#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2b n THR 2 N 0.00 0.17 -3.20 0.00 5.66 -1.26 -4.78 114.28 110.86 1d2b n THR 2 Ca 0.00 -0.55 -0.02 0.00 -3.05 0.00 0.00 64.05 60.43 1d2b n THR 2 Cb 0.00 -2.52 0.00 0.00 -1.55 0.00 0.00 70.33 66.26 1d2b n THR 2 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1d2b s VAL 4 N 0.38 4.22 -0.39 0.00 -7.23 -1.26 -4.76 120.40 111.35 1d2b s VAL 4 Ca 0.04 -0.95 -0.35 0.00 -1.81 0.00 0.00 61.98 58.90 1d2b s VAL 4 Cb -0.00 -3.47 -0.15 0.00 0.56 0.00 0.00 36.38 33.31 1d2b s VAL 4 CO 0.02 -0.19 1.54 -2.65 -0.31 0.00 0.00 175.10 173.51 1d2b n PRO 5 N -1.65 0.00 -3.40 4.82 -0.02 -1.26 -4.90 135.00 128.59 1d2b n PRO 5 Ca -0.01 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.09 1d2b n PRO 5 Cb 0.58 -1.17 -0.06 0.00 -0.02 0.00 0.00 33.50 32.82 1d2b n PRO 5 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1d2b s PRO 6 N 3.94 4.28 -0.05 0.52 0.04 -1.26 -4.99 135.00 137.48 1d2b s PRO 6 Ca 0.90 0.34 -0.15 0.00 0.04 0.00 0.00 61.00 62.13 1d2b s PRO 6 Cb -1.17 -3.41 -0.07 0.00 0.04 0.00 0.00 34.50 29.88 1d2b s PRO 6 CO 0.56 0.23 0.43 0.72 0.04 0.00 0.00 177.00 178.97 1d2b n HIS 7 N 3.48 0.33 0.32 0.56 8.25 -1.26 -4.47 115.22 122.44 1d2b n HIS 7 Ca -0.09 0.38 0.15 0.00 -0.26 0.00 0.00 57.72 57.90 1d2b n HIS 7 Cb 0.52 -0.75 0.64 0.00 1.12 0.00 0.00 29.99 31.52 1d2b n HIS 7 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1d2b h PRO 8 N 1.25 0.00 -0.40 -0.41 0.13 -1.92 0.61 132.00 131.26 1d2b h PRO 8 Ca -0.17 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.88 1d2b h PRO 8 Cb 0.50 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 1d2b h PRO 8 CO 0.26 0.00 -0.09 0.37 -0.23 0.00 0.00 178.00 178.32 1d2b h GLN 9 N 0.00 0.69 0.09 0.86 -0.00 -1.84 0.98 115.11 115.88 1d2b h GLN 9 Ca 0.00 -0.21 -0.35 0.00 -0.00 0.00 0.00 58.65 58.09 1d2b h GLN 9 Cb 0.39 -0.07 -0.03 0.00 0.00 0.00 0.00 27.48 27.77 1d2b h GLN 9 CO 0.00 0.77 -1.94 2.41 0.00 0.00 0.00 178.83 180.07 1d2b n THR 10 N -4.19 1.70 -0.19 2.39 -1.04 -0.62 -3.59 114.28 108.74 1d2b n THR 10 Ca 0.01 -0.53 -0.03 0.00 -2.04 0.00 0.00 64.05 61.46 1d2b n THR 10 Cb 0.34 -1.76 0.16 0.00 -1.82 0.00 0.00 70.33 67.25 1d2b n THR 10 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1d2b h ALA 11 N -0.07 1.20 0.25 2.41 0.00 0.30 0.25 119.26 123.58 1d2b h ALA 11 Ca -0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1d2b h ALA 11 Cb 1.88 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1d2b h ALA 11 CO -0.00 0.57 -0.12 0.35 0.00 0.00 0.00 179.25 180.05 1d2b h PHE 12 N 0.94 -0.31 -0.06 0.00 3.04 0.82 -2.80 116.94 118.57 1d2b h PHE 12 Ca 0.22 -0.01 -0.10 0.00 3.98 0.00 0.00 57.97 62.05 1d2b h PHE 12 Cb 0.22 0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.82 1d2b h PHE 12 CO 0.02 -0.19 -0.44 0.00 -2.02 0.00 0.00 178.31 175.67 1d2b h ASN 14 N 0.11 0.35 -4.11 0.00 2.35 -0.65 -3.45 115.58 110.18 1d2b h ASN 14 Ca 0.01 -0.31 -0.47 0.00 -0.55 0.00 0.00 56.30 54.98 1d2b h ASN 14 Cb 0.83 -0.11 0.03 0.00 0.05 0.00 0.00 38.32 39.12 1d2b h ASN 14 CO 0.06 1.15 0.38 -0.55 -1.65 0.00 0.00 177.43 176.82 1d2b s SER 15 N -7.01 6.29 -0.05 5.81 0.15 -1.05 -4.92 113.70 112.93 1d2b s SER 15 Ca -0.04 1.86 0.14 0.00 0.70 0.00 0.00 55.95 58.62 1d2b s SER 15 Cb 0.09 -2.55 0.44 0.00 -1.71 0.00 0.00 66.02 62.29 1d2b s SER 15 CO 0.85 -0.81 1.37 0.47 1.20 0.00 0.00 173.24 176.31 1d2b n ASP 16 N -1.20 3.47 -3.32 5.45 9.92 -1.25 -4.86 116.55 124.75 1d2b n ASP 16 Ca 0.09 -2.27 0.03 0.00 -0.53 0.00 0.00 54.79 52.10 1d2b n ASP 16 Cb 0.53 -0.37 -0.03 0.00 -0.64 0.00 0.00 41.12 40.62 1d2b n ASP 16 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1d2b s LEU 17 N -1.49 -0.97 -0.07 0.64 1.43 0.38 -4.43 118.68 114.18 1d2b s LEU 17 Ca 0.33 0.91 0.00 0.00 -1.03 0.00 0.00 54.13 54.34 1d2b s LEU 17 Cb 0.21 1.94 0.02 0.00 0.03 0.00 0.00 46.19 48.39 1d2b s LEU 17 CO 0.17 -0.18 -0.04 -0.69 0.23 0.00 0.00 176.35 175.84 1d2b s VAL 18 N 2.80 0.63 -0.01 -1.59 1.01 -0.63 0.23 120.40 122.84 1d2b s VAL 18 Ca 0.05 -0.11 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 1d2b s VAL 18 Cb -0.11 -0.69 0.05 0.00 0.00 0.00 0.00 36.38 35.63 1d2b s VAL 18 CO -0.18 0.28 0.55 0.27 0.00 0.00 0.00 175.10 176.02 1d2b s ILE 19 N 1.40 0.02 -0.16 2.22 -0.00 0.98 0.11 121.20 125.76 1d2b s ILE 19 Ca -0.03 -0.18 -0.15 0.00 -0.00 0.00 0.00 60.65 60.29 1d2b s ILE 19 Cb -0.13 -0.91 -0.04 0.00 -0.00 0.00 0.00 42.46 41.37 1d2b s ILE 19 CO -0.03 -0.10 0.34 0.00 -0.00 0.00 0.00 174.94 175.16 1d2b s ARG 20 N -1.65 4.25 0.24 0.37 1.70 0.35 0.48 118.95 124.70 1d2b s ARG 20 Ca -0.10 0.17 -0.22 0.00 -0.47 0.00 0.00 55.73 55.12 1d2b s ARG 20 Cb -0.01 -3.46 0.04 0.00 -0.57 0.00 0.00 34.95 30.95 1d2b s ARG 20 CO 0.05 0.16 0.69 0.00 -1.08 0.00 0.00 175.30 175.11 1d2b s ALA 21 N 0.70 -1.34 0.20 7.88 0.00 -0.34 0.64 121.76 129.49 1d2b s ALA 21 Ca 0.18 -0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.16 1d2b s ALA 21 Cb -0.14 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1d2b s ALA 21 CO 0.06 -0.96 0.06 0.15 0.00 0.00 0.00 175.76 175.07 1d2b s LYS 22 N -3.86 2.59 -0.26 0.00 1.02 0.15 0.50 119.74 119.88 1d2b s LYS 22 Ca 0.08 -1.09 -0.12 0.00 0.02 0.00 0.00 55.97 54.86 1d2b s LYS 22 Cb -0.04 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.79 1d2b s LYS 22 CO 0.01 0.44 0.24 -0.06 -0.92 0.00 0.00 175.35 175.06 1d2b s PHE 23 N -1.88 3.26 -0.29 3.18 0.40 -1.26 0.47 117.98 121.87 1d2b s PHE 23 Ca 0.30 0.26 0.21 0.00 -0.60 0.00 0.00 56.93 57.09 1d2b s PHE 23 Cb -0.09 -2.41 0.49 0.00 0.51 0.00 0.00 43.02 41.52 1d2b s PHE 23 CO 0.21 -0.10 1.07 1.33 0.70 0.00 0.00 175.22 178.42 1d2b n VAL 24 N 4.80 1.12 -3.59 -0.44 0.24 -0.59 -4.69 118.33 115.18 1d2b n VAL 24 Ca -0.13 -2.91 -0.06 0.00 -2.04 0.00 0.00 64.34 59.21 1d2b n VAL 24 Cb 0.52 1.07 -0.02 0.00 -1.47 0.00 0.00 33.84 33.94 1d2b n VAL 24 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1d2b s GLY 25 N -3.46 -0.38 0.22 7.63 0.00 -0.39 -4.69 107.32 106.25 1d2b s GLY 25 Ca 0.27 0.74 0.01 0.00 0.00 0.00 0.00 44.72 45.73 1d2b s GLY 25 CO -0.01 0.23 0.39 -1.08 0.00 0.00 0.00 173.10 172.63 1d2b s THR 26 N -3.12 5.22 -0.08 0.90 -1.32 -1.26 -4.14 115.64 111.84 1d2b s THR 26 Ca 0.08 -0.54 -0.24 0.00 -1.21 0.00 0.00 61.69 59.78 1d2b s THR 26 Cb -0.01 -3.78 -0.03 0.00 -1.51 0.00 0.00 72.50 67.17 1d2b s THR 26 CO -0.05 -0.25 0.74 -2.16 -2.21 0.00 0.00 174.62 170.69 1d2b s PRO 27 N -3.58 4.42 -0.39 7.08 0.04 -1.25 -4.24 135.00 137.09 1d2b s PRO 27 Ca 0.37 0.94 -0.22 0.00 0.04 0.00 0.00 61.00 62.13 1d2b s PRO 27 Cb -0.10 -3.47 0.01 0.00 0.04 0.00 0.00 34.50 30.98 1d2b s PRO 27 CO 0.30 -0.01 0.72 -1.83 0.04 0.00 0.00 177.00 176.22 1d2b s GLU 28 N 1.04 3.61 -0.49 4.56 -1.05 -0.62 -4.91 118.70 120.83 1d2b s GLU 28 Ca 0.39 0.07 -0.04 0.00 -0.15 0.00 0.00 54.97 55.23 1d2b s GLU 28 Cb -0.18 -3.85 0.13 0.00 -0.44 0.00 0.00 34.13 29.79 1d2b s GLU 28 CO 0.18 -0.88 0.31 0.08 0.95 0.00 0.00 175.26 175.90 1d2b s VAL 29 N 2.97 3.63 0.63 1.83 1.01 -1.26 -3.30 120.40 125.91 1d2b s VAL 29 Ca 0.28 -2.29 -0.11 0.00 0.00 0.00 0.00 61.98 59.85 1d2b s VAL 29 Cb -0.13 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1d2b s VAL 29 CO 0.18 -0.77 1.03 0.21 0.00 0.00 0.00 175.10 175.75 1d2b s ASN 30 N 1.64 6.17 0.00 3.32 2.47 -1.26 -4.94 114.94 122.34 1d2b s ASN 30 Ca 0.11 1.43 0.27 0.00 0.42 0.00 0.00 52.86 55.08 1d2b s ASN 30 Cb -0.22 -2.46 0.86 0.00 -1.45 0.00 0.00 41.25 37.97 1d2b s ASN 30 CO -0.03 -0.91 1.66 0.00 -3.72 0.00 0.00 177.10 174.09 1d2b n GLN 31 N -2.78 0.09 -2.81 0.43 1.13 -1.26 -4.05 117.38 108.13 1d2b n GLN 31 Ca 0.06 -0.04 -0.01 0.00 -1.94 0.00 0.00 57.00 55.08 1d2b n GLN 31 Cb 0.54 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.45 1d2b n GLN 31 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1d2b n THR 32 N -1.42 1.15 -0.08 5.09 -1.04 -1.26 -4.81 114.28 111.90 1d2b n THR 32 Ca 0.07 -2.77 -0.14 0.00 -2.04 0.00 0.00 64.05 59.17 1d2b n THR 32 Cb 0.33 1.24 -0.06 0.00 -1.82 0.00 0.00 70.33 70.02 1d2b n THR 32 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1d2b n THR 33 N -0.64 0.88 0.00 12.58 5.66 -1.26 -4.97 114.28 126.53 1d2b n THR 33 Ca 0.05 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 1d2b n THR 33 Cb 0.81 -1.43 0.00 0.00 -1.55 0.00 0.00 70.33 68.16 1d2b n THR 33 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1d2b n LEU 34 N -3.39 0.00 0.00 1.09 4.77 -1.26 -4.85 117.00 113.35 1d2b n LEU 34 Ca -0.30 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.51 1d2b n LEU 34 Cb 0.75 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.77 1d2b n LEU 34 CO 0.07 0.00 -0.05 0.00 -1.33 0.00 0.00 177.39 176.08 1d2b n TYR 35 N -2.00 -0.86 -3.62 -1.77 0.18 -1.26 0.91 117.16 108.74 1d2b n TYR 35 Ca 0.00 -2.59 -0.10 0.00 1.88 0.00 0.00 57.90 57.09 1d2b n TYR 35 Cb 0.00 0.32 -0.03 0.00 -0.38 0.00 0.00 39.34 39.24 1d2b n TYR 35 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1d2b s GLN 36 N -3.20 1.28 0.16 -3.48 -0.21 0.42 -4.09 119.66 110.55 1d2b s GLN 36 Ca 0.36 -0.70 0.06 0.00 0.02 0.00 0.00 55.36 55.10 1d2b s GLN 36 Cb 0.01 0.53 -0.04 0.00 1.00 0.00 0.00 33.01 34.51 1d2b s GLN 36 CO 0.26 -0.54 -0.13 -0.98 -2.12 0.00 0.00 175.29 171.78 1d2b s ARG 37 N -3.82 1.15 0.07 2.91 1.70 -1.21 -1.44 118.95 118.31 1d2b s ARG 37 Ca 0.05 -1.45 0.04 0.00 -0.47 0.00 0.00 55.73 53.89 1d2b s ARG 37 Cb -0.00 -0.88 -0.03 0.00 -0.57 0.00 0.00 34.95 33.47 1d2b s ARG 37 CO -0.08 0.14 -0.11 0.71 -1.08 0.00 0.00 175.30 174.88 1d2b s TYR 38 N -2.90 0.98 -0.15 5.89 2.02 -0.60 -1.59 117.35 120.99 1d2b s TYR 38 Ca 0.17 -0.52 -0.05 0.00 -0.37 0.00 0.00 57.07 56.30 1d2b s TYR 38 Cb -0.00 -0.56 -0.04 0.00 -0.40 0.00 0.00 41.96 40.96 1d2b s TYR 38 CO 0.03 -0.01 0.04 -2.00 -1.57 0.00 0.00 175.55 172.04 1d2b s GLU 39 N -1.91 3.63 -0.00 -0.62 2.12 -1.26 -1.56 118.70 119.10 1d2b s GLU 39 Ca -0.03 -0.37 -0.00 0.00 0.36 0.00 0.00 54.97 54.92 1d2b s GLU 39 Cb -0.08 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.25 1d2b s GLU 39 CO 0.01 0.42 0.01 0.96 -0.54 0.00 0.00 175.26 176.12 1d2b s ILE 40 N -0.06 -0.00 -1.13 -3.70 -4.36 0.22 -1.26 121.20 110.90 1d2b s ILE 40 Ca 0.05 0.02 -0.22 0.00 -0.26 0.00 0.00 60.65 60.24 1d2b s ILE 40 Cb -0.12 -0.02 -0.03 0.00 1.25 0.00 0.00 42.46 43.53 1d2b s ILE 40 CO 0.01 0.01 1.85 -0.75 0.24 0.00 0.00 174.94 176.30 1d2b s LYS 41 N 0.08 2.93 -0.04 0.37 2.47 1.68 -4.66 119.74 122.57 1d2b s LYS 41 Ca -0.01 -1.15 -0.32 0.00 -1.56 0.00 0.00 55.97 52.94 1d2b s LYS 41 Cb -0.01 -5.28 -0.10 0.00 -1.46 0.00 0.00 37.83 30.98 1d2b s LYS 41 CO -0.00 -3.31 1.97 -0.12 0.16 0.00 0.00 175.35 174.04 1d2b n MET 42 N 8.49 2.48 -0.01 4.03 0.00 -1.26 0.30 117.12 131.16 1d2b n MET 42 Ca 0.43 0.89 -0.00 0.00 -0.00 0.00 0.00 57.70 59.02 1d2b n MET 42 Cb 0.47 -2.87 -0.00 0.00 0.00 0.00 0.00 33.22 30.82 1d2b n MET 42 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 1d2b h THR 43 N 5.72 0.00 -2.84 1.12 2.02 -0.13 -3.47 112.91 115.34 1d2b h THR 43 Ca -0.48 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 66.44 1d2b h THR 43 Cb 1.26 0.00 -0.20 0.00 -1.74 0.00 0.00 68.15 67.47 1d2b h THR 43 CO 0.95 0.00 -0.18 -0.75 0.37 0.00 0.00 175.52 175.91 1d2b s LYS 44 N -1.14 0.75 -0.14 6.66 2.47 0.49 -4.99 119.74 123.85 1d2b s LYS 44 Ca -0.01 -0.12 -0.14 0.00 -1.56 0.00 0.00 55.97 54.14 1d2b s LYS 44 Cb 0.00 0.34 -0.05 0.00 -1.46 0.00 0.00 37.83 36.67 1d2b s LYS 44 CO 0.02 -0.22 0.31 0.00 0.16 0.00 0.00 175.35 175.62 1d2b s MET 45 N -1.37 4.19 -0.18 4.03 0.23 -1.26 0.13 119.30 125.08 1d2b s MET 45 Ca -0.13 0.13 0.16 0.00 -1.03 0.00 0.00 55.69 54.83 1d2b s MET 45 Cb -0.04 -3.40 0.44 0.00 -1.53 0.00 0.00 34.83 30.30 1d2b s MET 45 CO 0.05 0.30 1.32 0.66 -2.03 0.00 0.00 175.02 175.32 1d2b n TYR 46 N 3.36 0.58 0.00 3.16 4.02 0.30 -4.93 117.16 123.65 1d2b n TYR 46 Ca -0.12 -1.05 0.00 0.00 -0.01 0.00 0.00 57.90 56.72 1d2b n TYR 46 Cb 0.52 -0.28 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 1d2b n TYR 46 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1d2b n LYS 47 N -0.96 0.00 0.00 -0.72 3.00 -0.47 -4.78 118.16 114.23 1d2b n LYS 47 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 1d2b n LYS 47 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.84 1d2b n LYS 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1d2b n GLY 48 N 0.00 -0.52 0.32 3.14 0.00 -1.26 -1.60 105.19 105.26 1d2b n GLY 48 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1d2b n GLY 48 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1d2b h PHE 49 N 0.00 -0.66 0.00 1.61 -1.00 -1.92 4.97 116.94 119.94 1d2b h PHE 49 Ca 0.00 0.07 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 1d2b h PHE 49 Cb 0.00 0.40 -0.00 0.00 3.61 0.00 0.00 35.95 39.96 1d2b h PHE 49 CO 0.00 -0.36 -0.14 0.37 -1.61 0.00 0.00 178.31 176.57 1d2b h GLN 50 N -0.06 0.00 0.00 1.51 4.15 -1.96 0.70 115.11 119.45 1d2b h GLN 50 Ca 0.32 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.67 1d2b h GLN 50 Cb 0.56 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 1d2b h GLN 50 CO -0.77 0.14 -0.48 0.00 -1.93 0.00 0.00 178.83 175.80 1d2b h ALA 51 N 1.86 0.08 -1.24 3.38 0.00 -0.42 -3.45 119.26 119.46 1d2b h ALA 51 Ca -0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 54.91 54.07 1d2b h ALA 51 Cb 0.26 0.32 -0.20 0.00 0.00 0.00 0.00 17.79 18.17 1d2b h ALA 51 CO 0.02 0.31 -0.57 -0.48 0.00 0.00 0.00 179.25 178.52 1d2b s LEU 52 N -8.18 -0.96 -0.44 0.00 0.05 1.58 -4.99 118.68 105.73 1d2b s LEU 52 Ca -0.17 -1.90 0.03 0.00 0.05 0.00 0.00 54.13 52.14 1d2b s LEU 52 Cb 0.01 1.50 0.46 0.00 -2.05 0.00 0.00 46.19 46.10 1d2b s LEU 52 CO 0.43 -0.08 1.53 0.61 -0.55 0.00 0.00 176.35 178.29 1d2b n GLY 53 N 3.03 6.19 1.29 -3.48 0.00 0.21 -3.66 105.19 108.78 1d2b n GLY 53 Ca 0.19 -2.53 0.00 0.00 0.00 0.00 0.00 46.02 43.69 1d2b n GLY 53 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d2b n ASP 54 N -0.79 0.41 0.00 1.61 5.75 -1.26 -4.94 116.55 117.33 1d2b n ASP 54 Ca 0.52 0.13 0.00 0.00 -0.01 0.00 0.00 54.79 55.42 1d2b n ASP 54 Cb 0.84 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 1d2b n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1d2b n ALA 55 N -3.03 0.00 -2.17 2.12 0.00 -1.26 -4.91 120.51 111.25 1d2b n ALA 55 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1d2b n ALA 55 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 1d2b n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d2b n ALA 56 N 0.00 6.22 -1.00 0.00 0.00 -1.26 -4.87 120.51 119.59 1d2b n ALA 56 Ca 0.00 -4.27 0.00 0.00 0.00 0.00 0.00 53.44 49.17 1d2b n ALA 56 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1d2b n ALA 56 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1d2b n ASP 57 N -0.42 0.00 -3.70 0.00 5.75 -1.24 -4.62 116.55 112.32 1d2b n ASP 57 Ca 0.50 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 55.13 1d2b n ASP 57 Cb 0.29 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.23 1d2b n ASP 57 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1d2b s ILE 58 N 0.00 -0.17 -0.02 2.12 1.09 -1.26 -4.99 121.20 117.97 1d2b s ILE 58 Ca 0.00 0.26 0.04 0.00 -1.10 0.00 0.00 60.65 59.86 1d2b s ILE 58 Cb 0.00 -0.29 -0.07 0.00 -1.06 0.00 0.00 42.46 41.04 1d2b s ILE 58 CO 0.00 0.11 0.10 0.54 -0.10 0.00 0.00 174.94 175.59 1d2b n ARG 59 N 4.80 0.40 -4.35 2.79 1.74 -1.26 -4.55 116.66 116.23 1d2b n ARG 59 Ca -0.15 -0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 56.70 1d2b n ARG 59 Cb 0.51 -1.09 -0.15 0.00 -1.02 0.00 0.00 32.46 30.71 1d2b n ARG 59 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1d2b s PHE 60 N -2.26 0.81 -0.17 -1.55 0.40 -1.26 0.73 117.98 114.67 1d2b s PHE 60 Ca -0.01 -0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1d2b s PHE 60 Cb 0.03 -0.54 -0.02 0.00 0.51 0.00 0.00 43.02 43.00 1d2b s PHE 60 CO 0.18 -0.04 -0.08 0.14 0.70 0.00 0.00 175.22 176.13 1d2b s VAL 61 N -0.08 3.35 -0.36 -0.44 -7.23 -0.60 -4.16 120.40 110.88 1d2b s VAL 61 Ca 0.01 -0.53 -0.08 0.00 -1.81 0.00 0.00 61.98 59.57 1d2b s VAL 61 Cb -0.05 -2.46 0.05 0.00 0.56 0.00 0.00 36.38 34.48 1d2b s VAL 61 CO -0.00 0.48 0.16 -0.31 -0.31 0.00 0.00 175.10 175.12 1d2b s TYR 62 N 0.75 3.28 0.02 2.82 1.51 0.22 -1.56 117.35 124.40 1d2b s TYR 62 Ca -0.03 -1.40 0.04 0.00 -1.01 0.00 0.00 57.07 54.67 1d2b s TYR 62 Cb -0.15 -2.47 -0.03 0.00 -0.11 0.00 0.00 41.96 39.19 1d2b s TYR 62 CO 0.02 -0.75 -0.07 -0.08 -1.11 0.00 0.00 175.55 173.55 1d2b s THR 63 N 1.42 3.58 0.55 -0.71 -1.32 -0.52 -2.90 115.64 115.75 1d2b s THR 63 Ca 0.00 -0.88 -0.20 0.00 -1.21 0.00 0.00 61.69 59.40 1d2b s THR 63 Cb -0.20 -2.58 -0.05 0.00 -1.51 0.00 0.00 72.50 68.16 1d2b s THR 63 CO 0.03 0.34 1.21 -2.84 -2.21 0.00 0.00 174.62 171.14 1d2b s PRO 64 N -1.57 3.23 -0.24 7.08 0.02 -1.26 0.16 135.00 142.42 1d2b s PRO 64 Ca 0.18 1.83 0.14 0.00 0.02 0.00 0.00 61.00 63.17 1d2b s PRO 64 Cb -0.11 -2.09 0.62 0.00 0.02 0.00 0.00 34.50 32.95 1d2b s PRO 64 CO 0.09 -1.00 1.57 0.00 -0.33 0.00 0.00 177.00 177.33 1d2b n ALA 65 N -1.23 3.68 -0.74 -1.55 0.00 5.49 -4.21 120.51 121.95 1d2b n ALA 65 Ca 0.12 -2.38 -0.28 0.00 0.00 0.00 0.00 53.44 50.90 1d2b n ALA 65 Cb 0.49 -0.91 0.24 0.00 0.00 0.00 0.00 19.45 19.27 1d2b n ALA 65 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1d2b s MET 66 N -2.92 -0.72 0.00 0.00 -1.94 -0.96 -4.68 119.30 108.07 1d2b s MET 66 Ca 0.48 0.64 0.00 0.00 -1.71 0.00 0.00 55.69 55.10 1d2b s MET 66 Cb 0.39 -1.59 0.00 0.00 2.01 0.00 0.00 34.83 35.63 1d2b s MET 66 CO 0.10 -3.54 0.93 -1.91 -0.01 0.00 0.00 175.02 170.59 1d2b n GLU 67 N -4.76 0.00 -2.43 2.03 2.13 -1.26 -3.79 120.64 112.56 1d2b n GLU 67 Ca 0.04 0.55 -0.33 0.00 0.66 0.00 0.00 57.16 58.07 1d2b n GLU 67 Cb 0.56 -1.43 0.01 0.00 0.27 0.00 0.00 31.44 30.84 1d2b n GLU 67 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1d2b n SER 68 N -2.01 6.00 -4.97 4.31 3.41 -1.26 -5.03 113.62 114.06 1d2b n SER 68 Ca 0.00 -3.74 -0.21 0.00 -0.26 0.00 0.00 58.87 54.66 1d2b n SER 68 Cb 0.00 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 1d2b n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1d2b s VAL 69 N -4.97 4.17 -1.20 -3.33 0.11 -1.25 -4.60 120.40 109.33 1d2b s VAL 69 Ca 0.48 -0.77 -0.05 0.00 -2.93 0.00 0.00 61.98 58.71 1d2b s VAL 69 Cb 0.35 -3.49 0.21 0.00 -1.53 0.00 0.00 36.38 31.92 1d2b s VAL 69 CO -0.24 -0.26 1.95 0.00 -3.33 0.00 0.00 175.10 173.23 1d2b n GLY 71 N 1.58 -0.31 2.77 0.00 0.00 -1.26 -2.86 105.19 105.12 1d2b n GLY 71 Ca 0.46 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.43 1d2b n GLY 71 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1d2b s TYR 72 N 0.00 -0.95 -0.56 1.61 5.04 -1.26 -2.79 117.35 118.44 1d2b s TYR 72 Ca 0.00 -0.22 -0.27 0.00 -2.44 0.00 0.00 57.07 54.14 1d2b s TYR 72 Cb 0.00 0.19 -0.02 0.00 0.35 0.00 0.00 41.96 42.48 1d2b s TYR 72 CO 0.00 -0.73 1.80 -0.06 -1.34 0.00 0.00 175.55 175.22 1d2b s PHE 73 N 1.15 1.76 -0.29 4.97 0.08 -1.26 -4.93 117.98 119.45 1d2b s PHE 73 Ca 0.24 0.72 -0.10 0.00 0.12 0.00 0.00 56.93 57.92 1d2b s PHE 73 Cb 0.05 -4.13 -0.03 0.00 -0.57 0.00 0.00 43.02 38.35 1d2b s PHE 73 CO -0.09 -2.38 0.15 -1.58 -0.10 0.00 0.00 175.22 171.22 1d2b s HIS 74 N 8.35 3.17 -0.25 0.36 5.65 -1.26 -4.93 115.29 126.38 1d2b s HIS 74 Ca 0.68 -0.29 0.11 0.00 0.25 0.00 0.00 55.06 55.80 1d2b s HIS 74 Cb -0.14 -2.35 0.45 0.00 -1.18 0.00 0.00 32.58 29.37 1d2b s HIS 74 CO 0.23 -0.33 1.19 0.54 -0.65 0.00 0.00 174.74 175.72 1d2b n ARG 75 N 5.01 2.75 -3.75 2.88 3.00 -1.26 -4.96 116.66 120.32 1d2b n ARG 75 Ca -0.14 -3.79 -0.35 0.00 -0.01 0.00 0.00 57.85 53.56 1d2b n ARG 75 Cb 0.51 -1.94 -0.10 0.00 0.00 0.00 0.00 32.46 30.93 1d2b n ARG 75 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1d2b s SER 76 N -3.46 5.22 -0.98 0.55 0.01 -1.26 -4.98 113.70 108.80 1d2b s SER 76 Ca 0.44 -3.18 -0.03 0.00 1.31 0.00 0.00 55.95 54.49 1d2b s SER 76 Cb 0.39 -1.81 0.28 0.00 0.21 0.00 0.00 66.02 65.08 1d2b s SER 76 CO -0.01 -0.28 1.17 0.00 0.41 0.00 0.00 173.24 174.54 1d2b n HIS 77 N 3.00 3.35 -1.77 2.43 1.44 -1.26 -4.83 115.22 117.59 1d2b n HIS 77 Ca 0.12 -3.35 0.00 0.00 -2.01 0.00 0.00 57.72 52.47 1d2b n HIS 77 Cb 0.36 -1.19 0.00 0.00 0.12 0.00 0.00 29.99 29.29 1d2b n HIS 77 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1d2b n ASN 78 N 1.63 0.00 0.00 4.39 5.15 -1.26 -5.10 115.26 120.06 1d2b n ASN 78 Ca 0.26 -0.11 0.00 0.00 -0.60 0.00 0.00 54.58 54.13 1d2b n ASN 78 Cb 0.36 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.61 1d2b n ASN 78 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1d2b n ARG 79 N -0.11 0.00 -2.09 1.20 3.00 -1.26 -4.88 116.66 112.52 1d2b n ARG 79 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 57.85 57.48 1d2b n ARG 79 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.49 1d2b n ARG 79 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1d2b n SER 80 N -0.78 6.65 -4.28 0.55 2.88 -1.26 -4.96 113.62 112.42 1d2b n SER 80 Ca 0.00 -3.80 -0.41 0.00 -1.33 0.00 0.00 58.87 53.33 1d2b n SER 80 Cb 0.00 -0.88 -0.09 0.00 -0.75 0.00 0.00 64.21 62.49 1d2b n SER 80 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1d2b s GLU 81 N -3.91 2.64 0.48 -1.46 2.12 -1.26 -5.08 118.70 112.23 1d2b s GLU 81 Ca 0.51 -1.50 -0.20 0.00 0.36 0.00 0.00 54.97 54.14 1d2b s GLU 81 Cb 0.43 -3.86 -0.09 0.00 0.26 0.00 0.00 34.13 30.87 1d2b s GLU 81 CO -0.35 -1.01 0.99 -1.83 -0.54 0.00 0.00 175.26 172.53 1d2b s GLU 82 N 1.45 3.96 0.40 4.30 -1.05 -1.26 -4.54 118.70 121.95 1d2b s GLU 82 Ca 0.04 1.18 0.03 0.00 -0.15 0.00 0.00 54.97 56.07 1d2b s GLU 82 Cb -0.24 -2.13 -0.03 0.00 -0.44 0.00 0.00 34.13 31.29 1d2b s GLU 82 CO 0.02 -0.27 0.10 -0.06 0.95 0.00 0.00 175.26 176.00 1d2b s PHE 83 N -2.22 1.84 -0.12 4.83 0.08 0.18 -3.78 117.98 118.80 1d2b s PHE 83 Ca 0.63 -1.16 0.03 0.00 0.12 0.00 0.00 56.93 56.55 1d2b s PHE 83 Cb -0.12 -1.25 0.01 0.00 -0.57 0.00 0.00 43.02 41.09 1d2b s PHE 83 CO 0.20 -0.16 -0.23 -1.17 -0.10 0.00 0.00 175.22 173.77 1d2b s LEU 84 N -3.61 2.09 -0.24 -0.37 1.98 0.88 -1.20 118.68 118.20 1d2b s LEU 84 Ca 0.25 -0.58 -0.01 0.00 -2.89 0.00 0.00 54.13 50.90 1d2b s LEU 84 Cb 0.04 -1.42 0.07 0.00 0.66 0.00 0.00 46.19 45.55 1d2b s LEU 84 CO 0.13 0.11 0.02 -0.63 -1.89 0.00 0.00 176.35 174.09 1d2b s ILE 85 N 0.60 1.08 -0.26 6.68 1.01 0.18 -2.06 121.20 128.42 1d2b s ILE 85 Ca -0.12 -1.10 -0.16 0.00 0.00 0.00 0.00 60.65 59.27 1d2b s ILE 85 Cb -0.17 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 1d2b s ILE 85 CO 0.03 -0.30 0.43 0.00 0.00 0.00 0.00 174.94 175.11 1d2b s ALA 86 N 1.58 3.58 -0.29 9.38 0.00 0.10 -0.02 121.76 136.09 1d2b s ALA 86 Ca 0.00 -0.72 -0.20 0.00 0.00 0.00 0.00 51.96 51.04 1d2b s ALA 86 Cb -0.18 -2.79 0.14 0.00 0.00 0.00 0.00 23.12 20.29 1d2b s ALA 86 CO -0.11 -0.69 1.01 0.20 0.00 0.00 0.00 175.76 176.17 1d2b s GLY 87 N 1.59 -0.05 0.44 0.00 0.00 0.63 -4.23 107.32 105.70 1d2b s GLY 87 Ca 0.18 2.97 -0.11 0.00 0.00 0.00 0.00 44.72 47.75 1d2b s GLY 87 CO 0.10 2.27 0.82 1.25 0.00 0.00 0.00 173.10 177.54 1d2b s LYS 88 N 0.86 3.78 0.44 2.90 2.36 -1.23 0.14 119.74 129.00 1d2b s LYS 88 Ca -0.04 0.54 -0.21 0.00 -2.55 0.00 0.00 55.97 53.72 1d2b s LYS 88 Cb -0.04 -2.33 -0.10 0.00 -1.05 0.00 0.00 37.83 34.30 1d2b s LYS 88 CO -0.12 -0.12 0.98 -0.51 1.55 0.00 0.00 175.35 177.13 1d2b s LEU 89 N -4.02 3.94 -0.22 5.43 1.43 -1.26 -1.19 118.68 122.78 1d2b s LEU 89 Ca 0.52 1.77 -0.01 0.00 -1.03 0.00 0.00 54.13 55.38 1d2b s LEU 89 Cb -0.10 -4.52 0.06 0.00 0.03 0.00 0.00 46.19 41.67 1d2b s LEU 89 CO 0.33 -0.47 0.01 -1.58 0.23 0.00 0.00 176.35 174.88 1d2b s GLN 90 N -3.13 1.00 -0.41 1.70 2.00 0.46 -4.80 119.66 116.47 1d2b s GLN 90 Ca 0.63 -0.70 0.00 0.00 -2.00 0.00 0.00 55.36 53.28 1d2b s GLN 90 Cb -0.12 -2.27 0.00 0.00 0.80 0.00 0.00 33.01 31.42 1d2b s GLN 90 CO 0.16 -0.67 0.00 -0.25 -0.50 0.00 0.00 175.29 174.03 1d2b n ASP 91 N 4.89 -2.11 0.00 6.67 8.00 -1.26 -0.73 116.55 132.01 1d2b n ASP 91 Ca -0.09 0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.78 1d2b n ASP 91 Cb 0.45 -1.89 0.00 0.00 -0.02 0.00 0.00 41.12 39.66 1d2b n ASP 91 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d2b n GLY 92 N -0.60 3.43 3.85 0.44 0.00 -1.26 -5.10 105.19 105.95 1d2b n GLY 92 Ca -0.06 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.71 1d2b n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2b s LEU 93 N 0.00 3.62 0.63 0.99 2.01 0.09 -4.96 118.68 121.07 1d2b s LEU 93 Ca 0.00 1.47 -0.15 0.00 0.01 0.00 0.00 54.13 55.46 1d2b s LEU 93 Cb 0.00 -4.41 -0.02 0.00 0.01 0.00 0.00 46.19 41.77 1d2b s LEU 93 CO 0.00 -0.58 1.08 -0.22 1.01 0.00 0.00 176.35 177.64 1d2b s LEU 94 N -4.14 3.42 -0.02 1.79 2.96 -1.26 0.17 118.68 121.61 1d2b s LEU 94 Ca 0.57 1.87 0.02 0.00 -0.22 0.00 0.00 54.13 56.37 1d2b s LEU 94 Cb -0.10 -4.54 0.01 0.00 0.50 0.00 0.00 46.19 42.06 1d2b s LEU 94 CO 0.33 -1.38 -0.05 -1.00 -1.32 0.00 0.00 176.35 172.93 1d2b s HIS 95 N -2.46 0.56 -0.01 5.38 3.76 -0.33 0.69 115.29 122.88 1d2b s HIS 95 Ca 0.64 -0.11 0.05 0.00 -0.15 0.00 0.00 55.06 55.49 1d2b s HIS 95 Cb -0.18 -0.42 -0.01 0.00 1.11 0.00 0.00 32.58 33.08 1d2b s HIS 95 CO 0.40 -0.06 -0.17 0.42 -0.85 0.00 0.00 174.74 174.48 1d2b s ILE 96 N 0.23 1.32 0.01 0.60 -1.09 -1.14 -3.47 121.20 117.66 1d2b s ILE 96 Ca -0.02 -0.76 0.01 0.00 -2.23 0.00 0.00 60.65 57.65 1d2b s ILE 96 Cb -0.06 -1.11 -0.01 0.00 -1.58 0.00 0.00 42.46 39.70 1d2b s ILE 96 CO -0.00 0.34 -0.03 0.42 -1.23 0.00 0.00 174.94 174.43 1d2b s THR 97 N -0.44 0.22 -0.92 2.92 -4.23 -1.12 -4.30 115.64 107.78 1d2b s THR 97 Ca 0.06 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.11 1d2b s THR 97 Cb -0.07 -0.26 0.00 0.00 1.34 0.00 0.00 72.50 73.52 1d2b s THR 97 CO -0.00 -0.16 0.78 0.35 -0.54 0.00 0.00 174.62 175.05 1d2b n THR 98 N 2.41 1.21 -1.49 3.99 -2.24 -1.13 0.12 114.28 117.15 1d2b n THR 98 Ca -0.17 0.40 -0.02 0.00 -2.27 0.00 0.00 64.05 61.99 1d2b n THR 98 Cb 0.57 -1.40 0.20 0.00 -2.10 0.00 0.00 70.33 67.61 1d2b n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1d2b s SER 100 N -2.70 4.27 -0.55 0.00 0.15 0.32 -4.74 113.70 110.44 1d2b s SER 100 Ca 0.43 -0.67 -0.28 0.00 0.70 0.00 0.00 55.95 56.13 1d2b s SER 100 Cb 0.40 -0.71 0.02 0.00 -1.71 0.00 0.00 66.02 64.02 1d2b s SER 100 CO -0.02 0.05 1.29 0.12 1.20 0.00 0.00 173.24 175.88 1d2b s PHE 101 N -2.07 2.49 -0.26 3.44 2.19 -1.26 -4.66 117.98 117.85 1d2b s PHE 101 Ca 0.28 0.48 -0.02 0.00 0.33 0.00 0.00 56.93 58.00 1d2b s PHE 101 Cb -0.07 -4.45 0.12 0.00 -1.31 0.00 0.00 43.02 37.30 1d2b s PHE 101 CO 0.17 -1.74 0.26 0.08 1.83 0.00 0.00 175.22 175.82 1d2b s VAL 102 N 5.35 -0.35 0.27 3.12 1.01 -1.26 -0.72 120.40 127.81 1d2b s VAL 102 Ca 0.48 -0.36 -0.21 0.00 0.00 0.00 0.00 61.98 61.89 1d2b s VAL 102 Cb -0.09 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.44 1d2b s VAL 102 CO 0.26 -0.38 0.69 0.00 0.00 0.00 0.00 175.10 175.67 1d2b s ALA 103 N 2.33 -1.18 0.13 5.51 0.00 -0.88 -5.00 121.76 122.68 1d2b s ALA 103 Ca 0.09 -0.29 -0.34 0.00 0.00 0.00 0.00 51.96 51.41 1d2b s ALA 103 Cb -0.15 0.87 -0.14 0.00 0.00 0.00 0.00 23.12 23.70 1d2b s ALA 103 CO -0.25 -1.01 1.61 -2.30 0.00 0.00 0.00 175.76 173.82 1d2b n PRO 104 N -0.45 2.15 0.00 0.00 -0.02 -1.26 -0.09 135.00 135.34 1d2b n PRO 104 Ca -0.05 0.78 -0.10 0.00 -2.02 0.00 0.00 63.50 62.11 1d2b n PRO 104 Cb 0.60 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 1d2b n PRO 104 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 1d2b h TRP 105 N 6.33 -0.64 0.00 6.00 2.91 -1.76 0.12 115.95 128.91 1d2b h TRP 105 Ca -0.45 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.60 1d2b h TRP 105 Cb 1.26 0.30 0.00 0.00 -0.51 0.00 0.00 29.16 30.21 1d2b h TRP 105 CO 0.66 -0.32 0.28 0.09 -1.03 0.00 0.00 178.44 178.12 1d2b n ASN 106 N -5.37 0.00 -0.00 2.65 3.02 -1.26 0.17 115.26 114.47 1d2b n ASN 106 Ca -0.03 0.20 0.09 0.00 -0.03 0.00 0.00 54.58 54.81 1d2b n ASN 106 Cb 0.28 -0.20 -0.11 0.00 -0.61 0.00 0.00 39.78 39.13 1d2b n ASN 106 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1d2b n SER 107 N -1.19 0.82 -4.80 6.41 2.88 0.40 -4.98 113.62 113.16 1d2b n SER 107 Ca 0.00 -0.74 -0.34 0.00 -1.33 0.00 0.00 58.87 56.46 1d2b n SER 107 Cb 0.28 1.18 -0.04 0.00 -0.75 0.00 0.00 64.21 64.88 1d2b n SER 107 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1d2b s LEU 108 N -3.18 3.89 0.58 2.46 1.02 0.44 -5.01 118.68 118.88 1d2b s LEU 108 Ca 0.04 1.90 -0.20 0.00 0.02 0.00 0.00 54.13 55.89 1d2b s LEU 108 Cb 0.14 -4.52 -0.04 0.00 0.02 0.00 0.00 46.19 41.79 1d2b s LEU 108 CO 0.77 -0.69 1.32 -1.20 0.02 0.00 0.00 176.35 176.57 1d2b n SER 109 N -0.82 2.41 0.05 2.29 7.64 -1.26 -4.68 113.62 119.24 1d2b n SER 109 Ca 0.08 0.93 0.08 0.00 1.01 0.00 0.00 58.87 60.97 1d2b n SER 109 Cb 0.52 -1.56 0.52 0.00 -1.01 0.00 0.00 64.21 62.68 1d2b n SER 109 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 1d2b h LEU 110 N 1.11 0.29 0.11 -3.43 -0.00 -1.95 3.52 115.31 114.96 1d2b h LEU 110 Ca -0.51 -0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.06 1d2b h LEU 110 Cb 1.32 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.90 1d2b h LEU 110 CO 0.55 0.20 -1.57 0.00 -0.00 0.00 0.00 178.44 177.62 1d2b h ALA 111 N 1.80 0.31 -0.01 0.17 0.00 -1.97 -1.88 119.26 117.68 1d2b h ALA 111 Ca 0.15 -1.15 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1d2b h ALA 111 Cb 0.18 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1d2b h ALA 111 CO -0.03 1.18 -0.04 0.94 0.00 0.00 0.00 179.25 181.30 1d2b n GLN 112 N -3.43 1.25 0.01 0.00 7.27 -0.35 0.28 117.38 122.41 1d2b n GLN 112 Ca -0.18 -0.53 -0.21 0.00 0.07 0.00 0.00 57.00 56.15 1d2b n GLN 112 Cb 1.04 -1.49 -0.14 0.00 2.41 0.00 0.00 30.24 32.06 1d2b n GLN 112 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1d2b h ARG 113 N 1.30 0.27 0.49 3.69 3.08 0.65 -3.06 114.38 120.81 1d2b h ARG 113 Ca 0.00 -0.46 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 1d2b h ARG 113 Cb 0.33 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1d2b h ARG 113 CO 0.00 1.21 -0.24 -0.09 -1.07 0.00 0.00 179.97 179.78 1d2b h ARG 114 N 0.07 -0.64 -0.98 0.04 1.12 -0.41 -3.05 114.38 110.54 1d2b h ARG 114 Ca -0.42 0.04 0.32 0.00 -1.11 0.00 0.00 59.98 58.81 1d2b h ARG 114 Cb 2.04 0.15 -0.15 0.00 -0.01 0.00 0.00 29.97 31.99 1d2b h ARG 114 CO 0.10 -0.36 0.48 0.78 -3.11 0.00 0.00 179.97 177.86 1d2b h GLY 115 N -1.09 1.94 2.00 2.80 0.00 0.38 1.75 103.07 110.84 1d2b h GLY 115 Ca -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1d2b h GLY 115 CO 0.11 -0.51 0.00 0.74 0.00 0.00 0.00 176.54 176.88 1d2b h PHE 116 N 0.25 0.00 0.00 5.60 -1.00 -1.55 3.32 116.94 123.56 1d2b h PHE 116 Ca 0.71 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.48 1d2b h PHE 116 Cb 1.63 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 41.19 1d2b h PHE 116 CO -0.08 0.00 -0.73 0.00 -1.61 0.00 0.00 178.31 175.90 1d2b h THR 117 N 0.00 0.03 0.00 -1.55 1.03 0.25 -3.44 112.91 109.23 1d2b h THR 117 Ca 0.00 -1.06 0.00 0.00 -0.01 0.00 0.00 66.41 65.34 1d2b h THR 117 Cb 0.69 1.67 0.00 0.00 -1.07 0.00 0.00 68.15 69.45 1d2b h THR 117 CO 0.00 0.02 0.00 2.29 -0.01 0.00 0.00 175.52 177.82 1d2b n LYS 118 N -2.81 0.00 0.01 0.00 2.85 0.14 -5.02 118.16 113.32 1d2b n LYS 118 Ca 0.01 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.38 1d2b n LYS 118 Cb 0.56 -0.40 -0.11 0.00 -0.65 0.00 0.00 35.03 34.42 1d2b n LYS 118 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1d2b n THR 119 N -1.65 0.08 -0.69 0.58 -1.04 1.03 -4.52 114.28 108.07 1d2b n THR 119 Ca 0.00 -0.36 0.09 0.00 -2.04 0.00 0.00 64.05 61.74 1d2b n THR 119 Cb 0.00 0.21 0.36 0.00 -1.82 0.00 0.00 70.33 69.08 1d2b n THR 119 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1d2b n TYR 120 N -2.09 1.57 -0.05 -1.42 4.02 0.32 -2.61 117.16 116.89 1d2b n TYR 120 Ca -0.01 -0.64 0.00 0.00 -0.01 0.00 0.00 57.90 57.24 1d2b n TYR 120 Cb 0.50 -0.29 -0.14 0.00 -0.02 0.00 0.00 39.34 39.38 1d2b n TYR 120 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1d2b n THR 121 N 0.98 0.62 0.00 -0.72 5.66 -1.26 -3.49 114.28 116.06 1d2b n THR 121 Ca 0.26 -0.60 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1d2b n THR 121 Cb 0.94 -0.24 0.00 0.00 -1.55 0.00 0.00 70.33 69.49 1d2b n THR 121 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1d2b n VAL 122 N -2.41 0.00 -2.49 1.08 0.31 -1.26 -4.75 118.33 108.81 1d2b n VAL 122 Ca -0.16 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.14 1d2b n VAL 122 Cb 0.79 -0.22 0.05 0.00 -0.91 0.00 0.00 33.84 33.56 1d2b n VAL 122 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d2b n GLY 123 N 2.72 2.72 3.51 2.92 0.00 -1.07 -5.05 105.19 110.93 1d2b n GLY 123 Ca 0.00 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 1d2b n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2b s GLU 125 N 8.35 2.30 0.00 0.00 -1.05 -1.26 -4.39 118.70 122.65 1d2b s GLU 125 Ca 1.28 -2.34 0.00 0.00 -0.15 0.00 0.00 54.97 53.76 1d2b s GLU 125 Cb -0.94 -3.62 0.00 0.00 -0.44 0.00 0.00 34.13 29.13 1d2b s GLU 125 CO 0.46 -1.13 0.42 -0.85 0.95 0.00 0.00 175.26 175.11