GLN 101 CO 0.00 0.80 -0.08 -0.09 -0.95 0.00 0.00 178.83 178.51 2a33 h ARG 102 N 0.78 -0.10 -0.78 1.46 2.43 -1.41 -1.03 114.38 115.73 2a33 h ARG 102 Ca 0.16 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 2a33 h ARG 102 Cb 0.40 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.93 2a33 h ARG 102 CO 0.01 -0.07 0.37 0.87 -1.51 0.00 0.00 179.97 179.64 2a33 h LYS 103 N -0.11 1.13 -0.45 0.20 1.57 -1.78 -3.09 116.57 114.05 2a33 h LYS 103 Ca 0.05 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 2a33 h LYS 103 Cb 0.18 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2a33 h LYS 103 CO -0.12 0.88 0.21 0.00 -0.57 0.00 0.00 179.45 179.85 2a33 h ALA 104 N 1.19 0.57 0.00 3.86 0.00 -1.21 -0.42 119.26 123.24 2a33 h ALA 104 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2a33 h ALA 104 Cb 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2a33 h ALA 104 CO -0.03 0.14 0.00 0.39 0.00 0.00 0.00 179.25 179.74 2a33 n GLU 105 N -4.65 0.25 0.00 0.00 -0.58 -0.40 -0.30 120.64 114.95 2a33 n GLU 105 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2a33 n GLU 105 Cb 0.11 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 2a33 n GLU 105 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2a33 n ALA 107 N 0.69 0.00 -0.26 0.62 0.00 -0.17 -1.81 120.51 119.58 2a33 n ALA 107 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 2a33 n ALA 107 Cb 0.10 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.81 2a33 n ALA 107 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2a33 h LYS 108 N 0.00 0.94 -0.62 0.00 3.64 -0.91 -2.58 116.57 117.04 2a33 h LYS 108 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2a33 h LYS 108 Cb 0.00 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2a33 h LYS 108 CO 0.00 0.63 0.00 0.72 -2.27 0.00 0.00 179.45 178.53 2a33 n HIS 109 N -4.47 1.04 -4.37 1.91 8.25 -0.75 -4.94 115.22 111.88 2a33 n HIS 109 Ca 0.12 -0.45 -0.22 0.00 -0.26 0.00 0.00 57.72 56.90 2a33 n HIS 109 Cb 0.17 -0.11 -0.11 0.00 1.12 0.00 0.00 29.99 31.06 2a33 n HIS 109 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2a33 s SER 110 N -0.91 2.95 -0.01 0.41 0.01 -0.98 -4.73 113.70 110.45 2a33 s SER 110 Ca 0.42 -0.92 0.12 0.00 1.31 0.00 0.00 55.95 56.88 2a33 s SER 110 Cb 0.24 -0.20 -0.16 0.00 0.21 0.00 0.00 66.02 66.12 2a33 s SER 110 CO 0.24 -0.02 0.43 0.47 0.41 0.00 0.00 173.24 174.77 2a33 n ASP 111 N 0.02 1.18 -3.48 2.44 8.00 0.17 -4.97 116.55 119.90 2a33 n ASP 111 Ca -0.11 -0.48 -0.08 0.00 0.71 0.00 0.00 54.79 54.84 2a33 n ASP 111 Cb 0.58 1.23 -0.00 0.00 -0.02 0.00 0.00 41.12 42.91 2a33 n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a33 s ALA 112 N -2.45 -1.05 -0.01 2.24 0.00 -1.24 -4.16 121.76 115.09 2a33 s ALA 112 Ca 0.01 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.51 2a33 s ALA 112 Cb 0.09 0.77 0.00 0.00 0.00 0.00 0.00 23.12 23.98 2a33 s ALA 112 CO 0.52 -1.02 -0.04 -0.06 0.00 0.00 0.00 175.76 175.16 2a33 s PHE 113 N -3.23 0.43 -0.04 0.00 0.08 -0.38 -0.96 117.98 113.87 2a33 s PHE 113 Ca 0.13 -0.08 0.02 0.00 0.12 0.00 0.00 56.93 57.12 2a33 s PHE 113 Cb -0.05 -0.32 0.01 0.00 -0.57 0.00 0.00 43.02 42.09 2a33 s PHE 113 CO 0.09 -0.04 -0.09 0.42 -0.10 0.00 0.00 175.22 175.50 2a33 s ILE 114 N 0.12 0.82 -0.24 0.64 1.01 0.05 -0.87 121.20 122.72 2a33 s ILE 114 Ca -0.01 -0.32 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 2a33 s ILE 114 Cb -0.04 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.63 2a33 s ILE 114 CO -0.00 0.28 0.06 0.00 0.00 0.00 0.00 174.94 175.27 2a33 s ALA 115 N 0.59 3.13 0.84 9.38 0.00 0.10 -0.88 121.76 134.92 2a33 s ALA 115 Ca -0.10 -1.12 -0.12 0.00 0.00 0.00 0.00 51.96 50.61 2a33 s ALA 115 Cb -0.13 -2.04 0.10 0.00 0.00 0.00 0.00 23.12 21.05 2a33 s ALA 115 CO 0.02 -0.46 1.18 -0.51 0.00 0.00 0.00 175.76 175.98 2a33 s LEU 116 N 1.57 2.43 0.40 0.00 1.43 -0.60 -0.19 118.68 123.71 2a33 s LEU 116 Ca 0.06 0.77 -0.24 0.00 -1.03 0.00 0.00 54.13 53.70 2a33 s LEU 116 Cb -0.15 -3.21 -0.12 0.00 0.03 0.00 0.00 46.19 42.74 2a33 s LEU 116 CO 0.03 -2.07 0.76 -2.65 0.23 0.00 0.00 176.35 172.65 2a33 n PRO 117 N -3.43 0.90 -3.24 1.29 -0.02 -1.26 -4.65 135.00 124.59 2a33 n PRO 117 Ca 0.08 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2a33 n PRO 117 Cb 0.61 -1.72 0.01 0.00 -0.02 0.00 0.00 33.50 32.38 2a33 n PRO 117 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a33 n GLY 118 N 1.52 0.55 0.00 -1.23 0.00 -1.26 -1.39 105.19 103.39 2a33 n GLY 118 Ca 0.11 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2a33 n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a33 n GLY 119 N -0.58 1.82 0.33 -0.02 0.00 -1.26 -4.77 105.19 100.71 2a33 n GLY 119 Ca 0.01 -1.81 0.04 0.00 0.00 0.00 0.00 46.02 44.26 2a33 n GLY 119 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2a33 h TYR 120 N 0.00 0.99 -0.04 1.61 0.05 -2.02 -1.64 116.97 115.92 2a33 h TYR 120 Ca 0.00 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2a33 h TYR 120 Cb 0.00 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.43 2a33 h TYR 120 CO 0.00 0.43 -0.00 0.78 -1.05 0.00 0.00 178.16 178.32 2a33 h GLY 121 N 0.91 0.07 0.42 3.88 0.00 -1.99 0.93 103.07 107.29 2a33 h GLY 121 Ca 0.43 -0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.78 2a33 h GLY 121 CO -0.23 0.05 0.13 -0.84 0.00 0.00 0.00 176.54 175.65 2a33 h THR 122 N -0.23 0.76 -0.47 4.70 2.02 -1.84 -1.94 112.91 115.91 2a33 h THR 122 Ca 0.01 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 2a33 h THR 122 Cb 0.33 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2a33 h THR 122 CO 0.00 0.05 0.14 0.25 0.37 0.00 0.00 175.52 176.34 2a33 h LEU 123 N 0.28 0.68 -0.64 2.58 5.85 -1.09 -0.79 115.31 122.18 2a33 h LEU 123 Ca 0.25 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2a33 h LEU 123 Cb 0.31 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2a33 h LEU 123 CO -0.30 0.71 0.36 -0.08 -0.34 0.00 0.00 178.44 178.79 2a33 h GLU 124 N 0.62 0.90 -0.35 1.25 4.22 -0.67 -0.29 114.58 120.26 2a33 h GLU 124 Ca 0.15 -0.10 -0.05 0.00 0.08 0.00 0.00 59.36 59.44 2a33 h GLU 124 Cb 0.27 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2a33 h GLU 124 CO -0.00 0.67 0.02 0.93 -2.18 0.00 0.00 179.01 178.45 2a33 h GLU 125 N 0.88 0.60 -0.07 1.92 5.08 -1.13 -1.23 114.58 120.63 2a33 h GLU 125 Ca 0.23 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2a33 h GLU 125 Cb 0.04 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 2a33 h GLU 125 CO -0.04 0.70 0.04 1.25 -1.00 0.00 0.00 179.01 179.97 2a33 h LEU 126 N 0.42 0.09 -1.20 1.33 5.85 -0.96 -2.73 115.31 118.10 2a33 h LEU 126 Ca 0.10 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2a33 h LEU 126 Cb 0.42 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2a33 h LEU 126 CO 0.01 0.09 0.22 -0.07 -0.34 0.00 0.00 178.44 178.35 2a33 h LEU 127 N 0.07 0.70 -0.02 2.25 3.38 -0.99 -1.93 115.31 118.78 2a33 h LEU 127 Ca 0.03 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2a33 h LEU 127 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2a33 h LEU 127 CO -0.01 0.63 -0.03 -0.08 0.09 0.00 0.00 178.44 179.05 2a33 h GLU 128 N 0.77 -0.04 0.00 1.13 4.81 -1.06 -0.97 114.58 119.22 2a33 h GLU 128 Ca 0.18 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.35 2a33 h GLU 128 Cb 0.15 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2a33 h GLU 128 CO -0.02 -0.02 -0.34 -0.39 -0.73 0.00 0.00 179.01 177.51 2a33 h VAL 129 N -0.04 1.03 -0.10 0.32 -1.51 -1.22 -0.33 116.25 114.40 2a33 h VAL 129 Ca 0.02 -1.26 -0.03 0.00 -1.23 0.00 0.00 66.70 64.19 2a33 h VAL 129 Cb 0.07 1.73 -0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2a33 h VAL 129 CO -0.05 0.33 -0.08 0.40 -1.23 0.00 0.00 177.57 176.95 2a33 h ILE 130 N 0.00 1.35 -0.60 7.19 2.04 -1.26 -2.47 117.51 123.75 2a33 h ILE 130 Ca -0.00 -1.18 0.03 0.00 1.00 0.00 0.00 64.86 64.70 2a33 h ILE 130 Cb 0.70 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 38.66 2a33 h ILE 130 CO 0.04 0.33 0.37 0.74 0.00 0.00 0.00 178.15 179.64 2a33 h THR 131 N -0.17 1.08 -0.87 -0.27 2.02 -0.79 -0.13 112.91 113.78 2a33 h THR 131 Ca 0.02 -0.25 0.05 0.00 0.77 0.00 0.00 66.41 67.00 2a33 h THR 131 Cb 0.57 0.28 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 2a33 h THR 131 CO 0.02 0.13 0.57 -0.50 0.37 0.00 0.00 175.52 176.11 2a33 h TRP 132 N 0.73 1.01 -0.34 3.16 6.55 -1.05 0.86 115.95 126.87 2a33 h TRP 132 Ca 0.24 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 60.04 2a33 h TRP 132 Cb 0.01 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 27.97 2a33 h TRP 132 CO -0.05 0.55 -0.06 0.00 -1.05 0.00 0.00 178.44 177.83 2a33 h ALA 133 N 1.52 0.46 -0.93 1.49 0.00 -0.98 0.15 119.26 120.97 2a33 h ALA 133 Ca 0.36 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2a33 h ALA 133 Cb 0.14 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 2a33 h ALA 133 CO -0.12 0.28 0.60 0.37 0.00 0.00 0.00 179.25 180.37 2a33 h GLN 134 N 0.42 1.08 0.00 0.00 4.15 -0.28 -1.79 115.11 118.69 2a33 h GLN 134 Ca 0.09 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2a33 h GLN 134 Cb 0.55 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.99 2a33 h GLN 134 CO 0.03 0.71 0.00 1.28 -1.93 0.00 0.00 178.83 178.92 2a33 n LEU 135 N -4.54 0.00 -0.04 -2.39 4.77 0.23 -4.91 117.00 110.12 2a33 n LEU 135 Ca 0.13 0.05 -0.01 0.00 -0.03 0.00 0.00 56.01 56.16 2a33 n LEU 135 Cb 0.15 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2a33 n LEU 135 CO 0.32 -0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 176.99 2a33 n GLY 136 N 0.98 0.47 0.21 -0.72 0.00 -0.67 -4.91 105.19 100.55 2a33 n GLY 136 Ca 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2a33 n GLY 136 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2a33 h ILE 137 N 0.00 1.28 -4.11 -0.61 2.04 -0.94 -3.46 117.51 111.71 2a33 h ILE 137 Ca -0.01 -1.36 -0.17 0.00 1.00 0.00 0.00 64.86 64.31 2a33 h ILE 137 Cb 0.13 1.54 -0.11 0.00 -0.74 0.00 0.00 36.82 37.64 2a33 h ILE 137 CO 0.02 0.42 -0.33 -1.38 0.00 0.00 0.00 178.15 176.87 2a33 s HIS 138 N -4.30 0.81 -0.04 1.37 -3.43 -1.21 -5.01 115.29 103.49 2a33 s HIS 138 Ca -0.05 -1.09 0.05 0.00 -0.80 0.00 0.00 55.06 53.18 2a33 s HIS 138 Cb 0.14 -0.16 0.08 0.00 -1.43 0.00 0.00 32.58 31.21 2a33 s HIS 138 CO 0.77 -0.88 0.93 -3.47 -2.00 0.00 0.00 174.74 170.10 2a33 n ASP 139 N -0.53 1.29 -4.76 7.38 -0.08 -1.26 -4.22 116.55 114.38 2a33 n ASP 139 Ca 0.00 -2.08 -0.39 0.00 -1.51 0.00 0.00 54.79 50.81 2a33 n ASP 139 Cb 0.63 -0.16 -0.06 0.00 2.34 0.00 0.00 41.12 43.88 2a33 n ASP 139 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2a33 s LYS 140 N -1.12 4.73 0.56 -0.67 1.02 -1.26 -5.01 119.74 117.99 2a33 s LYS 140 Ca 0.09 1.53 -0.21 0.00 0.02 0.00 0.00 55.97 57.40 2a33 s LYS 140 Cb 0.08 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.21 2a33 s LYS 140 CO 0.01 0.38 1.27 -2.14 -0.92 0.00 0.00 175.35 173.94 2a33 s PRO 141 N -1.47 3.13 -0.08 -1.68 0.02 -1.26 -4.88 135.00 128.78 2a33 s PRO 141 Ca 0.44 1.99 -0.00 0.00 0.02 0.00 0.00 61.00 63.46 2a33 s PRO 141 Cb -0.26 -2.13 0.02 0.00 0.02 0.00 0.00 34.50 32.16 2a33 s PRO 141 CO 0.32 -1.12 -0.05 0.08 -0.33 0.00 0.00 177.00 175.90 2a33 s VAL 142 N -1.45 0.72 0.08 3.83 1.01 -1.26 -1.25 120.40 122.07 2a33 s VAL 142 Ca 0.73 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.61 2a33 s VAL 142 Cb -0.35 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 2a33 s VAL 142 CO 0.39 0.30 -0.11 -0.83 0.00 0.00 0.00 175.10 174.86 2a33 s GLY 143 N 1.50 0.78 -0.14 4.51 0.00 -0.05 -1.67 107.32 112.25 2a33 s GLY 143 Ca -0.01 -1.05 -0.00 0.00 0.00 0.00 0.00 44.72 43.66 2a33 s GLY 143 CO -0.04 -1.11 -0.14 1.08 0.00 0.00 0.00 173.10 172.89 2a33 s LEU 144 N -2.09 2.65 -0.77 0.66 1.43 0.15 -0.72 118.68 119.99 2a33 s LEU 144 Ca 0.00 -0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 52.53 2a33 s LEU 144 Cb -0.06 -1.60 0.11 0.00 0.03 0.00 0.00 46.19 44.67 2a33 s LEU 144 CO 0.01 0.14 0.98 -0.22 0.23 0.00 0.00 176.35 177.48 2a33 s LEU 145 N 0.51 4.95 -1.21 1.79 2.96 0.74 -2.21 118.68 126.21 2a33 s LEU 145 Ca -0.09 -1.59 -0.07 0.00 -0.22 0.00 0.00 54.13 52.16 2a33 s LEU 145 Cb -0.16 -2.38 0.22 0.00 0.50 0.00 0.00 46.19 44.37 2a33 s LEU 145 CO 0.04 -1.19 1.75 -3.20 -1.32 0.00 0.00 176.35 172.43 2a33 n ASN 146 N 6.82 5.67 -4.71 3.68 5.15 0.06 -4.12 115.26 127.80 2a33 n ASN 146 Ca 0.08 -3.23 -0.42 0.00 -0.60 0.00 0.00 54.58 50.40 2a33 n ASN 146 Cb 0.46 -1.39 -0.03 0.00 -0.53 0.00 0.00 39.78 38.29 2a33 n ASN 146 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2a33 s VAL 147 N -0.89 3.48 -1.66 3.44 1.01 -1.26 -3.34 120.40 121.18 2a33 s VAL 147 Ca 0.37 1.03 -0.15 0.00 0.00 0.00 0.00 61.98 63.22 2a33 s VAL 147 Cb 0.08 -3.66 0.13 0.00 0.00 0.00 0.00 36.38 32.94 2a33 s VAL 147 CO 0.04 0.06 0.70 0.47 0.00 0.00 0.00 175.10 176.37 2a33 n ASP 148 N 4.29 -2.69 -1.15 3.32 8.00 -1.26 -1.66 116.55 125.39 2a33 n ASP 148 Ca 0.12 -1.02 -0.15 0.00 0.71 0.00 0.00 54.79 54.44 2a33 n ASP 148 Cb 0.43 -2.75 -0.06 0.00 -0.02 0.00 0.00 41.12 38.71 2a33 n ASP 148 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a33 n GLY 149 N -1.53 1.45 0.32 0.44 0.00 -1.21 -4.88 105.19 99.78 2a33 n GLY 149 Ca 0.00 -0.03 0.17 0.00 0.00 0.00 0.00 46.02 46.17 2a33 n GLY 149 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2a33 h TYR 150 N 0.00 0.48 -0.37 1.61 3.20 -1.56 -0.62 116.97 119.72 2a33 h TYR 150 Ca -0.31 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.61 2a33 h TYR 150 Cb 1.23 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.44 2a33 h TYR 150 CO 0.58 -0.25 0.00 0.66 -1.64 0.00 0.00 178.16 177.51 2a33 n TYR 151 N -5.22 0.48 -0.26 -3.82 4.01 -1.26 -4.52 117.16 106.56 2a33 n TYR 151 Ca 0.26 -0.24 -0.03 0.00 -0.16 0.00 0.00 57.90 57.72 2a33 n TYR 151 Cb 0.82 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.93 2a33 n TYR 151 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 2a33 h ASN 152 N 3.31 0.78 0.71 7.72 2.35 -1.49 0.06 115.58 129.01 2a33 h ASN 152 Ca 0.00 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 2a33 h ASN 152 Cb 0.74 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2a33 h ASN 152 CO 0.00 0.55 -0.40 0.28 -1.65 0.00 0.00 177.43 176.21 2a33 h SER 153 N 0.93 0.00 -0.14 5.81 0.02 -1.79 0.40 113.55 118.78 2a33 h SER 153 Ca 0.29 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 2a33 h SER 153 Cb -0.02 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 2a33 h SER 153 CO -0.10 0.40 -0.03 0.25 -1.14 0.00 0.00 176.83 176.21 2a33 h LEU 154 N 0.00 0.27 -0.44 5.07 5.85 -1.51 -0.07 115.31 124.48 2a33 h LEU 154 Ca -0.00 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.37 2a33 h LEU 154 Cb 0.86 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 2a33 h LEU 154 CO 0.05 0.57 0.26 -0.07 -0.34 0.00 0.00 178.44 178.91 2a33 h LEU 155 N -0.04 0.42 -1.65 2.25 3.38 -0.78 -1.09 115.31 117.81 2a33 h LEU 155 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2a33 h LEU 155 Cb 0.45 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2a33 h LEU 155 CO 0.01 0.30 0.12 0.28 0.09 0.00 0.00 178.44 179.25 2a33 h SER 156 N 0.53 0.31 -0.31 -0.43 0.02 -0.90 -1.07 113.55 111.69 2a33 h SER 156 Ca 0.17 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2a33 h SER 156 Cb 0.00 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 2a33 h SER 156 CO -0.08 0.27 0.08 0.15 -1.14 0.00 0.00 176.83 176.12 2a33 h PHE 157 N 0.35 0.53 -0.87 3.45 3.57 -0.29 -2.04 116.94 121.65 2a33 h PHE 157 Ca 0.09 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.58 2a33 h PHE 157 Cb 0.05 -0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.58 2a33 h PHE 157 CO 0.00 0.55 0.55 0.82 -2.23 0.00 0.00 178.31 178.00 2a33 h ILE 158 N 0.35 1.09 -0.81 1.41 1.08 -0.81 -1.29 117.51 118.53 2a33 h ILE 158 Ca 0.10 -0.35 0.13 0.00 -0.39 0.00 0.00 64.86 64.34 2a33 h ILE 158 Cb 0.29 -0.03 -0.09 0.00 -3.07 0.00 0.00 36.82 33.92 2a33 h ILE 158 CO 0.00 0.19 0.41 0.44 -0.69 0.00 0.00 178.15 178.50 2a33 h ASP 159 N 1.03 0.51 -0.28 1.72 3.32 -0.95 -0.19 116.42 121.58 2a33 h ASP 159 Ca 0.36 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.49 2a33 h ASP 159 Cb 0.10 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2a33 h ASP 159 CO -0.15 0.24 0.16 0.50 -1.72 0.00 0.00 179.24 178.28 2a33 h LYS 160 N 0.63 0.38 -0.89 3.56 1.63 -0.62 0.12 116.57 121.38 2a33 h LYS 160 Ca 0.42 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 60.22 2a33 h LYS 160 Cb 0.55 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 32.05 2a33 h LYS 160 CO -0.33 0.31 0.59 0.00 -3.45 0.00 0.00 179.45 176.57 2a33 h ALA 161 N 1.05 1.43 -0.24 5.00 0.00 -0.81 0.13 119.26 125.82 2a33 h ALA 161 Ca 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2a33 h ALA 161 Cb 0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2a33 h ALA 161 CO -0.02 0.49 -0.06 0.28 0.00 0.00 0.00 179.25 179.94 2a33 h VAL 162 N 1.12 1.29 -0.92 0.00 2.07 -0.48 0.66 116.25 119.98 2a33 h VAL 162 Ca 0.35 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2a33 h VAL 162 Cb -0.00 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 2a33 h VAL 162 CO -0.10 0.33 0.57 -0.08 0.02 0.00 0.00 177.57 178.31 2a33 h GLU 163 N 0.20 1.25 -0.01 1.57 4.81 -0.18 -2.28 114.58 119.93 2a33 h GLU 163 Ca 0.06 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2a33 h GLU 163 Cb 0.53 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2a33 h GLU 163 CO 0.02 0.86 -0.04 0.39 -0.73 0.00 0.00 179.01 179.52 2a33 n GLU 164 N -4.36 1.23 -0.73 1.92 -0.58 0.38 -4.92 120.64 113.58 2a33 n GLU 164 Ca 0.10 -0.50 0.00 0.00 -0.42 0.00 0.00 57.16 56.34 2a33 n GLU 164 Cb 0.05 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 2a33 n GLU 164 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2a33 n GLY 165 N 1.15 0.55 0.03 0.62 0.00 -0.86 -4.97 105.19 101.71 2a33 n GLY 165 Ca 0.19 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.52 2a33 n GLY 165 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2a33 n PHE 166 N -2.73 0.20 -4.14 1.61 3.72 0.17 -4.88 117.46 111.42 2a33 n PHE 166 Ca 0.00 0.06 -0.19 0.00 -0.05 0.00 0.00 57.45 57.27 2a33 n PHE 166 Cb 0.00 -0.38 -0.16 0.00 -0.94 0.00 0.00 39.48 38.00 2a33 n PHE 166 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2a33 s ILE 167 N -3.20 0.46 0.50 4.37 1.01 -1.11 -4.98 121.20 118.25 2a33 s ILE 167 Ca 0.03 -0.12 -0.19 0.00 0.00 0.00 0.00 60.65 60.37 2a33 s ILE 167 Cb 0.15 -0.47 -0.08 0.00 0.01 0.00 0.00 42.46 42.06 2a33 s ILE 167 CO 0.82 0.19 1.02 -0.94 0.00 0.00 0.00 174.94 176.03 2a33 s SER 168 N 0.68 6.38 0.37 3.58 1.04 -1.26 -4.03 113.70 120.47 2a33 s SER 168 Ca -0.09 1.83 0.14 0.00 0.48 0.00 0.00 55.95 58.31 2a33 s SER 168 Cb -0.12 -2.55 0.98 0.00 0.10 0.00 0.00 66.02 64.43 2a33 s SER 168 CO -0.00 -0.75 1.79 -0.65 0.98 0.00 0.00 173.24 174.61 2a33 h PRO 169 N 1.36 0.51 -0.63 4.02 0.11 -1.99 -0.95 132.00 134.43 2a33 h PRO 169 Ca -0.49 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 2a33 h PRO 169 Cb 1.21 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2a33 h PRO 169 CO 0.59 0.33 0.22 1.15 -0.21 0.00 0.00 178.00 180.09 2a33 h THR 170 N 0.52 1.24 -0.02 -1.15 2.02 -2.00 -2.77 112.91 110.75 2a33 h THR 170 Ca 0.56 -0.80 -0.10 0.00 0.77 0.00 0.00 66.41 66.84 2a33 h THR 170 Cb 1.21 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 2a33 h THR 170 CO -0.30 0.31 -0.43 0.00 0.37 0.00 0.00 175.52 175.47 2a33 h ALA 171 N 1.08 1.24 -0.88 6.16 0.00 -1.59 -2.46 119.26 122.82 2a33 h ALA 171 Ca 0.21 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2a33 h ALA 171 Cb 0.26 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2a33 h ALA 171 CO -0.01 0.56 0.55 -0.09 0.00 0.00 0.00 179.25 180.25 2a33 h ARG 172 N 0.04 1.18 0.00 0.00 2.43 -1.03 -2.29 114.38 114.71 2a33 h ARG 172 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2a33 h ARG 172 Cb 0.78 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2a33 h ARG 172 CO 0.06 0.81 0.00 0.39 -1.51 0.00 0.00 179.97 179.72 2a33 n GLU 173 N -4.38 0.06 -0.20 0.20 1.02 -0.93 -2.27 120.64 114.15 2a33 n GLU 173 Ca 0.10 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2a33 n GLU 173 Cb 0.05 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 30.22 2a33 n GLU 173 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2a33 h ILE 174 N 0.00 1.19 -3.52 -3.67 2.04 -1.43 -3.39 117.51 108.73 2a33 h ILE 174 Ca 0.00 -0.38 -0.56 0.00 1.00 0.00 0.00 64.86 64.91 2a33 h ILE 174 Cb 0.14 0.15 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 2a33 h ILE 174 CO 0.00 0.19 0.93 -0.63 0.00 0.00 0.00 178.15 178.64 2a33 s ILE 175 N -5.78 4.24 -0.04 -0.67 1.01 -0.96 -4.32 121.20 114.68 2a33 s ILE 175 Ca -0.11 1.32 -0.16 0.00 0.00 0.00 0.00 60.65 61.71 2a33 s ILE 175 Cb 0.18 -4.48 -0.05 0.00 0.01 0.00 0.00 42.46 38.12 2a33 s ILE 175 CO 0.78 -0.81 0.42 -0.69 0.00 0.00 0.00 174.94 174.64 2a33 s VAL 176 N 4.37 5.08 0.01 2.92 1.01 -0.67 -4.98 120.40 128.14 2a33 s VAL 176 Ca 0.50 0.85 0.01 0.00 0.00 0.00 0.00 61.98 63.34 2a33 s VAL 176 Cb -0.10 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2a33 s VAL 176 CO 0.27 0.50 -0.03 -0.55 0.00 0.00 0.00 175.10 175.29 2a33 s SER 177 N -0.52 0.35 0.07 3.32 0.15 -1.26 0.30 113.70 116.10 2a33 s SER 177 Ca 0.24 -0.21 -0.23 0.00 0.70 0.00 0.00 55.95 56.45 2a33 s SER 177 Cb -0.16 0.00 0.06 0.00 -1.71 0.00 0.00 66.02 64.21 2a33 s SER 177 CO 0.12 -0.07 0.55 0.00 1.20 0.00 0.00 173.24 175.04 2a33 s ALA 178 N -0.52 -1.42 -1.13 5.45 0.00 -0.94 -4.92 121.76 118.28 2a33 s ALA 178 Ca -0.04 0.62 0.29 0.00 0.00 0.00 0.00 51.96 52.83 2a33 s ALA 178 Cb -0.04 0.47 1.21 0.00 0.00 0.00 0.00 23.12 24.76 2a33 s ALA 178 CO -0.00 -0.56 1.89 -0.35 0.00 0.00 0.00 175.76 176.74 2a33 n PRO 179 N 0.25 0.14 -4.16 0.00 -0.04 -1.26 -0.76 135.00 129.16 2a33 n PRO 179 Ca -0.18 -0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.15 2a33 n PRO 179 Cb 0.61 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.47 2a33 n PRO 179 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2a33 s THR 180 N -2.88 0.70 0.08 0.52 -4.23 -1.26 -4.34 115.64 104.23 2a33 s THR 180 Ca 0.18 -1.83 -0.23 0.00 -1.18 0.00 0.00 61.69 58.63 2a33 s THR 180 Cb 0.19 -1.55 -0.14 0.00 1.34 0.00 0.00 72.50 72.34 2a33 s THR 180 CO 0.53 -0.80 1.66 0.00 -0.54 0.00 0.00 174.62 175.48 2a33 h ALA 181 N 3.16 0.07 -0.14 3.99 0.00 -1.89 -1.19 119.26 123.26 2a33 h ALA 181 Ca -0.35 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.55 2a33 h ALA 181 Cb 1.17 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 2a33 h ALA 181 CO 0.61 -0.39 -0.30 -0.22 0.00 0.00 0.00 179.25 178.95 2a33 h LYS 182 N -0.01 -0.36 -0.51 0.00 3.64 -1.97 -0.12 116.57 117.25 2a33 h LYS 182 Ca 0.02 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.50 2a33 h LYS 182 Cb 0.09 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.93 2a33 h LYS 182 CO -0.00 -0.24 0.16 0.93 -2.27 0.00 0.00 179.45 178.02 2a33 h GLU 183 N -0.37 0.31 -0.30 1.90 5.08 -1.97 -2.25 114.58 116.97 2a33 h GLU 183 Ca 0.10 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2a33 h GLU 183 Cb 0.53 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2a33 h GLU 183 CO -0.35 0.20 0.10 1.25 -1.00 0.00 0.00 179.01 179.21 2a33 h LEU 184 N 0.32 0.43 -1.15 1.33 5.85 -0.83 -1.02 115.31 120.24 2a33 h LEU 184 Ca 0.25 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2a33 h LEU 184 Cb 0.29 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2a33 h LEU 184 CO -0.28 0.52 0.15 0.58 -0.34 0.00 0.00 178.44 179.07 2a33 h VAL 185 N 0.33 1.21 -0.28 1.05 2.07 -0.98 0.11 116.25 119.75 2a33 h VAL 185 Ca 0.10 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 2a33 h VAL 185 Cb 0.24 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2a33 h VAL 185 CO -0.00 0.27 0.16 0.11 0.02 0.00 0.00 177.57 178.13 2a33 h LYS 186 N 0.73 0.38 -0.36 1.57 1.57 -1.09 -1.63 116.57 117.74 2a33 h LYS 186 Ca 0.17 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.87 2a33 h LYS 186 Cb 0.23 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 2a33 h LYS 186 CO -0.01 0.31 0.04 0.87 -0.57 0.00 0.00 179.45 180.08 2a33 h LYS 187 N 0.35 0.54 -0.48 3.15 1.57 -0.57 -2.87 116.57 118.26 2a33 h LYS 187 Ca 0.10 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 2a33 h LYS 187 Cb 0.03 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2a33 h LYS 187 CO -0.02 0.54 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.13 2a33 h LEU 188 N 0.53 1.00 -1.32 2.94 3.38 -0.20 -2.90 115.31 118.73 2a33 h LEU 188 Ca 0.12 -0.37 0.12 0.00 0.09 0.00 0.00 57.88 57.84 2a33 h LEU 188 Cb 0.29 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 2a33 h LEU 188 CO 0.01 1.16 0.55 -0.33 0.09 0.00 0.00 178.44 179.92 2a33 h GLU 189 N 0.84 0.68 0.00 1.13 4.39 -1.10 -3.47 114.58 117.05 2a33 h GLU 189 Ca 0.11 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2a33 h GLU 189 Cb 0.78 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2a33 h GLU 189 CO 0.06 0.45 0.00 0.39 -1.16 0.00 0.00 179.01 178.75