#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8m h SER 2 N 0.00 -1.56 -2.78 1.61 0.87 -2.03 -3.36 113.55 106.30 2d8m h SER 2 Ca 0.00 0.27 -0.57 0.00 -1.23 0.00 0.00 61.79 60.26 2d8m h SER 2 Cb 0.00 0.73 -0.03 0.00 -0.44 0.00 0.00 62.40 62.66 2d8m h SER 2 CO 0.00 -0.31 1.17 -0.94 -0.53 0.00 0.00 176.83 176.22 2d8m s SER 3 N -5.25 6.23 0.00 6.23 1.04 -1.26 -3.94 113.70 116.75 2d8m s SER 3 Ca -0.14 1.48 0.00 0.00 0.48 0.00 0.00 55.95 57.77 2d8m s SER 3 Cb 0.15 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2d8m s SER 3 CO 0.67 -1.40 0.00 0.61 0.98 0.00 0.00 173.24 174.10 2d8m n GLY 4 N 4.92 0.05 0.22 7.32 0.00 -1.26 -4.93 105.19 111.51 2d8m n GLY 4 Ca 0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.22 2d8m n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d8m h SER 5 N 0.00 -0.06 -4.07 1.61 4.64 -1.79 -3.41 113.55 110.47 2d8m h SER 5 Ca 0.00 0.11 -0.52 0.00 -0.47 0.00 0.00 61.79 60.92 2d8m h SER 5 Cb 0.00 0.17 0.09 0.00 -0.31 0.00 0.00 62.40 62.35 2d8m h SER 5 CO 0.00 -0.01 0.47 -0.55 -0.87 0.00 0.00 176.83 175.87 2d8m s SER 6 N -5.28 5.55 0.00 4.97 0.15 -1.25 -5.03 113.70 112.80 2d8m s SER 6 Ca -0.13 2.34 0.00 0.00 0.70 0.00 0.00 55.95 58.86 2d8m s SER 6 Cb 0.17 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 2d8m s SER 6 CO 0.74 -1.35 0.00 0.61 1.20 0.00 0.00 173.24 174.44 2d8m n GLY 7 N 0.41 5.31 3.45 9.45 0.00 -1.26 -4.94 105.19 117.61 2d8m n GLY 7 Ca 0.12 -1.43 -0.15 0.00 0.00 0.00 0.00 46.02 44.56 2d8m n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2d8m s GLU 8 N 3.59 0.77 0.72 1.61 2.02 -1.26 -4.99 118.70 121.16 2d8m s GLU 8 Ca 0.00 0.51 -0.13 0.00 0.02 0.00 0.00 54.97 55.37 2d8m s GLU 8 Cb 0.00 0.36 0.03 0.00 0.10 0.00 0.00 34.13 34.62 2d8m s GLU 8 CO 0.00 -0.16 1.10 -1.25 0.02 0.00 0.00 175.26 174.97 2d8m s PRO 9 N -0.33 2.52 -0.01 0.39 0.04 -1.26 -5.07 135.00 131.28 2d8m s PRO 9 Ca -0.05 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.29 2d8m s PRO 9 Cb -0.03 -1.92 -0.00 0.00 0.04 0.00 0.00 34.50 32.58 2d8m s PRO 9 CO 0.04 -1.45 -0.08 1.03 0.04 0.00 0.00 177.00 176.57 2d8m s ARG 10 N -4.51 0.79 -0.06 4.56 1.81 -1.26 -5.15 118.95 115.14 2d8m s ARG 10 Ca 0.64 -0.29 -0.09 0.00 -1.72 0.00 0.00 55.73 54.26 2d8m s ARG 10 Cb -0.19 -0.76 0.02 0.00 -0.45 0.00 0.00 34.95 33.57 2d8m s ARG 10 CO 0.49 0.15 0.24 -0.98 -0.68 0.00 0.00 175.30 174.51 2d8m s ARG 11 N -0.01 0.40 0.35 3.54 3.03 -1.26 -5.04 118.95 119.95 2d8m s ARG 11 Ca 0.00 0.09 0.14 0.00 2.03 0.00 0.00 55.73 57.99 2d8m s ARG 11 Cb -0.06 0.18 0.63 0.00 -1.03 0.00 0.00 34.95 34.68 2d8m s ARG 11 CO -0.00 -0.08 1.75 -1.00 -1.13 0.00 0.00 175.30 174.84 2d8m h PRO 12 N 5.09 0.00 -6.88 3.89 0.13 -2.05 -3.44 132.00 128.74 2d8m h PRO 12 Ca -0.28 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.37 2d8m h PRO 12 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2d8m h PRO 12 CO 0.37 0.44 0.39 1.03 -0.23 0.00 0.00 178.00 180.00 2d8m s ARG 13 N -3.89 4.49 -0.71 0.86 0.52 -1.26 -4.90 118.95 114.06 2d8m s ARG 13 Ca -0.02 1.49 -0.26 0.00 -0.52 0.00 0.00 55.73 56.42 2d8m s ARG 13 Cb 0.13 -2.84 -0.23 0.00 0.52 0.00 0.00 34.95 32.53 2d8m s ARG 13 CO 0.72 0.16 1.88 0.00 0.02 0.00 0.00 175.30 178.08 2d8m n ALA 14 N 0.57 1.42 -1.00 2.13 0.00 -1.26 -4.89 120.51 117.48 2d8m n ALA 14 Ca 0.02 -2.78 0.00 0.00 0.00 0.00 0.00 53.44 50.68 2d8m n ALA 14 Cb 0.49 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.37 2d8m n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d8m n GLY 15 N 5.36 -2.92 0.00 0.00 0.00 -1.26 -4.75 105.19 101.62 2d8m n GLY 15 Ca 0.46 -1.22 0.08 0.00 0.00 0.00 0.00 46.02 45.33 2d8m n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d8m n PRO 16 N 0.00 0.38 -0.09 1.61 -0.04 -1.26 -3.00 135.00 132.60 2d8m n PRO 16 Ca 0.00 0.06 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 2d8m n PRO 16 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 2d8m n PRO 16 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2d8m h GLU 17 N 0.00 0.71 -0.08 0.54 4.11 -1.92 -1.18 114.58 116.76 2d8m h GLU 17 Ca 0.00 -0.39 -0.01 0.00 0.07 0.00 0.00 59.36 59.03 2d8m h GLU 17 Cb 0.06 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2d8m h GLU 17 CO 0.00 1.00 0.01 1.05 0.07 0.00 0.00 179.01 181.14 2d8m h GLU 18 N 0.45 0.14 0.55 1.06 4.11 -1.83 -2.92 114.58 116.14 2d8m h GLU 18 Ca 0.04 -0.04 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2d8m h GLU 18 Cb 0.89 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.13 2d8m h GLU 18 CO 0.08 0.37 -0.26 -0.07 0.07 0.00 0.00 179.01 179.19 2d8m h LEU 19 N -0.11 -0.62 -1.19 3.06 4.07 -1.71 -2.12 115.31 116.68 2d8m h LEU 19 Ca 0.02 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.98 2d8m h LEU 19 Cb 0.30 0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.21 2d8m h LEU 19 CO 0.00 -0.40 0.42 1.23 -1.08 0.00 0.00 178.44 178.62 2d8m h GLY 20 N -0.81 0.00 1.03 0.83 0.00 0.46 0.81 103.07 105.39 2d8m h GLY 20 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.06 2d8m h GLY 20 CO 0.12 0.00 -1.45 0.50 0.00 0.00 0.00 176.54 175.71 2d8m h LYS 21 N 0.00 0.00 0.56 4.80 1.79 -1.19 -3.32 116.57 119.21 2d8m h LYS 21 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2d8m h LYS 21 Cb 0.84 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.48 2d8m h LYS 21 CO 0.00 0.35 -0.39 0.82 -1.08 0.00 0.00 179.45 179.15 2d8m h ILE 22 N 0.00 0.20 -2.15 1.86 2.04 0.10 -3.18 117.51 116.38 2d8m h ILE 22 Ca -0.19 0.00 -0.73 0.00 1.00 0.00 0.00 64.86 64.94 2d8m h ILE 22 Cb 1.69 0.20 -0.32 0.00 -0.74 0.00 0.00 36.82 37.65 2d8m h ILE 22 CO 0.06 0.00 0.47 0.18 0.00 0.00 0.00 178.15 178.85 2d8m n LEU 23 N -5.52 6.45 -4.62 1.44 4.77 -0.60 -4.89 117.00 114.03 2d8m n LEU 23 Ca -0.12 -5.35 -0.43 0.00 -0.03 0.00 0.00 56.01 50.08 2d8m n LEU 23 Cb 0.41 -0.94 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 2d8m n LEU 23 CO 0.32 2.09 1.05 -1.58 -1.33 0.00 0.00 177.39 177.94 2d8m s GLN 24 N -4.01 3.83 0.00 3.23 -0.44 -1.21 -3.14 119.66 117.93 2d8m s GLN 24 Ca 0.45 0.84 0.00 0.00 -2.50 0.00 0.00 55.36 54.15 2d8m s GLN 24 Cb 0.28 -3.87 0.00 0.00 -1.64 0.00 0.00 33.01 27.78 2d8m s GLN 24 CO -0.19 -1.23 0.00 0.41 0.50 0.00 0.00 175.29 174.78 2d8m n GLY 25 N 4.53 0.70 3.62 2.59 0.00 -1.26 -4.95 105.19 110.42 2d8m n GLY 25 Ca 0.13 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 2d8m n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d8m s VAL 26 N -2.00 3.73 -0.20 1.61 1.01 -1.19 -5.03 120.40 118.34 2d8m s VAL 26 Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2d8m s VAL 26 Cb 0.00 -2.67 0.04 0.00 0.00 0.00 0.00 36.38 33.75 2d8m s VAL 26 CO 0.00 0.30 -0.11 -0.69 0.00 0.00 0.00 175.10 174.60 2d8m s VAL 27 N -1.10 1.67 0.15 2.92 1.01 -1.26 -1.38 120.40 122.40 2d8m s VAL 27 Ca 0.20 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.22 2d8m s VAL 27 Cb -0.11 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2d8m s VAL 27 CO 0.11 0.19 0.13 0.68 0.00 0.00 0.00 175.10 176.22 2d8m s VAL 28 N 1.39 4.55 -0.09 2.92 -7.23 0.12 -2.15 120.40 119.92 2d8m s VAL 28 Ca -0.01 -0.99 0.01 0.00 -1.81 0.00 0.00 61.98 59.18 2d8m s VAL 28 Cb -0.16 -3.30 0.02 0.00 0.56 0.00 0.00 36.38 33.50 2d8m s VAL 28 CO -0.08 -0.06 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.84 2d8m s VAL 29 N -1.68 1.15 -0.27 1.32 1.01 -1.15 -2.65 120.40 118.14 2d8m s VAL 29 Ca 0.31 -0.44 -0.23 0.00 0.00 0.00 0.00 61.98 61.62 2d8m s VAL 29 Cb -0.11 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 2d8m s VAL 29 CO 0.23 0.37 0.75 -0.76 0.00 0.00 0.00 175.10 175.70 2d8m s LEU 30 N 1.07 4.08 -0.05 3.92 1.43 -1.24 -0.09 118.68 127.80 2d8m s LEU 30 Ca -0.07 0.81 0.03 0.00 -1.03 0.00 0.00 54.13 53.87 2d8m s LEU 30 Cb -0.15 -3.04 0.01 0.00 0.03 0.00 0.00 46.19 43.04 2d8m s LEU 30 CO -0.01 -0.50 -0.12 -0.94 0.23 0.00 0.00 176.35 175.01 2d8m s SER 31 N 1.47 1.63 -0.85 2.29 1.04 -0.97 -4.80 113.70 113.52 2d8m s SER 31 Ca 0.31 -0.27 -0.04 0.00 0.48 0.00 0.00 55.95 56.44 2d8m s SER 31 Cb -0.15 -0.59 0.00 0.00 0.10 0.00 0.00 66.02 65.39 2d8m s SER 31 CO 0.09 0.07 0.73 0.61 0.98 0.00 0.00 173.24 175.72 2d8m n GLY 32 N 3.50 -0.04 3.27 7.32 0.00 -1.26 -3.30 105.19 114.67 2d8m n GLY 32 Ca -0.20 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 2d8m n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2d8m s PHE 33 N -3.22 1.67 -0.00 1.61 0.08 -1.26 -4.72 117.98 112.14 2d8m s PHE 33 Ca 0.26 -0.44 -0.00 0.00 0.12 0.00 0.00 56.93 56.87 2d8m s PHE 33 Cb -0.11 -0.91 -0.00 0.00 -0.57 0.00 0.00 43.02 41.43 2d8m s PHE 33 CO 0.47 0.19 0.01 1.14 -0.10 0.00 0.00 175.22 176.93 2d8m s GLN 34 N -1.99 0.03 0.73 0.44 0.00 -1.26 -4.82 119.66 112.79 2d8m s GLN 34 Ca 0.06 -0.02 -0.15 0.00 -0.00 0.00 0.00 55.36 55.25 2d8m s GLN 34 Cb -0.09 0.01 0.04 0.00 0.00 0.00 0.00 33.01 32.97 2d8m s GLN 34 CO 0.04 -0.00 1.21 0.54 0.00 0.00 0.00 175.29 177.07 2d8m s ASN 35 N -0.08 4.17 0.41 12.60 4.22 -1.26 -1.20 114.94 133.80 2d8m s ASN 35 Ca -0.01 2.36 0.20 0.00 -2.14 0.00 0.00 52.86 53.27 2d8m s ASN 35 Cb -0.01 -2.59 0.86 0.00 1.28 0.00 0.00 41.25 40.79 2d8m s ASN 35 CO -0.00 -2.28 1.82 1.55 -2.04 0.00 0.00 177.10 176.16 2d8m h PRO 36 N -0.32 0.00 -0.74 3.55 0.13 -2.01 -3.44 132.00 129.17 2d8m h PRO 36 Ca -0.48 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.80 2d8m h PRO 36 Cb 1.30 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 2d8m h PRO 36 CO 0.50 0.31 -0.19 0.34 -0.23 0.00 0.00 178.00 178.73 2d8m n PHE 37 N -3.65 0.25 -0.13 1.56 7.35 -0.76 0.17 117.46 122.25 2d8m n PHE 37 Ca -0.01 0.91 -0.04 0.00 -0.76 0.00 0.00 57.45 57.55 2d8m n PHE 37 Cb 0.43 -0.92 0.04 0.00 0.35 0.00 0.00 39.48 39.39 2d8m n PHE 37 CO 0.00 0.00 0.00 -0.09 -0.76 0.00 0.00 176.76 175.91 2d8m h ARG 38 N 0.00 0.22 -0.13 -4.13 2.43 -1.45 0.32 114.38 111.64 2d8m h ARG 38 Ca 0.35 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2d8m h ARG 38 Cb 0.53 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2d8m h ARG 38 CO -0.76 0.15 0.07 1.03 -1.51 0.00 0.00 179.97 178.95 2d8m h SER 39 N 0.23 0.17 -0.34 -3.80 0.87 0.15 -0.14 113.55 110.69 2d8m h SER 39 Ca 0.21 -0.08 0.04 0.00 -1.23 0.00 0.00 61.79 60.73 2d8m h SER 39 Cb 0.26 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.14 2d8m h SER 39 CO -0.27 0.20 0.09 -0.08 -0.53 0.00 0.00 176.83 176.24 2d8m h GLU 40 N 0.12 0.21 0.71 2.24 4.57 -0.58 0.17 114.58 122.02 2d8m h GLU 40 Ca 0.05 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 2d8m h GLU 40 Cb 0.07 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2d8m h GLU 40 CO -0.01 0.14 -0.34 -0.07 -1.18 0.00 0.00 179.01 177.55 2d8m h LEU 41 N 0.22 -0.81 -0.60 1.64 3.38 -0.79 -2.04 115.31 116.32 2d8m h LEU 41 Ca 0.16 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.24 2d8m h LEU 41 Cb 0.15 0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 2d8m h LEU 41 CO -0.18 -0.52 0.14 -0.09 0.09 0.00 0.00 178.44 177.87 2d8m h ARG 42 N -1.04 0.27 0.29 1.13 2.43 -0.89 0.68 114.38 117.25 2d8m h ARG 42 Ca -0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2d8m h ARG 42 Cb 0.75 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 2d8m h ARG 42 CO 0.16 0.18 -0.49 -0.44 -1.51 0.00 0.00 179.97 177.87 2d8m h ASP 43 N 0.27 -1.40 -0.89 -3.80 5.19 -0.57 -0.38 116.42 114.85 2d8m h ASP 43 Ca 0.31 0.13 0.08 0.00 -0.62 0.00 0.00 57.03 56.93 2d8m h ASP 43 Cb 0.45 0.49 -0.06 0.00 0.18 0.00 0.00 39.33 40.40 2d8m h ASP 43 CO -0.39 -0.59 0.58 0.11 -3.12 0.00 0.00 179.24 175.83 2d8m h LYS 44 N -0.84 0.92 -0.46 3.56 1.57 -0.91 -0.76 116.57 119.65 2d8m h LYS 44 Ca -0.02 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2d8m h LYS 44 Cb 0.79 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 2d8m h LYS 44 CO -0.18 0.61 0.23 0.00 -0.57 0.00 0.00 179.45 179.54 2d8m h ALA 45 N 1.54 1.54 -0.40 3.86 0.00 -0.13 -2.41 119.26 123.25 2d8m h ALA 45 Ca 0.39 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 2d8m h ALA 45 Cb 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2d8m h ALA 45 CO -0.16 0.38 -0.35 -0.07 0.00 0.00 0.00 179.25 179.05 2d8m h LEU 46 N 0.65 1.00 -0.24 0.00 3.38 0.41 -2.58 115.31 117.93 2d8m h LEU 46 Ca 0.16 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.75 2d8m h LEU 46 Cb 0.06 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.46 2d8m h LEU 46 CO -0.02 1.24 -0.19 -0.33 0.09 0.00 0.00 178.44 179.23 2d8m h GLU 47 N 0.78 -0.18 0.00 1.13 4.39 -1.00 0.23 114.58 119.93 2d8m h GLU 47 Ca 0.07 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2d8m h GLU 47 Cb 0.94 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 2d8m h GLU 47 CO 0.09 -0.12 0.12 -0.07 -1.16 0.00 0.00 179.01 177.87 2d8m h LEU 48 N -0.19 0.00 0.00 1.33 3.38 -1.54 0.72 115.31 119.01 2d8m h LEU 48 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2d8m h LEU 48 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2d8m h LEU 48 CO -0.35 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.79 2d8m n GLY 49 N -1.17 1.01 3.92 0.83 0.00 0.82 -1.56 105.19 109.04 2d8m n GLY 49 Ca -0.02 -0.26 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 2d8m n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d8m s ALA 50 N -2.00 3.76 0.08 4.61 0.00 -0.98 -4.29 121.76 122.95 2d8m s ALA 50 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.05 2d8m s ALA 50 Cb 0.00 -2.09 -0.06 0.00 0.00 0.00 0.00 23.12 20.96 2d8m s ALA 50 CO 0.00 0.36 0.51 0.15 0.00 0.00 0.00 175.76 176.77 2d8m s LYS 51 N -3.44 4.01 -0.30 0.00 1.02 -0.48 -4.31 119.74 116.24 2d8m s LYS 51 Ca 0.40 0.51 -0.04 0.00 0.02 0.00 0.00 55.97 56.86 2d8m s LYS 51 Cb -0.11 -3.10 0.03 0.00 -0.52 0.00 0.00 37.83 34.13 2d8m s LYS 51 CO 0.29 0.59 0.04 -0.47 -0.92 0.00 0.00 175.35 174.88 2d8m s TYR 52 N -1.26 3.19 0.02 3.18 5.04 -1.25 0.16 117.35 126.43 2d8m s TYR 52 Ca 0.31 -1.45 0.06 0.00 -2.44 0.00 0.00 57.07 53.55 2d8m s TYR 52 Cb -0.17 -2.18 -0.03 0.00 0.35 0.00 0.00 41.96 39.93 2d8m s TYR 52 CO 0.18 -0.71 -0.16 1.03 -1.34 0.00 0.00 175.55 174.54 2d8m s ARG 53 N 1.37 2.21 0.16 4.97 1.81 -1.08 -5.01 118.95 123.38 2d8m s ARG 53 Ca -0.01 -0.90 0.20 0.00 -1.72 0.00 0.00 55.73 53.30 2d8m s ARG 53 Cb -0.18 -2.25 0.84 0.00 -0.45 0.00 0.00 34.95 32.90 2d8m s ARG 53 CO 0.00 0.56 1.61 -0.35 -0.68 0.00 0.00 175.30 176.45 2d8m n PRO 54 N 1.74 0.12 -3.99 3.54 -0.04 -1.26 -3.65 135.00 131.46 2d8m n PRO 54 Ca -0.16 0.36 -0.09 0.00 -0.04 0.00 0.00 63.50 63.57 2d8m n PRO 54 Cb 0.52 -1.73 -0.05 0.00 -0.04 0.00 0.00 33.50 32.20 2d8m n PRO 54 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2d8m s ASP 55 N -3.76 -0.09 -0.12 3.54 -1.08 -1.26 -4.92 116.67 108.98 2d8m s ASP 55 Ca 0.05 -0.91 -0.30 0.00 -0.52 0.00 0.00 52.55 50.87 2d8m s ASP 55 Cb 0.09 0.58 -0.02 0.00 -1.46 0.00 0.00 42.92 42.11 2d8m s ASP 55 CO 0.34 -1.13 1.27 0.86 0.52 0.00 0.00 175.17 177.03 2d8m s TRP 56 N -4.01 2.90 0.45 -5.34 -0.11 -1.26 -4.96 118.94 106.62 2d8m s TRP 56 Ca 0.22 1.01 0.04 0.00 1.22 0.00 0.00 56.10 58.59 2d8m s TRP 56 Cb -0.01 -3.51 0.04 0.00 -1.50 0.00 0.00 33.47 28.49 2d8m s TRP 56 CO 0.08 -1.75 0.32 0.25 -4.62 0.00 0.00 176.95 171.24 2d8m n THR 57 N 5.10 0.00 1.14 5.86 -2.24 -1.26 -4.98 114.28 117.90 2d8m n THR 57 Ca 0.13 -1.81 0.11 0.00 -2.27 0.00 0.00 64.05 60.21 2d8m n THR 57 Cb 0.45 -0.08 0.59 0.00 -2.10 0.00 0.00 70.33 69.18 2d8m n THR 57 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2d8m n ARG 58 N -1.54 0.40 -0.02 -0.78 1.85 -1.26 -2.76 116.66 112.56 2d8m n ARG 58 Ca -0.02 0.06 0.02 0.00 -1.00 0.00 0.00 57.85 56.91 2d8m n ARG 58 Cb 0.52 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.35 2d8m n ARG 58 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2d8m n ASP 59 N -1.23 2.61 -4.48 2.89 -0.08 -1.26 -4.97 116.55 110.04 2d8m n ASP 59 Ca 0.12 0.00 -0.46 0.00 -1.51 0.00 0.00 54.79 52.94 2d8m n ASP 59 Cb 0.16 1.25 -0.07 0.00 2.34 0.00 0.00 41.12 44.80 2d8m n ASP 59 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2d8m n SER 60 N -2.02 1.96 -0.01 1.67 7.64 -1.11 -4.56 113.62 117.19 2d8m n SER 60 Ca -0.06 0.16 -0.21 0.00 1.01 0.00 0.00 58.87 59.77 2d8m n SER 60 Cb 0.44 -1.30 -0.13 0.00 -1.01 0.00 0.00 64.21 62.21 2d8m n SER 60 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2d8m h THR 61 N 7.37 1.10 -4.04 0.44 1.35 -1.80 -3.45 112.91 113.87 2d8m h THR 61 Ca -0.24 -2.37 -0.63 0.00 -0.55 0.00 0.00 66.41 62.62 2d8m h THR 61 Cb 1.30 2.72 -0.23 0.00 -1.73 0.00 0.00 68.15 70.21 2d8m h THR 61 CO 1.10 0.65 -0.85 -1.00 -0.25 0.00 0.00 175.52 175.16 2d8m s HIS 62 N -2.44 2.06 -0.12 4.73 3.76 -0.92 -2.14 115.29 120.23 2d8m s HIS 62 Ca -0.21 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.33 2d8m s HIS 62 Cb 0.04 -1.16 -0.00 0.00 1.11 0.00 0.00 32.58 32.56 2d8m s HIS 62 CO 0.74 0.21 -0.20 -1.17 -0.85 0.00 0.00 174.74 173.47 2d8m s LEU 63 N -1.70 2.30 -0.89 0.89 2.96 -0.15 -2.95 118.68 119.15 2d8m s LEU 63 Ca 0.10 -0.50 -0.19 0.00 -0.22 0.00 0.00 54.13 53.32 2d8m s LEU 63 Cb -0.10 -1.49 0.12 0.00 0.50 0.00 0.00 46.19 45.22 2d8m s LEU 63 CO 0.04 0.14 1.10 -0.63 -1.32 0.00 0.00 176.35 175.68 2d8m s ILE 64 N 0.48 4.65 -0.36 6.68 -1.09 0.87 -1.79 121.20 130.63 2d8m s ILE 64 Ca -0.13 -1.37 -0.17 0.00 -2.23 0.00 0.00 60.65 56.75 2d8m s ILE 64 Cb -0.17 -4.77 -0.00 0.00 -1.58 0.00 0.00 42.46 35.94 2d8m s ILE 64 CO 0.05 -1.51 0.45 0.00 -1.23 0.00 0.00 174.94 172.70 2d8m h ALA 66 N 8.52 1.06 -1.94 0.00 0.00 -1.84 -3.34 119.26 121.73 2d8m h ALA 66 Ca -0.28 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 2d8m h ALA 66 Cb 1.13 -0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.58 2d8m h ALA 66 CO 0.75 0.57 0.19 -0.59 0.00 0.00 0.00 179.25 180.17 2d8m s PHE 67 N -4.54 -0.71 0.80 0.00 -0.71 -1.26 -4.87 117.98 106.68 2d8m s PHE 67 Ca -0.07 1.63 -0.13 0.00 -1.04 0.00 0.00 56.93 57.31 2d8m s PHE 67 Cb 0.14 0.32 0.21 0.00 -1.21 0.00 0.00 43.02 42.47 2d8m s PHE 67 CO 0.80 -0.41 0.48 0.00 -1.34 0.00 0.00 175.22 174.75 2d8m n ALA 68 N 2.19 -2.82 -1.99 1.99 0.00 -1.26 -4.06 120.51 114.56 2d8m n ALA 68 Ca -0.15 -0.85 -0.16 0.00 0.00 0.00 0.00 53.44 52.28 2d8m n ALA 68 Cb 0.56 -0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 2d8m n ALA 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2d8m n ASN 69 N -4.53 -4.92 -4.71 0.00 4.13 -1.26 -5.00 115.26 98.98 2d8m n ASN 69 Ca 0.08 0.15 -0.23 0.00 1.68 0.00 0.00 54.58 56.26 2d8m n ASN 69 Cb 0.33 -3.97 -0.06 0.00 -1.54 0.00 0.00 39.78 34.54 2d8m n ASN 69 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2d8m s THR 70 N -2.74 3.80 0.05 3.41 -4.23 -1.26 -5.02 115.64 109.66 2d8m s THR 70 Ca 0.00 -1.73 0.33 0.00 -1.18 0.00 0.00 61.69 59.11 2d8m s THR 70 Cb 0.00 -3.04 0.38 0.00 1.34 0.00 0.00 72.50 71.18 2d8m s THR 70 CO 0.00 -0.36 1.97 1.55 -0.54 0.00 0.00 174.62 177.24 2d8m h PRO 71 N 1.77 0.00 0.00 3.99 0.13 -1.94 -2.58 132.00 133.36 2d8m h PRO 71 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2d8m h PRO 71 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2d8m h PRO 71 CO 0.60 0.00 -1.01 1.63 -0.23 0.00 0.00 178.00 179.00 2d8m n LYS 72 N -2.98 0.50 -0.04 0.86 4.76 -1.26 -3.13 118.16 116.88 2d8m n LYS 72 Ca 0.01 0.07 -0.14 0.00 -2.87 0.00 0.00 58.31 55.38 2d8m n LYS 72 Cb 0.29 -1.74 -0.12 0.00 -1.84 0.00 0.00 35.03 31.61 2d8m n LYS 72 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 2d8m h TYR 73 N 0.00 0.12 -0.03 2.13 5.03 -1.82 -2.99 116.97 119.41 2d8m h TYR 73 Ca 0.00 -0.07 -0.15 0.00 2.58 0.00 0.00 58.73 61.09 2d8m h TYR 73 Cb 0.91 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 39.16 2d8m h TYR 73 CO 0.00 0.89 -0.67 0.77 -1.32 0.00 0.00 178.16 177.83 2d8m h SER 74 N -0.68 0.16 0.92 -2.11 0.02 -1.71 -2.47 113.55 107.68 2d8m h SER 74 Ca -0.02 -0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2d8m h SER 74 Cb 0.93 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.43 2d8m h SER 74 CO 0.03 0.79 -0.44 -0.61 -1.14 0.00 0.00 176.83 175.45 2d8m h GLN 75 N 0.10 -1.19 0.00 3.45 4.15 -1.64 -0.26 115.11 119.71 2d8m h GLN 75 Ca -0.01 0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.49 2d8m h GLN 75 Cb 1.20 0.27 0.00 0.00 0.21 0.00 0.00 27.48 29.16 2d8m h GLN 75 CO 0.10 -0.80 0.00 0.28 -1.93 0.00 0.00 178.83 176.48 2d8m n VAL 76 N -5.49 0.87 -0.06 2.39 0.31 -1.13 -2.74 118.33 112.49 2d8m n VAL 76 Ca -0.15 0.38 -0.13 0.00 -0.01 0.00 0.00 64.34 64.42 2d8m n VAL 76 Cb 0.49 -1.34 -0.12 0.00 -0.91 0.00 0.00 33.84 31.96 2d8m n VAL 76 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2d8m h LEU 77 N 0.00 -0.00 -1.53 7.52 5.85 -1.05 -0.78 115.31 125.32 2d8m h LEU 77 Ca 0.00 -0.89 -0.02 0.00 0.84 0.00 0.00 57.88 57.81 2d8m h LEU 77 Cb 0.26 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2d8m h LEU 77 CO 0.00 0.91 0.06 1.23 -0.34 0.00 0.00 178.44 180.30 2d8m h GLY 78 N -0.93 0.39 0.45 3.75 0.00 -0.89 -3.13 103.07 102.71 2d8m h GLY 78 Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 2d8m h GLY 78 CO 0.00 0.18 -0.16 1.41 0.00 0.00 0.00 176.54 177.97 2d8m h LEU 79 N 0.36 -0.39 0.00 3.11 3.38 -1.62 -3.48 115.31 116.68 2d8m h LEU 79 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2d8m h LEU 79 Cb 0.15 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2d8m h LEU 79 CO -0.00 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.21 2d8m n GLY 80 N 0.28 0.88 3.96 0.83 0.00 -1.04 -5.13 105.19 104.98 2d8m n GLY 80 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2d8m n GLY 80 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2d8m s GLY 81 N -0.88 1.75 -0.81 -0.02 0.00 -0.32 -5.01 107.32 102.02 2d8m s GLY 81 Ca 0.00 -1.28 -0.21 0.00 0.00 0.00 0.00 44.72 43.23 2d8m s GLY 81 CO 0.00 -0.78 1.07 -1.60 0.00 0.00 0.00 173.10 171.79 2d8m s ARG 82 N -5.25 3.36 -0.23 2.90 3.52 -0.91 -4.81 118.95 117.53 2d8m s ARG 82 Ca 0.64 -1.27 -0.25 0.00 -0.13 0.00 0.00 55.73 54.71 2d8m s ARG 82 Cb -0.08 -4.62 -0.00 0.00 -1.56 0.00 0.00 34.95 28.69 2d8m s ARG 82 CO 0.45 -1.82 0.86 0.42 -0.81 0.00 0.00 175.30 174.39 2d8m s ILE 83 N 3.50 4.82 0.31 4.11 1.01 -1.26 -0.97 121.20 132.71 2d8m s ILE 83 Ca 0.28 1.64 0.05 0.00 0.00 0.00 0.00 60.65 62.62 2d8m s ILE 83 Cb -0.10 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 2d8m s ILE 83 CO -0.00 -0.07 0.22 0.68 0.00 0.00 0.00 174.94 175.77 2d8m s VAL 84 N 2.77 0.09 0.57 2.92 -7.23 -0.74 -1.79 120.40 116.99 2d8m s VAL 84 Ca 0.37 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 2d8m s VAL 84 Cb -0.15 -2.49 0.11 0.00 0.56 0.00 0.00 36.38 34.40 2d8m s VAL 84 CO 0.08 0.00 0.78 0.54 -0.31 0.00 0.00 175.10 176.19 2d8m n ARG 85 N -0.57 0.22 0.09 4.82 1.74 -1.17 -0.76 116.66 121.03 2d8m n ARG 85 Ca 0.04 -2.39 -0.04 0.00 -0.77 0.00 0.00 57.85 54.69 2d8m n ARG 85 Cb 0.64 -0.44 -0.01 0.00 -1.02 0.00 0.00 32.46 31.62 2d8m n ARG 85 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 2d8m h LYS 86 N 0.00 0.00 -1.48 5.56 2.10 -1.90 -3.25 116.57 117.59 2d8m h LYS 86 Ca -0.26 0.00 0.44 0.00 -2.00 0.00 0.00 60.65 58.83 2d8m h LYS 86 Cb 1.03 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.28 2d8m h LYS 86 CO 0.31 0.84 1.03 0.93 -2.00 0.00 0.00 179.45 180.56 2d8m h GLU 87 N 0.00 0.06 0.91 0.07 4.39 -1.95 0.44 114.58 118.50 2d8m h GLU 87 Ca -0.01 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2d8m h GLU 87 Cb 1.52 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 2d8m h GLU 87 CO 0.11 0.04 -0.49 2.35 -1.16 0.00 0.00 179.01 179.86 2d8m h TRP 88 N 0.06 -1.29 0.22 4.33 7.01 -1.95 0.38 115.95 124.71 2d8m h TRP 88 Ca 0.77 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.74 2d8m h TRP 88 Cb 2.81 0.44 -0.00 0.00 -2.10 0.00 0.00 29.16 30.31 2d8m h TRP 88 CO -0.00 -0.76 -0.12 0.28 -2.79 0.00 0.00 178.44 175.05 2d8m h VAL 89 N -1.29 0.75 -0.15 2.65 2.07 -1.17 0.32 116.25 119.43 2d8m h VAL 89 Ca -0.12 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.44 2d8m h VAL 89 Cb 1.01 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.46 2d8m h VAL 89 CO 0.17 0.00 -0.43 -0.07 0.02 0.00 0.00 177.57 177.26 2d8m h LEU 90 N -0.32 -1.36 -0.73 2.57 3.38 -1.34 0.22 115.31 117.73 2d8m h LEU 90 Ca -0.03 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2d8m h LEU 90 Cb 0.25 0.56 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2d8m h LEU 90 CO 0.04 -0.43 0.37 0.44 0.09 0.00 0.00 178.44 178.94 2d8m h ASP 91 N -0.49 0.95 -0.61 -0.43 5.19 -0.84 0.37 116.42 120.56 2d8m h ASP 91 Ca 0.08 -0.12 0.06 0.00 -0.62 0.00 0.00 57.03 56.42 2d8m h ASP 91 Cb 0.63 -0.24 -0.05 0.00 0.18 0.00 0.00 39.33 39.84 2d8m h ASP 91 CO -0.42 0.80 0.31 0.00 -3.12 0.00 0.00 179.24 176.82 2d8m h HIS 93 N 0.58 -0.19 -1.41 0.00 -0.00 -0.31 1.05 115.15 114.87 2d8m h HIS 93 Ca 0.28 -0.00 0.43 0.00 -0.00 0.00 0.00 60.37 61.08 2d8m h HIS 93 Cb 0.20 0.06 -0.10 0.00 -0.00 0.00 0.00 27.41 27.57 2d8m h HIS 93 CO -0.10 -0.12 0.95 -0.09 -0.00 0.00 0.00 177.93 178.58 2d8m h ARG 94 N -0.98 0.09 0.00 5.26 9.65 -0.25 1.14 114.38 129.29 2d8m h ARG 94 Ca -0.02 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2d8m h ARG 94 Cb 0.15 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2d8m h ARG 94 CO 0.03 0.06 -0.94 -1.33 2.80 0.00 0.00 179.97 180.59 2d8m n MET 95 N -4.46 1.46 -3.92 0.20 2.81 0.64 -4.99 117.12 108.86 2d8m n MET 95 Ca 0.36 -0.03 -0.29 0.00 -1.81 0.00 0.00 57.70 55.93 2d8m n MET 95 Cb 1.47 -1.29 0.02 0.00 -0.71 0.00 0.00 33.22 32.71 2d8m n MET 95 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2d8m n ARG 96 N -1.51 -5.14 -4.20 0.03 1.74 0.39 -4.96 116.66 103.00 2d8m n ARG 96 Ca 0.02 0.57 -0.12 0.00 -0.77 0.00 0.00 57.85 57.55 2d8m n ARG 96 Cb 0.28 -5.37 -0.10 0.00 -1.02 0.00 0.00 32.46 26.25 2d8m n ARG 96 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2d8m s ARG 97 N -6.57 1.07 -0.34 5.56 1.70 0.01 -4.81 118.95 115.57 2d8m s ARG 97 Ca 0.56 -1.53 -0.19 0.00 -0.47 0.00 0.00 55.73 54.10 2d8m s ARG 97 Cb -0.28 0.04 -0.00 0.00 -0.57 0.00 0.00 34.95 34.13 2d8m s ARG 97 CO 0.84 -0.24 0.55 0.50 -1.08 0.00 0.00 175.30 175.87 2d8m s ARG 98 N -4.02 3.68 -0.03 3.89 3.52 -1.26 -4.46 118.95 120.26 2d8m s ARG 98 Ca 0.27 -0.05 -0.02 0.00 -0.13 0.00 0.00 55.73 55.80 2d8m s ARG 98 Cb 0.07 -3.79 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 2d8m s ARG 98 CO 0.05 -0.65 0.10 -0.51 -0.81 0.00 0.00 175.30 173.48 2d8m s LEU 99 N 2.49 4.04 -0.80 -0.88 1.43 -1.26 -5.03 118.68 118.66 2d8m s LEU 99 Ca 0.21 0.24 -0.25 0.00 -1.03 0.00 0.00 54.13 53.30 2d8m s LEU 99 Cb -0.15 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.78 2d8m s LEU 99 CO 0.13 0.31 1.92 -2.16 0.23 0.00 0.00 176.35 176.78 2d8m s PRO 100 N -1.56 2.58 0.65 1.29 0.04 -1.26 -4.80 135.00 131.94 2d8m s PRO 100 Ca 0.21 0.01 0.23 0.00 0.04 0.00 0.00 61.00 61.50 2d8m s PRO 100 Cb -0.12 -4.83 1.22 0.00 0.04 0.00 0.00 34.50 30.80 2d8m s PRO 100 CO 0.12 -3.16 1.68 0.66 0.04 0.00 0.00 177.00 176.34 2d8m h SER 101 N 12.54 0.00 -0.32 6.66 4.64 -1.96 0.13 113.55 135.25 2d8m h SER 101 Ca -0.02 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.39 2d8m h SER 101 Cb 1.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 2d8m h SER 101 CO 1.21 0.00 0.38 -0.61 -0.87 0.00 0.00 176.83 176.94 2d8m h GLN 102 N 0.00 0.00 0.00 4.77 4.15 -1.98 0.65 115.11 122.71 2d8m h GLN 102 Ca 0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2d8m h GLN 102 Cb 1.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2d8m h GLN 102 CO -0.00 0.00 -0.92 0.54 -1.93 0.00 0.00 178.83 176.52 2d8m n ARG 103 N -3.64 0.29 -0.73 1.69 1.74 0.46 -3.94 116.66 112.53 2d8m n ARG 103 Ca 0.05 0.02 0.01 0.00 -0.77 0.00 0.00 57.85 57.17 2d8m n ARG 103 Cb 0.53 -1.62 0.27 0.00 -1.02 0.00 0.00 32.46 30.63 2d8m n ARG 103 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2d8m n TYR 104 N -2.01 1.54 -2.95 -1.55 4.01 0.22 -4.98 117.16 111.44 2d8m n TYR 104 Ca 0.02 -1.11 -0.40 0.00 -0.16 0.00 0.00 57.90 56.25 2d8m n TYR 104 Cb 0.44 -0.48 -0.05 0.00 -0.31 0.00 0.00 39.34 38.94 2d8m n TYR 104 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2d8m s LEU 105 N -2.96 4.42 -0.12 7.72 1.43 -0.75 -3.04 118.68 125.38 2d8m s LEU 105 Ca 0.48 1.45 -0.08 0.00 -1.03 0.00 0.00 54.13 54.95 2d8m s LEU 105 Cb 0.39 -3.27 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 2d8m s LEU 105 CO 0.09 -0.04 -0.15 0.23 0.23 0.00 0.00 176.35 176.71 2d8m n MET 106 N 3.06 0.38 -0.03 1.70 2.81 -0.74 -4.68 117.12 119.62 2d8m n MET 106 Ca -0.01 0.47 0.02 0.00 -1.81 0.00 0.00 57.70 56.37 2d8m n MET 106 Cb 0.50 -1.52 0.04 0.00 -0.71 0.00 0.00 33.22 31.53 2d8m n MET 106 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2d8m n ALA 107 N -3.43 2.30 -1.78 3.04 0.00 -1.26 -5.03 120.51 114.35 2d8m n ALA 107 Ca -0.06 -0.77 -0.37 0.00 0.00 0.00 0.00 53.44 52.24 2d8m n ALA 107 Cb 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 19.45 19.48 2d8m n ALA 107 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2d8m s GLY 108 N -0.66 2.74 0.37 0.00 0.00 -1.26 -5.00 107.32 103.52 2d8m s GLY 108 Ca 0.07 0.71 -0.06 0.00 0.00 0.00 0.00 44.72 45.44 2d8m s GLY 108 CO 0.06 1.14 0.33 -1.55 0.00 0.00 0.00 173.10 173.08 2d8m n PRO 109 N -0.04 -1.67 -2.41 2.90 -0.04 -1.26 -4.93 135.00 127.55 2d8m n PRO 109 Ca 0.05 -0.53 -0.43 0.00 -0.04 0.00 0.00 63.50 62.55 2d8m n PRO 109 Cb 0.49 -0.49 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 2d8m n PRO 109 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2d8m s GLY 110 N -3.08 1.48 -0.82 0.55 0.00 -1.26 -4.90 107.32 99.29 2d8m s GLY 110 Ca 0.21 0.26 -0.27 0.00 0.00 0.00 0.00 44.72 44.92 2d8m s GLY 110 CO 0.16 2.57 1.96 -1.26 0.00 0.00 0.00 173.10 176.54 2d8m n SER 111 N 7.28 1.49 0.04 1.64 2.88 -1.26 -4.60 113.62 121.09 2d8m n SER 111 Ca 0.15 -2.52 -0.20 0.00 -1.33 0.00 0.00 58.87 54.97 2d8m n SER 111 Cb 0.46 -1.41 -0.14 0.00 -0.75 0.00 0.00 64.21 62.37 2d8m n SER 111 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2d8m h SER 112 N 10.90 0.52 -0.63 -3.46 4.64 -2.03 -3.30 113.55 120.19 2d8m h SER 112 Ca 0.11 -0.89 -0.42 0.00 -0.47 0.00 0.00 61.79 60.11 2d8m h SER 112 Cb 0.91 -0.17 -0.18 0.00 -0.31 0.00 0.00 62.40 62.65 2d8m h SER 112 CO 1.32 1.36 0.54 -0.24 -0.87 0.00 0.00 176.83 178.95 2d8m n SER 113 N -4.12 6.57 -3.09 4.97 2.88 -1.26 -4.76 113.62 114.81 2d8m n SER 113 Ca -0.13 -3.26 -0.29 0.00 -1.33 0.00 0.00 58.87 53.87 2d8m n SER 113 Cb 0.80 -1.01 -0.04 0.00 -0.75 0.00 0.00 64.21 63.21 2d8m n SER 113 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2d8m n GLU 114 N -0.06 2.82 -1.86 -1.46 4.07 -1.24 -4.93 120.64 117.98 2d8m n GLU 114 Ca 0.39 -1.73 -0.35 0.00 -0.06 0.00 0.00 57.16 55.42 2d8m n GLU 114 Cb 0.65 -2.54 0.05 0.00 -0.06 0.00 0.00 31.44 29.53 2d8m n GLU 114 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2d8m s GLU 115 N 2.52 2.79 0.11 5.31 2.02 -1.26 -4.99 118.70 125.19 2d8m s GLU 115 Ca 0.56 1.69 -0.25 0.00 0.02 0.00 0.00 54.97 57.00 2d8m s GLU 115 Cb 0.16 -1.92 -0.07 0.00 0.10 0.00 0.00 34.13 32.40 2d8m s GLU 115 CO -0.04 -1.32 0.76 -0.51 0.02 0.00 0.00 175.26 174.17 2d8m s ASP 116 N -1.92 7.30 -0.16 -0.19 1.01 -1.26 -4.97 116.67 116.47 2d8m s ASP 116 Ca 0.74 1.55 -0.07 0.00 0.71 0.00 0.00 52.55 55.48 2d8m s ASP 116 Cb -0.27 -2.48 -0.08 0.00 1.01 0.00 0.00 42.92 41.10 2d8m s ASP 116 CO 0.37 0.13 -0.20 -0.62 0.21 0.00 0.00 175.17 175.06 2d8m n GLU 117 N 2.10 0.35 -1.90 8.23 1.02 -1.26 -4.82 120.64 124.36 2d8m n GLU 117 Ca -0.05 0.14 -0.23 0.00 -0.02 0.00 0.00 57.16 57.00 2d8m n GLU 117 Cb 0.49 -1.12 -0.08 0.00 -0.02 0.00 0.00 31.44 30.72 2d8m n GLU 117 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d8m s ALA 118 N -2.30 1.32 0.45 0.62 0.00 -1.26 -4.90 121.76 115.68 2d8m s ALA 118 Ca -0.23 -1.89 0.05 0.00 0.00 0.00 0.00 51.96 49.89 2d8m s ALA 118 Cb 0.08 -4.68 0.01 0.00 0.00 0.00 0.00 23.12 18.53 2d8m s ALA 118 CO 0.30 -5.83 0.62 -1.54 0.00 0.00 0.00 175.76 169.31 2d8m s SER 119 N 7.29 5.61 -0.65 0.00 1.04 -1.26 -4.95 113.70 120.78 2d8m s SER 119 Ca 0.73 -0.20 -0.35 0.00 0.48 0.00 0.00 55.95 56.62 2d8m s SER 119 Cb -0.02 -0.89 -0.17 0.00 0.10 0.00 0.00 66.02 65.03 2d8m s SER 119 CO 0.15 -0.82 2.39 0.00 0.98 0.00 0.00 173.24 175.94 2d8m n HIS 120 N -1.99 1.07 -4.52 5.02 1.44 -1.26 -4.87 115.22 110.12 2d8m n HIS 120 Ca 0.06 0.43 -0.25 0.00 -2.01 0.00 0.00 57.72 55.96 2d8m n HIS 120 Cb 0.59 -2.42 -0.06 0.00 0.12 0.00 0.00 29.99 28.21 2d8m n HIS 120 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2d8m n SER 121 N 10.17 1.72 0.05 4.39 3.41 -1.26 -5.11 113.62 126.97 2d8m n SER 121 Ca 0.54 -3.01 0.00 0.00 -0.26 0.00 0.00 58.87 56.13 2d8m n SER 121 Cb 0.12 0.80 0.00 0.00 -0.26 0.00 0.00 64.21 64.87 2d8m n SER 121 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d8m n GLY 122 N -0.56 -0.09 0.00 5.00 0.00 -1.26 -5.15 105.19 103.14 2d8m n GLY 122 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2d8m n GLY 122 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d8m n GLY 123 N 2.72 3.82 2.72 -0.02 0.00 -1.26 -4.89 105.19 108.28 2d8m n GLY 123 Ca 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 2d8m n GLY 123 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d8m n SER 124 N 0.00 -1.99 0.00 1.61 3.41 -1.26 -4.68 113.62 110.71 2d8m n SER 124 Ca 0.00 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 2d8m n SER 124 Cb 0.00 -1.77 0.00 0.00 -0.26 0.00 0.00 64.21 62.18 2d8m n SER 124 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d8m n GLY 125 N -0.67 0.08 0.00 5.00 0.00 -1.26 -4.84 105.19 103.49 2d8m n GLY 125 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.07 2d8m n GLY 125 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d8m n PRO 126 N -1.29 0.46 -1.56 1.61 -0.04 -1.26 -4.85 135.00 128.08 2d8m n PRO 126 Ca 0.00 0.01 -0.64 0.00 -0.04 0.00 0.00 63.50 62.84 2d8m n PRO 126 Cb 0.00 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2d8m n PRO 126 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d8m n SER 127 N -1.03 1.04 -4.67 3.54 2.88 -1.26 -4.74 113.62 109.38 2d8m n SER 127 Ca 0.11 1.01 -0.47 0.00 -1.33 0.00 0.00 58.87 58.19 2d8m n SER 127 Cb 0.06 -0.86 -0.05 0.00 -0.75 0.00 0.00 64.21 62.61 2d8m n SER 127 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2d8m n SER 128 N 4.91 3.24 0.00 -3.46 7.64 -1.26 -5.12 113.62 119.57 2d8m n SER 128 Ca 0.37 1.02 0.00 0.00 1.01 0.00 0.00 58.87 61.28 2d8m n SER 128 Cb -0.05 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 61.76 2d8m n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64