#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8m s SER 2 N 0.00 0.57 -1.64 1.61 1.04 -1.26 -4.89 113.70 109.13 2d8m s SER 2 Ca 0.00 -1.41 -0.15 0.00 0.48 0.00 0.00 55.95 54.87 2d8m s SER 2 Cb 0.00 0.50 0.12 0.00 0.10 0.00 0.00 66.02 66.75 2d8m s SER 2 CO 0.00 -1.02 0.73 -0.24 0.98 0.00 0.00 173.24 173.69 2d8m n SER 3 N -0.76 -2.89 -3.47 7.02 2.88 -1.26 -2.72 113.62 112.43 2d8m n SER 3 Ca 0.02 -0.99 -0.27 0.00 -1.33 0.00 0.00 58.87 56.30 2d8m n SER 3 Cb 0.64 -2.90 0.02 0.00 -0.75 0.00 0.00 64.21 61.22 2d8m n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d8m n GLY 4 N -1.54 -0.60 3.68 0.46 0.00 -1.26 -4.81 105.19 101.12 2d8m n GLY 4 Ca 0.00 0.96 -0.42 0.00 0.00 0.00 0.00 46.02 46.56 2d8m n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8m s SER 5 N -2.21 6.65 -0.60 1.61 1.04 -1.10 -4.94 113.70 114.15 2d8m s SER 5 Ca 0.22 2.37 -0.26 0.00 0.48 0.00 0.00 55.95 58.76 2d8m s SER 5 Cb -0.03 -2.55 0.04 0.00 0.10 0.00 0.00 66.02 63.57 2d8m s SER 5 CO 0.86 -0.88 1.10 -0.44 0.98 0.00 0.00 173.24 174.86 2d8m s SER 6 N 2.67 6.35 -0.30 7.02 0.01 -1.26 -4.90 113.70 123.28 2d8m s SER 6 Ca 0.73 -0.21 -0.18 0.00 1.31 0.00 0.00 55.95 57.59 2d8m s SER 6 Cb -0.37 -2.50 0.17 0.00 0.21 0.00 0.00 66.02 63.53 2d8m s SER 6 CO 0.31 -1.44 1.25 -0.83 0.41 0.00 0.00 173.24 172.94 2d8m s GLY 7 N 3.08 -0.20 -0.10 3.44 0.00 -1.26 -5.18 107.32 107.10 2d8m s GLY 7 Ca 0.36 3.05 -0.30 0.00 0.00 0.00 0.00 44.72 47.83 2d8m s GLY 7 CO 0.21 4.06 0.89 -1.83 0.00 0.00 0.00 173.10 176.42 2d8m s GLU 8 N 3.00 0.77 1.09 2.90 -1.05 -1.26 -5.18 118.70 118.97 2d8m s GLU 8 Ca -0.02 0.10 -0.15 0.00 -0.15 0.00 0.00 54.97 54.74 2d8m s GLU 8 Cb -0.06 0.36 0.23 0.00 -0.44 0.00 0.00 34.13 34.22 2d8m s GLU 8 CO -0.10 -0.26 1.10 -1.25 0.95 0.00 0.00 175.26 175.71 2d8m s PRO 9 N -1.48 -0.32 0.00 -4.83 0.04 -1.26 -5.02 135.00 122.13 2d8m s PRO 9 Ca -0.03 0.26 0.00 0.00 0.04 0.00 0.00 61.00 61.27 2d8m s PRO 9 Cb -0.00 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.86 2d8m s PRO 9 CO 0.02 -3.18 0.00 -2.13 0.04 0.00 0.00 177.00 171.75 2d8m n ARG 10 N -4.44 2.57 -2.36 4.56 3.00 -1.26 -5.05 116.66 113.67 2d8m n ARG 10 Ca 0.08 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.53 2d8m n ARG 10 Cb 0.58 -0.86 -0.04 0.00 0.00 0.00 0.00 32.46 32.15 2d8m n ARG 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2d8m s ARG 11 N -1.65 4.51 -0.18 -0.14 3.52 -1.26 -4.96 118.95 118.78 2d8m s ARG 11 Ca 0.00 1.92 -0.29 0.00 -0.13 0.00 0.00 55.73 57.23 2d8m s ARG 11 Cb 0.00 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.25 2d8m s ARG 11 CO 0.00 0.06 1.59 -1.25 -0.81 0.00 0.00 175.30 174.88 2d8m s PRO 12 N -1.62 3.91 -0.27 5.12 0.04 -1.26 -4.97 135.00 135.94 2d8m s PRO 12 Ca 0.47 1.76 -0.25 0.00 0.04 0.00 0.00 61.00 63.02 2d8m s PRO 12 Cb -0.34 -4.00 0.09 0.00 0.04 0.00 0.00 34.50 30.30 2d8m s PRO 12 CO 0.44 -1.15 0.86 -0.98 0.04 0.00 0.00 177.00 176.22 2d8m s ARG 13 N 4.43 0.69 -0.51 4.56 1.70 -1.26 -5.13 118.95 123.44 2d8m s ARG 13 Ca 0.70 0.81 -0.22 0.00 -0.47 0.00 0.00 55.73 56.54 2d8m s ARG 13 Cb -0.26 0.33 0.04 0.00 -0.57 0.00 0.00 34.95 34.49 2d8m s ARG 13 CO 0.28 -0.08 0.81 0.00 -1.08 0.00 0.00 175.30 175.22 2d8m s ALA 14 N 0.29 3.26 0.59 7.88 0.00 -1.26 -5.03 121.76 127.49 2d8m s ALA 14 Ca 0.01 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.68 2d8m s ALA 14 Cb -0.05 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2d8m s ALA 14 CO -0.02 -2.14 0.00 0.41 0.00 0.00 0.00 175.76 174.01 2d8m n GLY 15 N 5.09 0.42 0.00 0.00 0.00 -1.26 -4.91 105.19 104.53 2d8m n GLY 15 Ca -0.00 -1.78 0.08 0.00 0.00 0.00 0.00 46.02 44.31 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 0.48 0.01 1.61 -0.04 -1.26 -3.25 135.00 132.55 2d8m n PRO 16 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2d8m n PRO 16 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 2d8m n PRO 16 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2d8m h GLU 17 N 0.00 -0.12 -0.28 0.54 4.57 -1.91 0.54 114.58 117.92 2d8m h GLU 17 Ca 0.00 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.23 2d8m h GLU 17 Cb 0.00 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 2d8m h GLU 17 CO 0.00 0.34 0.06 0.93 -1.18 0.00 0.00 179.01 179.16 2d8m h GLU 18 N -0.93 0.16 -0.31 1.92 4.39 -1.91 -2.47 114.58 115.44 2d8m h GLU 18 Ca -0.01 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.51 2d8m h GLU 18 Cb 0.52 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2d8m h GLU 18 CO 0.02 0.11 -0.46 -0.07 -1.16 0.00 0.00 179.01 177.45 2d8m h LEU 19 N 0.17 0.88 -1.55 1.33 4.07 -1.69 -2.87 115.31 115.65 2d8m h LEU 19 Ca 0.13 -0.43 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2d8m h LEU 19 Cb 0.13 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.62 2d8m h LEU 19 CO -0.17 1.20 0.05 1.23 -1.08 0.00 0.00 178.44 179.68 2d8m h GLY 20 N 0.84 0.00 -1.61 0.83 0.00 0.16 0.31 103.07 103.59 2d8m h GLY 20 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2d8m h GLY 20 CO 0.10 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.92 2d8m n LYS 21 N -2.34 2.13 -0.08 4.80 4.76 -0.97 -3.60 118.16 122.86 2d8m n LYS 21 Ca -0.02 -1.71 -0.12 0.00 -2.87 0.00 0.00 58.31 53.59 2d8m n LYS 21 Cb 0.09 -1.45 -0.06 0.00 -1.84 0.00 0.00 35.03 31.77 2d8m n LYS 21 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2d8m h ILE 22 N 3.33 0.46 -1.08 -0.18 2.04 -0.43 -3.40 117.51 118.25 2d8m h ILE 22 Ca 0.00 -1.56 -0.62 0.00 1.00 0.00 0.00 64.86 63.68 2d8m h ILE 22 Cb 0.74 1.08 -0.37 0.00 -0.74 0.00 0.00 36.82 37.53 2d8m h ILE 22 CO 0.00 0.16 -0.09 0.18 0.00 0.00 0.00 178.15 178.40 2d8m n LEU 23 N -4.54 6.03 -4.59 1.44 4.77 0.16 -4.85 117.00 115.41 2d8m n LEU 23 Ca -0.18 -4.69 -0.42 0.00 -0.03 0.00 0.00 56.01 50.69 2d8m n LEU 23 Cb 0.44 -0.63 -0.03 0.00 -2.33 0.00 0.00 43.42 40.87 2d8m n LEU 23 CO 0.14 1.90 1.69 -1.58 -1.33 0.00 0.00 177.39 178.21 2d8m s GLN 24 N -3.71 3.06 0.00 3.23 0.74 -1.24 -2.05 119.66 119.69 2d8m s GLN 24 Ca 0.55 1.52 0.00 0.00 0.05 0.00 0.00 55.36 57.48 2d8m s GLN 24 Cb 0.44 -4.31 0.00 0.00 1.10 0.00 0.00 33.01 30.24 2d8m s GLN 24 CO -0.06 -2.18 0.00 0.41 -0.55 0.00 0.00 175.29 172.91 2d8m n GLY 25 N 5.62 1.78 3.37 2.59 0.00 -1.26 -5.10 105.19 112.20 2d8m n GLY 25 Ca 0.26 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 2.22 -0.14 1.61 1.01 -0.87 -5.07 120.40 117.16 2d8m s VAL 26 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.38 2d8m s VAL 26 Cb 0.00 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.47 2d8m s VAL 26 CO 0.00 0.21 -0.14 -0.69 0.00 0.00 0.00 175.10 174.48 2d8m s VAL 27 N -0.96 1.53 0.04 2.92 1.01 -1.26 -0.58 120.40 123.11 2d8m s VAL 27 Ca 0.13 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.55 2d8m s VAL 27 Cb -0.10 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2d8m s VAL 27 CO 0.04 0.45 -0.10 0.68 0.00 0.00 0.00 175.10 176.18 2d8m s VAL 28 N 1.43 3.39 -0.13 2.92 -7.23 0.15 -2.46 120.40 118.47 2d8m s VAL 28 Ca 0.03 -1.01 0.01 0.00 -1.81 0.00 0.00 61.98 59.19 2d8m s VAL 28 Cb -0.13 -2.50 0.02 0.00 0.56 0.00 0.00 36.38 34.33 2d8m s VAL 28 CO -0.09 0.29 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.17 2d8m s VAL 29 N -1.05 1.43 -0.17 1.32 1.01 -1.20 -2.27 120.40 119.47 2d8m s VAL 29 Ca 0.18 -0.56 -0.27 0.00 0.00 0.00 0.00 61.98 61.33 2d8m s VAL 29 Cb -0.11 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 2d8m s VAL 29 CO 0.09 0.43 0.93 -0.76 0.00 0.00 0.00 175.10 175.80 2d8m s LEU 30 N 1.40 4.18 -0.24 3.92 1.43 -1.25 -1.46 118.68 126.65 2d8m s LEU 30 Ca 0.02 1.33 -0.02 0.00 -1.03 0.00 0.00 54.13 54.42 2d8m s LEU 30 Cb -0.13 -3.40 0.12 0.00 0.03 0.00 0.00 46.19 42.80 2d8m s LEU 30 CO -0.08 -0.48 0.28 -0.55 0.23 0.00 0.00 176.35 175.75 2d8m s SER 31 N 1.16 1.29 0.00 2.29 0.15 -1.17 -4.90 113.70 112.52 2d8m s SER 31 Ca 0.43 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2d8m s SER 31 Cb -0.17 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 2d8m s SER 31 CO 0.13 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.83 2d8m n GLY 32 N 5.32 1.24 3.29 9.45 0.00 -1.26 -4.02 105.19 119.22 2d8m n GLY 32 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.00 1.42 -0.04 1.61 0.08 -1.26 -4.65 117.98 113.14 2d8m s PHE 33 Ca 0.00 -0.75 -0.01 0.00 0.12 0.00 0.00 56.93 56.28 2d8m s PHE 33 Cb 0.00 -0.73 0.03 0.00 -0.57 0.00 0.00 43.02 41.75 2d8m s PHE 33 CO 0.00 0.12 0.04 1.14 -0.10 0.00 0.00 175.22 176.42 2d8m s GLN 34 N -3.75 0.05 0.82 0.44 -2.07 -1.26 -4.83 119.66 109.06 2d8m s GLN 34 Ca 0.20 0.29 -0.15 0.00 -1.82 0.00 0.00 55.36 53.88 2d8m s GLN 34 Cb 0.03 -0.53 -0.02 0.00 -1.09 0.00 0.00 33.01 31.40 2d8m s GLN 34 CO 0.04 -0.28 0.41 0.27 -1.32 0.00 0.00 175.29 174.40 2d8m n ASN 35 N 5.01 -1.81 0.23 12.60 0.23 -1.26 -2.55 115.26 127.70 2d8m n ASN 35 Ca -0.09 0.47 0.10 0.00 -0.53 0.00 0.00 54.58 54.53 2d8m n ASN 35 Cb 0.50 -1.18 0.50 0.00 -2.08 0.00 0.00 39.78 37.52 2d8m n ASN 35 CO 0.00 0.00 0.00 1.55 -0.93 0.00 0.00 177.26 177.88 2d8m h PRO 36 N -0.84 0.00 -0.85 -0.53 0.13 -2.01 -3.44 132.00 124.46 2d8m h PRO 36 Ca -0.45 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 64.84 2d8m h PRO 36 Cb 1.32 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.30 2d8m h PRO 36 CO 0.38 0.23 -0.25 0.34 -0.23 0.00 0.00 178.00 178.47 2d8m n PHE 37 N -3.50 0.22 -0.13 1.56 7.35 -1.06 0.95 117.46 122.85 2d8m n PHE 37 Ca -0.01 1.04 -0.04 0.00 -0.76 0.00 0.00 57.45 57.69 2d8m n PHE 37 Cb 0.39 -0.94 0.03 0.00 0.35 0.00 0.00 39.48 39.31 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 0.03 0.59 -4.13 2.43 -1.81 0.16 114.38 111.65 2d8m h ARG 38 Ca 0.37 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.51 2d8m h ARG 38 Cb 0.59 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2d8m h ARG 38 CO -0.87 0.02 -0.28 1.03 -1.51 0.00 0.00 179.97 178.36 2d8m h SER 39 N 0.03 -0.67 -0.88 -3.80 0.87 0.26 -1.08 113.55 108.27 2d8m h SER 39 Ca 0.21 0.02 0.18 0.00 -1.23 0.00 0.00 61.79 60.97 2d8m h SER 39 Cb 0.31 0.17 -0.17 0.00 -0.44 0.00 0.00 62.40 62.28 2d8m h SER 39 CO -0.41 -0.44 -0.21 -0.08 -0.53 0.00 0.00 176.83 175.16 2d8m h GLU 40 N -0.89 0.00 -0.85 2.24 4.81 -0.93 0.63 114.58 119.59 2d8m h GLU 40 Ca -0.08 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2d8m h GLU 40 Cb 0.61 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.95 2d8m h GLU 40 CO 0.13 0.00 0.51 1.25 -0.73 0.00 0.00 179.01 180.18 2d8m h LEU 41 N 0.00 1.01 -0.59 1.64 5.85 -0.93 -2.58 115.31 119.72 2d8m h LEU 41 Ca 0.43 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.07 2d8m h LEU 41 Cb 0.66 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 2d8m h LEU 41 CO -0.91 0.78 0.32 -0.09 -0.34 0.00 0.00 178.44 178.20 2d8m h ARG 42 N 1.16 0.82 0.23 1.25 2.43 0.15 -2.64 114.38 117.78 2d8m h ARG 42 Ca 0.30 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2d8m h ARG 42 Cb -0.05 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.31 2d8m h ARG 42 CO -0.06 0.63 -0.44 0.22 -1.51 0.00 0.00 179.97 178.82 2d8m h ASP 43 N 0.79 -1.27 -0.79 -3.80 3.58 -0.52 -1.88 116.42 112.54 2d8m h ASP 43 Ca 0.21 0.12 0.18 0.00 0.42 0.00 0.00 57.03 57.96 2d8m h ASP 43 Cb 0.05 0.45 -0.12 0.00 1.72 0.00 0.00 39.33 41.43 2d8m h ASP 43 CO -0.03 -0.51 0.20 0.11 -2.88 0.00 0.00 179.24 176.13 2d8m h LYS 44 N -0.72 0.26 -0.94 0.28 1.57 -1.48 0.21 116.57 115.75 2d8m h LYS 44 Ca -0.03 -0.02 0.13 0.00 -1.87 0.00 0.00 60.65 58.87 2d8m h LYS 44 Cb 0.68 -0.06 -0.09 0.00 0.08 0.00 0.00 32.23 32.84 2d8m h LYS 44 CO -0.16 0.17 0.56 0.00 -0.57 0.00 0.00 179.45 179.45 2d8m h ALA 45 N 1.66 1.43 -0.33 3.86 0.00 -1.03 -1.46 119.26 123.39 2d8m h ALA 45 Ca 0.46 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.32 2d8m h ALA 45 Cb 0.82 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2d8m h ALA 45 CO -0.55 0.11 -0.15 -0.07 0.00 0.00 0.00 179.25 178.58 2d8m h LEU 46 N 0.86 0.70 -0.49 0.00 3.38 0.16 -1.71 115.31 118.22 2d8m h LEU 46 Ca 0.48 -0.40 0.08 0.00 0.09 0.00 0.00 57.88 58.13 2d8m h LEU 46 Cb 0.55 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.04 2d8m h LEU 46 CO -0.30 0.95 0.08 -0.33 0.09 0.00 0.00 178.44 178.93 2d8m h GLU 47 N 0.45 0.20 0.00 1.13 3.07 -0.31 0.34 114.58 119.46 2d8m h GLU 47 Ca 0.07 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 2d8m h GLU 47 Cb 0.68 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 2d8m h GLU 47 CO 0.05 0.13 0.00 1.28 -1.40 0.00 0.00 179.01 179.07 2d8m n LEU 48 N -5.14 0.31 0.00 1.33 4.77 -0.83 -0.55 117.00 116.90 2d8m n LEU 48 Ca 0.05 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 2d8m n LEU 48 Cb 0.24 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 2d8m n LEU 48 CO 0.20 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.15 2d8m n GLY 49 N -1.26 0.87 3.86 -0.72 0.00 0.12 0.35 105.19 108.41 2d8m n GLY 49 Ca -0.00 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 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 3.65 -0.00 4.61 0.00 -0.65 -4.12 121.76 123.25 2d8m s ALA 50 Ca 0.00 -0.26 -0.22 0.00 0.00 0.00 0.00 51.96 51.48 2d8m s ALA 50 Cb 0.00 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.67 2d8m s ALA 50 CO 0.00 0.51 0.67 0.15 0.00 0.00 0.00 175.76 177.09 2d8m s LYS 51 N -1.98 4.40 -0.35 0.00 3.01 0.25 -3.93 119.74 121.15 2d8m s LYS 51 Ca 0.36 0.86 -0.11 0.00 -1.01 0.00 0.00 55.97 56.06 2d8m s LYS 51 Cb -0.14 -3.37 0.00 0.00 -1.01 0.00 0.00 37.83 33.31 2d8m s LYS 51 CO 0.19 0.28 0.21 -0.47 0.51 0.00 0.00 175.35 176.06 2d8m s TYR 52 N 0.07 3.22 0.00 3.18 5.04 -1.25 0.34 117.35 127.94 2d8m s TYR 52 Ca 0.34 -0.60 0.03 0.00 -2.44 0.00 0.00 57.07 54.41 2d8m s TYR 52 Cb -0.19 -2.44 -0.03 0.00 0.35 0.00 0.00 41.96 39.65 2d8m s TYR 52 CO 0.19 -0.50 -0.08 1.03 -1.34 0.00 0.00 175.55 174.85 2d8m s ARG 53 N 1.63 2.53 0.24 4.97 1.81 -0.96 -5.03 118.95 124.14 2d8m s ARG 53 Ca 0.04 -0.73 0.01 0.00 -1.72 0.00 0.00 55.73 53.33 2d8m s ARG 53 Cb -0.18 -2.48 0.28 0.00 -0.45 0.00 0.00 34.95 32.12 2d8m s ARG 53 CO 0.08 0.60 1.61 -1.00 -0.68 0.00 0.00 175.30 175.91 2d8m h PRO 54 N 4.56 0.43 -4.99 3.54 0.13 -1.92 -3.33 132.00 130.43 2d8m h PRO 54 Ca -0.48 -0.23 -0.32 0.00 -0.87 0.00 0.00 66.00 64.10 2d8m h PRO 54 Cb 1.17 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.13 2d8m h PRO 54 CO 0.53 0.79 -0.73 0.16 -0.23 0.00 0.00 178.00 178.53 2d8m s ASP 55 N -6.87 1.53 -0.39 1.44 1.47 -1.26 -4.85 116.67 107.74 2d8m s ASP 55 Ca -0.06 -0.87 -0.32 0.00 1.18 0.00 0.00 52.55 52.48 2d8m s ASP 55 Cb 0.13 0.01 -0.10 0.00 -0.34 0.00 0.00 42.92 42.61 2d8m s ASP 55 CO 0.81 -0.28 2.28 1.87 0.68 0.00 0.00 175.17 180.52 2d8m n TRP 56 N 0.36 1.57 -2.95 2.11 -0.00 -1.26 -4.93 117.44 112.34 2d8m n TRP 56 Ca -0.15 0.17 -0.21 0.00 -0.00 0.00 0.00 57.50 57.31 2d8m n TRP 56 Cb 0.58 -2.58 0.02 0.00 -0.00 0.00 0.00 31.31 29.33 2d8m n TRP 56 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 177.69 178.64 2d8m s THR 57 N 8.51 3.49 0.30 5.87 -4.23 -1.26 -4.98 115.64 123.34 2d8m s THR 57 Ca 1.08 -0.68 -0.01 0.00 -1.18 0.00 0.00 61.69 60.90 2d8m s THR 57 Cb -0.66 -3.27 0.22 0.00 1.34 0.00 0.00 72.50 70.13 2d8m s THR 57 CO 0.42 -0.17 1.92 -0.09 -0.54 0.00 0.00 174.62 176.16 2d8m h ARG 58 N 0.40 0.96 0.00 3.99 2.43 -2.05 -0.95 114.38 119.15 2d8m h ARG 58 Ca -0.44 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 58.62 2d8m h ARG 58 Cb 1.27 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2d8m h ARG 58 CO 0.54 0.72 0.00 -0.44 -1.51 0.00 0.00 179.97 179.27 2d8m h ASP 59 N 0.97 0.00 -1.20 -3.80 5.19 -1.99 -3.45 116.42 112.13 2d8m h ASP 59 Ca 0.25 0.00 -0.82 0.00 -0.62 0.00 0.00 57.03 55.83 2d8m h ASP 59 Cb 0.04 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.56 2d8m h ASP 59 CO -0.04 0.00 0.73 -1.20 -3.12 0.00 0.00 179.24 175.61 2d8m n SER 60 N -2.40 1.57 -0.06 6.45 7.64 -0.36 -4.71 113.62 121.74 2d8m n SER 60 Ca 0.03 1.15 -0.07 0.00 1.01 0.00 0.00 58.87 60.99 2d8m n SER 60 Cb 0.32 -0.98 -0.07 0.00 -1.01 0.00 0.00 64.21 62.47 2d8m n SER 60 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2d8m n THR 61 N 4.07 0.72 -3.81 0.44 -2.24 -1.21 -4.95 114.28 107.29 2d8m n THR 61 Ca 0.29 -0.36 -0.13 0.00 -2.27 0.00 0.00 64.05 61.58 2d8m n THR 61 Cb 0.02 -0.84 -0.14 0.00 -2.10 0.00 0.00 70.33 67.27 2d8m n THR 61 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2d8m s HIS 62 N -2.25 -0.06 -0.26 4.78 3.76 -1.03 -2.64 115.29 117.59 2d8m s HIS 62 Ca -0.11 0.21 -0.10 0.00 -0.15 0.00 0.00 55.06 54.91 2d8m s HIS 62 Cb 0.04 -0.06 -0.05 0.00 1.11 0.00 0.00 32.58 33.62 2d8m s HIS 62 CO 0.36 -0.07 0.16 -1.17 -0.85 0.00 0.00 174.74 173.17 2d8m s LEU 63 N 0.48 4.00 -0.86 0.89 2.96 -0.74 -3.27 118.68 122.14 2d8m s LEU 63 Ca -0.04 0.03 -0.21 0.00 -0.22 0.00 0.00 54.13 53.69 2d8m s LEU 63 Cb -0.05 -2.09 0.10 0.00 0.50 0.00 0.00 46.19 44.64 2d8m s LEU 63 CO -0.02 0.01 1.13 -0.63 -1.32 0.00 0.00 176.35 175.52 2d8m s ILE 64 N 1.41 4.45 0.39 6.68 -1.09 -0.54 -2.16 121.20 130.34 2d8m s ILE 64 Ca 0.07 -1.02 0.03 0.00 -2.23 0.00 0.00 60.65 57.50 2d8m s ILE 64 Cb -0.15 -4.80 -0.01 0.00 -1.58 0.00 0.00 42.46 35.92 2d8m s ILE 64 CO 0.07 -1.57 0.57 0.00 -1.23 0.00 0.00 174.94 172.79 2d8m n ALA 66 N -1.87 1.74 -3.43 0.00 0.00 -1.26 -1.85 120.51 113.85 2d8m n ALA 66 Ca -0.01 -0.61 -0.16 0.00 0.00 0.00 0.00 53.44 52.66 2d8m n ALA 66 Cb 0.58 0.12 -0.07 0.00 0.00 0.00 0.00 19.45 20.08 2d8m n ALA 66 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2d8m s PHE 67 N -2.25 -0.51 1.24 0.00 -0.71 -1.26 -4.85 117.98 109.63 2d8m s PHE 67 Ca -0.11 0.84 -0.21 0.00 -1.04 0.00 0.00 56.93 56.41 2d8m s PHE 67 Cb 0.04 0.31 0.31 0.00 -1.21 0.00 0.00 43.02 42.47 2d8m s PHE 67 CO 0.36 -0.55 1.10 0.00 -1.34 0.00 0.00 175.22 174.79 2d8m n ALA 68 N 0.99 -3.46 -2.25 1.99 0.00 -1.26 -4.17 120.51 112.35 2d8m n ALA 68 Ca -0.20 -1.65 -0.15 0.00 0.00 0.00 0.00 53.44 51.45 2d8m n ALA 68 Cb 0.57 -0.11 -0.01 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 -4.89 -4.50 -4.81 0.00 3.02 -1.26 -5.01 115.26 97.81 2d8m n ASN 69 Ca 0.15 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.45 2d8m n ASN 69 Cb 0.59 -3.64 -0.05 0.00 -0.61 0.00 0.00 39.78 36.08 2d8m n ASN 69 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2d8m s THR 70 N -2.73 4.52 -0.32 3.41 -4.23 -1.26 -5.01 115.64 110.02 2d8m s THR 70 Ca 0.00 -1.15 0.26 0.00 -1.18 0.00 0.00 61.69 59.63 2d8m s THR 70 Cb 0.00 -3.34 0.29 0.00 1.34 0.00 0.00 72.50 70.78 2d8m s THR 70 CO 0.00 -0.17 1.79 1.55 -0.54 0.00 0.00 174.62 177.25 2d8m h PRO 71 N 2.16 0.00 0.00 3.99 0.13 -1.95 -2.78 132.00 133.55 2d8m h PRO 71 Ca -0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.48 2d8m h PRO 71 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2d8m h PRO 71 CO 0.63 0.00 -1.96 1.17 -0.23 0.00 0.00 178.00 177.60 2d8m n LYS 72 N -2.46 0.66 -0.09 0.86 3.00 -1.26 -3.62 118.16 115.25 2d8m n LYS 72 Ca 0.02 -0.03 -0.09 0.00 -0.00 0.00 0.00 58.31 58.21 2d8m n LYS 72 Cb 0.24 -1.60 0.07 0.00 0.00 0.00 0.00 35.03 33.74 2d8m n LYS 72 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2d8m h TYR 73 N 0.00 0.92 0.00 5.64 5.03 -1.86 -1.96 116.97 124.74 2d8m h TYR 73 Ca -0.23 -0.22 0.00 0.00 2.58 0.00 0.00 58.73 60.86 2d8m h TYR 73 Cb 1.57 -0.21 0.00 0.00 1.55 0.00 0.00 36.73 39.64 2d8m h TYR 73 CO 0.00 0.97 -0.41 1.03 -1.32 0.00 0.00 178.16 178.43 2d8m h SER 74 N 0.69 0.00 0.04 -2.11 0.87 -1.73 -3.08 113.55 108.23 2d8m h SER 74 Ca 0.09 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 2d8m h SER 74 Cb 0.79 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.76 2d8m h SER 74 CO 0.06 0.03 -0.49 -0.61 -0.53 0.00 0.00 176.83 175.29 2d8m h GLN 75 N 0.00 0.25 0.00 2.24 5.75 -1.57 -3.14 115.11 118.65 2d8m h GLN 75 Ca 0.00 -0.33 0.00 0.00 -0.15 0.00 0.00 58.65 58.17 2d8m h GLN 75 Cb 0.89 0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.55 2d8m h GLN 75 CO 0.00 1.08 0.00 0.28 -2.65 0.00 0.00 178.83 177.54 2d8m n VAL 76 N -4.32 0.69 -0.01 2.39 0.31 -0.76 -3.47 118.33 113.16 2d8m n VAL 76 Ca -0.11 -0.08 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 2d8m n VAL 76 Cb 0.65 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.66 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 -0.06 -1.55 7.52 5.85 -1.58 -1.96 115.31 123.53 2d8m h LEU 77 Ca 0.00 -0.58 0.05 0.00 0.84 0.00 0.00 57.88 58.19 2d8m h LEU 77 Cb 0.59 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2d8m h LEU 77 CO 0.00 0.60 0.37 1.23 -0.34 0.00 0.00 178.44 180.31 2d8m h GLY 78 N -0.80 0.68 0.46 3.75 0.00 -1.59 -3.08 103.07 102.50 2d8m h GLY 78 Ca -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 2d8m h GLY 78 CO 0.01 0.18 -0.22 1.41 0.00 0.00 0.00 176.54 177.92 2d8m h LEU 79 N 0.57 -0.53 0.00 3.11 3.38 -1.62 -3.48 115.31 116.74 2d8m h LEU 79 Ca 0.23 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2d8m h LEU 79 Cb 0.21 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2d8m h LEU 79 CO -0.07 -0.23 0.00 0.61 0.09 0.00 0.00 178.44 178.85 2d8m n GLY 80 N -0.19 0.28 3.89 0.83 0.00 -1.03 -5.14 105.19 103.84 2d8m n GLY 80 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.43 2.04 -0.77 -0.02 0.00 -0.77 -5.03 107.32 102.33 2d8m s GLY 81 Ca 0.00 -0.93 -0.26 0.00 0.00 0.00 0.00 44.72 43.54 2d8m s GLY 81 CO 0.00 -0.91 1.71 -1.60 0.00 0.00 0.00 173.10 172.30 2d8m s ARG 82 N -2.67 2.85 -0.37 2.90 6.06 -1.08 -4.74 118.95 121.89 2d8m s ARG 82 Ca 0.34 -0.05 -0.28 0.00 -2.50 0.00 0.00 55.73 53.24 2d8m s ARG 82 Cb -0.12 -4.67 0.02 0.00 0.06 0.00 0.00 34.95 30.24 2d8m s ARG 82 CO 0.27 -2.72 1.06 0.42 -2.50 0.00 0.00 175.30 171.83 2d8m s ILE 83 N 8.11 4.45 0.14 4.11 1.01 -1.26 -1.80 121.20 135.95 2d8m s ILE 83 Ca 0.59 1.47 0.04 0.00 0.00 0.00 0.00 60.65 62.74 2d8m s ILE 83 Cb -0.08 -4.45 -0.04 0.00 0.01 0.00 0.00 42.46 37.89 2d8m s ILE 83 CO 0.09 -0.64 -0.09 0.68 0.00 0.00 0.00 174.94 174.98 2d8m s VAL 84 N 3.83 1.09 0.74 2.92 -7.23 -0.92 -2.38 120.40 118.45 2d8m s VAL 84 Ca 0.44 -2.04 -0.10 0.00 -1.81 0.00 0.00 61.98 58.48 2d8m s VAL 84 Cb -0.11 -1.84 0.06 0.00 0.56 0.00 0.00 36.38 35.05 2d8m s VAL 84 CO 0.21 -0.75 1.09 -0.13 -0.31 0.00 0.00 175.10 175.20 2d8m s ARG 85 N -3.77 2.25 0.29 4.82 0.52 -1.20 -1.58 118.95 120.28 2d8m s ARG 85 Ca 0.16 0.02 -0.01 0.00 -0.52 0.00 0.00 55.73 55.38 2d8m s ARG 85 Cb 0.03 -2.06 0.42 0.00 0.52 0.00 0.00 34.95 33.86 2d8m s ARG 85 CO -0.00 -1.32 1.87 1.57 0.02 0.00 0.00 175.30 177.43 2d8m h LYS 86 N -0.77 0.89 -0.81 3.54 2.10 -1.70 -2.89 116.57 116.94 2d8m h LYS 86 Ca -0.45 -0.14 0.33 0.00 -2.00 0.00 0.00 60.65 58.38 2d8m h LYS 86 Cb 1.31 -0.16 -0.15 0.00 -0.90 0.00 0.00 32.23 32.34 2d8m h LYS 86 CO 0.63 0.73 0.38 0.39 -2.00 0.00 0.00 179.45 179.59 2d8m n GLU 87 N -4.32 -0.05 0.06 0.07 1.02 -1.26 0.65 120.64 116.81 2d8m n GLU 87 Ca 0.05 1.13 -0.13 0.00 -0.02 0.00 0.00 57.16 58.20 2d8m n GLU 87 Cb 0.17 -2.00 -0.06 0.00 -0.02 0.00 0.00 31.44 29.53 2d8m n GLU 87 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 2d8m h TRP 88 N 0.00 -1.02 0.77 -0.32 7.01 -1.89 0.85 115.95 121.34 2d8m h TRP 88 Ca 0.66 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.66 2d8m h TRP 88 Cb 1.72 0.45 0.01 0.00 -2.10 0.00 0.00 29.16 29.23 2d8m h TRP 88 CO -0.06 -0.45 -0.37 0.28 -2.79 0.00 0.00 178.44 175.05 2d8m h VAL 89 N -0.52 0.11 -0.91 2.65 2.07 0.01 0.21 116.25 119.87 2d8m h VAL 89 Ca 0.05 -0.19 0.24 0.00 0.82 0.00 0.00 66.70 67.63 2d8m h VAL 89 Cb 0.61 0.14 -0.16 0.00 -1.52 0.00 0.00 31.29 30.36 2d8m h VAL 89 CO -0.29 0.01 0.07 -0.07 0.02 0.00 0.00 177.57 177.32 2d8m h LEU 90 N -1.19 -0.33 -0.01 2.57 3.38 -1.29 0.17 115.31 118.61 2d8m h LEU 90 Ca -0.11 0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2d8m h LEU 90 Cb 0.80 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2d8m h LEU 90 CO 0.17 -0.27 -0.01 0.44 0.09 0.00 0.00 178.44 178.86 2d8m h ASP 91 N 0.08 0.03 -0.77 -0.43 5.19 -0.75 -0.63 116.42 119.14 2d8m h ASP 91 Ca 0.55 -0.56 0.17 0.00 -0.62 0.00 0.00 57.03 56.56 2d8m h ASP 91 Cb 1.09 -0.01 -0.11 0.00 0.18 0.00 0.00 39.33 40.48 2d8m h ASP 91 CO -0.80 0.59 0.21 0.00 -3.12 0.00 0.00 179.24 176.11 2d8m h HIS 93 N 0.28 -0.38 -1.36 0.00 -0.00 -0.80 1.02 115.15 113.91 2d8m h HIS 93 Ca 0.44 -0.01 0.40 0.00 -0.00 0.00 0.00 60.37 61.21 2d8m h HIS 93 Cb 0.77 0.12 -0.09 0.00 -0.00 0.00 0.00 27.41 28.22 2d8m h HIS 93 CO -0.25 -0.12 0.94 -0.09 -0.00 0.00 0.00 177.93 178.41 2d8m h ARG 94 N -1.04 0.10 -0.00 5.26 2.43 -0.61 1.15 114.38 121.67 2d8m h ARG 94 Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2d8m h ARG 94 Cb 0.43 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2d8m h ARG 94 CO 0.07 0.06 -0.77 -1.33 -1.51 0.00 0.00 179.97 176.50 2d8m n MET 95 N -4.37 1.46 -3.98 0.20 2.81 0.13 -4.99 117.12 108.38 2d8m n MET 95 Ca 0.33 -0.06 -0.28 0.00 -1.81 0.00 0.00 57.70 55.88 2d8m n MET 95 Cb 1.39 -1.29 -0.01 0.00 -0.71 0.00 0.00 33.22 32.60 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 -1.31 -3.84 -4.04 0.03 1.74 0.40 -4.94 116.66 104.69 2d8m n ARG 96 Ca 0.03 0.46 -0.12 0.00 -0.77 0.00 0.00 57.85 57.45 2d8m n ARG 96 Cb 0.27 -4.91 -0.04 0.00 -1.02 0.00 0.00 32.46 26.76 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 -6.59 1.78 -0.13 5.56 1.70 -0.22 -4.93 118.95 116.12 2d8m s ARG 97 Ca 0.29 -1.54 -0.21 0.00 -0.47 0.00 0.00 55.73 53.80 2d8m s ARG 97 Cb -0.16 0.46 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 2d8m s ARG 97 CO 0.88 -0.74 0.61 1.03 -1.08 0.00 0.00 175.30 176.00 2d8m s ARG 98 N -3.38 4.33 0.12 3.89 0.52 -1.26 -4.55 118.95 118.62 2d8m s ARG 98 Ca 0.27 0.66 0.09 0.00 -0.52 0.00 0.00 55.73 56.23 2d8m s ARG 98 Cb -0.01 -3.49 -0.04 0.00 0.52 0.00 0.00 34.95 31.93 2d8m s ARG 98 CO 0.15 -0.02 -0.17 -0.51 0.02 0.00 0.00 175.30 174.77 2d8m s LEU 99 N 1.16 2.73 -0.64 2.53 1.43 -1.26 -5.07 118.68 119.57 2d8m s LEU 99 Ca 0.31 -0.55 -0.26 0.00 -1.03 0.00 0.00 54.13 52.59 2d8m s LEU 99 Cb -0.16 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 2d8m s LEU 99 CO 0.13 0.17 1.87 -2.16 0.23 0.00 0.00 176.35 176.59 2d8m s PRO 100 N -2.19 2.62 0.53 1.29 0.04 -1.26 -4.83 135.00 131.19 2d8m s PRO 100 Ca 0.19 0.52 0.27 0.00 0.04 0.00 0.00 61.00 62.02 2d8m s PRO 100 Cb -0.10 -4.46 1.41 0.00 0.04 0.00 0.00 34.50 31.39 2d8m s PRO 100 CO 0.11 -2.80 1.95 0.77 0.04 0.00 0.00 177.00 177.07 2d8m h SER 101 N 14.62 0.02 -0.55 6.66 0.02 -1.97 -1.76 113.55 130.59 2d8m h SER 101 Ca -0.22 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2d8m h SER 101 Cb 1.15 -0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.58 2d8m h SER 101 CO 1.22 0.01 -0.17 1.56 -1.14 0.00 0.00 176.83 178.30 2d8m h GLN 102 N 0.02 -0.04 -0.00 3.45 7.50 -1.93 0.72 115.11 124.83 2d8m h GLN 102 Ca 0.32 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.47 2d8m h GLN 102 Cb 1.26 0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.80 2d8m h GLN 102 CO -0.01 -0.03 0.12 0.00 -1.50 0.00 0.00 178.83 177.41 2d8m h ARG 103 N -0.04 0.00 -0.75 1.46 3.08 -1.61 -0.49 114.38 116.04 2d8m h ARG 103 Ca 0.26 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.79 2d8m h ARG 103 Cb 0.44 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.16 2d8m h ARG 103 CO -0.58 0.00 -0.18 0.66 -1.07 0.00 0.00 179.97 178.80 2d8m n TYR 104 N -3.02 2.57 -3.11 3.04 4.02 0.25 -5.01 117.16 115.91 2d8m n TYR 104 Ca -0.03 -2.34 -0.40 0.00 -0.01 0.00 0.00 57.90 55.12 2d8m n TYR 104 Cb 0.18 -0.70 -0.05 0.00 -0.02 0.00 0.00 39.34 38.75 2d8m n TYR 104 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2d8m s LEU 105 N -3.60 4.21 -0.16 7.72 1.43 -0.19 -3.23 118.68 124.85 2d8m s LEU 105 Ca 0.54 0.95 -0.12 0.00 -1.03 0.00 0.00 54.13 54.46 2d8m s LEU 105 Cb 0.44 -2.94 -0.08 0.00 0.03 0.00 0.00 46.19 43.64 2d8m s LEU 105 CO 0.02 -0.21 -0.05 0.24 0.23 0.00 0.00 176.35 176.58 2d8m h MET 106 N 7.19 0.00 -6.98 1.70 2.86 -1.81 -3.48 114.93 114.41 2d8m h MET 106 Ca -0.35 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 56.76 2d8m h MET 106 Cb 1.16 0.00 0.09 0.00 0.06 0.00 0.00 31.60 32.91 2d8m h MET 106 CO 0.77 0.29 0.60 0.00 1.06 0.00 0.00 176.91 179.64 2d8m s ALA 107 N -2.61 3.13 0.18 6.32 0.00 -1.26 -4.80 121.76 122.71 2d8m s ALA 107 Ca -0.18 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2d8m s ALA 107 Cb 0.03 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2d8m s ALA 107 CO 0.32 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2d8m n GLY 108 N 0.63 -0.99 0.19 0.00 0.00 -1.26 -4.36 105.19 99.40 2d8m n GLY 108 Ca 0.06 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 2d8m n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d8m h PRO 109 N -0.71 0.60 -5.37 1.61 0.13 -1.92 -3.48 132.00 122.86 2d8m h PRO 109 Ca 0.02 -0.32 -0.28 0.00 -0.87 0.00 0.00 66.00 64.55 2d8m h PRO 109 Cb 1.18 0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2d8m h PRO 109 CO 0.01 0.91 -0.90 0.41 -0.23 0.00 0.00 178.00 178.20 2d8m n GLY 110 N 0.18 0.14 3.57 1.56 0.00 -1.26 -4.95 105.19 104.43 2d8m n GLY 110 Ca -0.05 0.82 -0.15 0.00 0.00 0.00 0.00 46.02 46.65 2d8m n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d8m s SER 111 N -1.06 -0.64 0.24 1.61 0.01 -1.23 -4.74 113.70 107.90 2d8m s SER 111 Ca 0.27 0.93 -0.08 0.00 1.31 0.00 0.00 55.95 58.38 2d8m s SER 111 Cb -0.03 0.83 0.39 0.00 0.21 0.00 0.00 66.02 67.43 2d8m s SER 111 CO 0.62 -0.43 1.63 -1.28 0.41 0.00 0.00 173.24 174.19 2d8m h SER 112 N 3.68 -0.45 -0.58 2.44 0.87 -1.97 0.99 113.55 118.53 2d8m h SER 112 Ca -0.27 0.20 0.11 0.00 -1.23 0.00 0.00 61.79 60.61 2d8m h SER 112 Cb 1.15 0.38 -0.09 0.00 -0.44 0.00 0.00 62.40 63.40 2d8m h SER 112 CO 0.25 -0.20 0.05 0.28 -0.53 0.00 0.00 176.83 176.68 2d8m h SER 113 N 0.07 -0.15 -4.26 6.23 0.02 -1.99 -3.28 113.55 110.19 2d8m h SER 113 Ca 0.39 0.13 -0.66 0.00 -0.84 0.00 0.00 61.79 60.81 2d8m h SER 113 Cb 0.67 0.21 -0.39 0.00 0.14 0.00 0.00 62.40 63.03 2d8m h SER 113 CO -0.69 -0.06 -0.53 -1.61 -1.14 0.00 0.00 176.83 172.80 2d8m s GLU 114 N -6.14 2.21 1.01 3.45 8.01 0.33 -5.10 118.70 122.47 2d8m s GLU 114 Ca -0.13 -2.64 -0.11 0.00 0.01 0.00 0.00 54.97 52.09 2d8m s GLU 114 Cb 0.18 -3.46 0.20 0.00 -4.31 0.00 0.00 34.13 26.73 2d8m s GLU 114 CO 0.73 -1.14 1.10 -1.21 0.01 0.00 0.00 175.26 174.75 2d8m s GLU 115 N -0.30 0.25 0.45 1.61 0.41 -1.15 -3.51 118.70 116.46 2d8m s GLU 115 Ca 0.18 1.28 -0.24 0.00 -0.41 0.00 0.00 54.97 55.77 2d8m s GLU 115 Cb -0.23 -1.66 -0.07 0.00 -1.78 0.00 0.00 34.13 30.39 2d8m s GLU 115 CO -0.02 -3.07 1.22 -0.51 -0.49 0.00 0.00 175.26 172.39 2d8m s ASP 116 N -2.61 6.15 -0.11 -0.19 1.11 -1.26 -4.95 116.67 114.81 2d8m s ASP 116 Ca 0.67 2.44 -0.05 0.00 0.18 0.00 0.00 52.55 55.80 2d8m s ASP 116 Cb -0.24 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.10 2d8m s ASP 116 CO 0.61 -0.94 0.09 -0.08 1.18 0.00 0.00 175.17 176.03 2d8m h GLU 117 N 2.22 0.00 -0.25 8.23 4.57 -2.03 -3.38 114.58 123.94 2d8m h GLU 117 Ca -0.49 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 57.74 2d8m h GLU 117 Cb 1.25 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.77 2d8m h GLU 117 CO 0.61 0.15 -0.39 0.00 -1.18 0.00 0.00 179.01 178.19 2d8m h ALA 118 N -0.86 -0.45 -0.79 2.92 0.00 -2.05 -3.42 119.26 114.61 2d8m h ALA 118 Ca -0.00 0.03 -0.64 0.00 0.00 0.00 0.00 54.91 54.30 2d8m h ALA 118 Cb 0.19 0.77 0.03 0.00 0.00 0.00 0.00 17.79 18.78 2d8m h ALA 118 CO -0.00 -0.86 0.15 0.45 0.00 0.00 0.00 179.25 178.99 2d8m n SER 119 N -5.42 0.19 -3.69 0.00 2.88 -1.26 -4.93 113.62 101.39 2d8m n SER 119 Ca -0.02 0.92 -0.26 0.00 -1.33 0.00 0.00 58.87 58.18 2d8m n SER 119 Cb 0.35 -0.72 -0.17 0.00 -0.75 0.00 0.00 64.21 62.92 2d8m n SER 119 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2d8m s HIS 120 N 0.50 0.67 0.32 0.66 -0.00 -1.26 -4.97 115.29 111.21 2d8m s HIS 120 Ca 0.74 -0.57 0.09 0.00 -0.00 0.00 0.00 55.06 55.32 2d8m s HIS 120 Cb -1.04 -0.87 -0.05 0.00 -0.00 0.00 0.00 32.58 30.62 2d8m s HIS 120 CO 0.49 -0.54 0.03 -1.12 -0.00 0.00 0.00 174.74 173.60 2d8m s SER 121 N 1.98 4.34 0.44 7.38 0.01 -1.26 -5.06 113.70 121.53 2d8m s SER 121 Ca 0.01 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2d8m s SER 121 Cb -0.16 -0.63 0.00 0.00 0.21 0.00 0.00 66.02 65.44 2d8m s SER 121 CO -0.08 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 173.99 2d8m n GLY 122 N -0.97 -2.50 0.00 3.44 0.00 -1.26 -4.96 105.19 98.94 2d8m n GLY 122 Ca -0.04 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 -4.18 1.03 3.38 -0.02 0.00 -1.26 -5.10 105.19 99.04 2d8m n GLY 123 Ca -0.03 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.80 2d8m n GLY 123 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d8m s SER 124 N -1.00 3.24 0.00 1.61 0.15 -1.26 -5.03 113.70 111.41 2d8m s SER 124 Ca 0.00 -0.72 0.00 0.00 0.70 0.00 0.00 55.95 55.93 2d8m s SER 124 Cb 0.00 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 2d8m s SER 124 CO 0.00 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2d8m n GLY 125 N 1.05 1.25 0.23 9.45 0.00 -1.26 -5.05 105.19 110.86 2d8m n GLY 125 Ca -0.18 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 2d8m n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d8m h PRO 126 N 0.00 0.77 -2.25 1.61 0.13 -2.05 -3.45 132.00 126.76 2d8m h PRO 126 Ca 0.00 -0.40 -0.04 0.00 -0.87 0.00 0.00 66.00 64.68 2d8m h PRO 126 Cb 0.00 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 30.92 2d8m h PRO 126 CO 0.00 1.03 -0.07 -1.12 -0.23 0.00 0.00 178.00 177.61 2d8m s SER 127 N -6.62 -0.74 0.07 1.44 0.01 -1.26 -5.13 113.70 101.47 2d8m s SER 127 Ca -0.12 1.27 -0.25 0.00 1.31 0.00 0.00 55.95 58.16 2d8m s SER 127 Cb 0.09 1.19 -0.14 0.00 0.21 0.00 0.00 66.02 67.38 2d8m s SER 127 CO 0.84 -0.22 0.58 -0.24 0.41 0.00 0.00 173.24 174.62 2d8m n SER 128 N 3.80 -0.47 0.00 2.44 2.88 -1.26 -5.29 113.62 115.72 2d8m n SER 128 Ca -0.19 0.84 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 2d8m n SER 128 Cb 0.57 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 2d8m n SER 128 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42