#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 -0.66 0.20 1.61 1.04 -1.26 -5.18 113.70 109.45 2d8m s SER 2 Ca 0.00 1.24 -0.01 0.00 0.48 0.00 0.00 55.95 57.66 2d8m s SER 2 Cb 0.00 1.23 -0.04 0.00 0.10 0.00 0.00 66.02 67.31 2d8m s SER 2 CO 0.00 -0.21 0.12 -0.94 0.98 0.00 0.00 173.24 173.18 2d8m s SER 3 N 0.51 0.28 -0.35 7.02 1.04 -1.26 -5.13 113.70 115.81 2d8m s SER 3 Ca -0.01 -1.37 -0.06 0.00 0.48 0.00 0.00 55.95 54.99 2d8m s SER 3 Cb -0.05 0.35 0.20 0.00 0.10 0.00 0.00 66.02 66.62 2d8m s SER 3 CO -0.02 -0.81 1.04 -0.83 0.98 0.00 0.00 173.24 173.60 2d8m s GLY 4 N -3.16 -1.74 -0.30 7.32 0.00 -1.26 -5.14 107.32 103.04 2d8m s GLY 4 Ca 0.37 0.73 -0.13 0.00 0.00 0.00 0.00 44.72 45.69 2d8m s GLY 4 CO 0.11 4.24 0.87 -0.45 0.00 0.00 0.00 173.10 177.87 2d8m s SER 5 N 1.31 -0.79 0.02 1.64 0.15 -1.26 -5.17 113.70 109.60 2d8m s SER 5 Ca 0.21 1.03 0.02 0.00 0.70 0.00 0.00 55.95 57.90 2d8m s SER 5 Cb 0.08 1.88 -0.01 0.00 -1.71 0.00 0.00 66.02 66.26 2d8m s SER 5 CO -0.11 -0.15 -0.05 -0.94 1.20 0.00 0.00 173.24 173.18 2d8m s SER 6 N 2.63 0.61 0.00 5.45 1.04 -1.26 -5.10 113.70 117.08 2d8m s SER 6 Ca -0.02 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2d8m s SER 6 Cb -0.09 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.03 2d8m s SER 6 CO -0.18 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.57 2d8m n GLY 7 N 2.27 3.08 3.26 7.32 0.00 -1.26 -5.17 105.19 114.69 2d8m n GLY 7 Ca -0.18 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.22 1.30 -1.11 1.61 0.41 -1.26 -5.06 118.70 113.37 2d8m s GLU 8 Ca 0.00 -1.02 -0.23 0.00 -0.41 0.00 0.00 54.97 53.31 2d8m s GLU 8 Cb 0.00 -1.47 -0.08 0.00 -1.78 0.00 0.00 34.13 30.80 2d8m s GLU 8 CO 0.00 0.36 1.94 -1.25 -0.49 0.00 0.00 175.26 175.82 2d8m s PRO 9 N -1.44 2.50 -0.24 0.39 0.04 -1.26 -4.74 135.00 130.25 2d8m s PRO 9 Ca 0.07 -0.93 0.04 0.00 0.04 0.00 0.00 61.00 60.22 2d8m s PRO 9 Cb -0.09 -5.19 0.41 0.00 0.04 0.00 0.00 34.50 29.67 2d8m s PRO 9 CO 0.03 -3.84 1.48 -2.13 0.04 0.00 0.00 177.00 172.58 2d8m n ARG 10 N 8.43 2.08 -1.62 4.56 0.63 -1.26 -4.98 116.66 124.50 2d8m n ARG 10 Ca 0.44 -1.79 -0.44 0.00 -0.92 0.00 0.00 57.85 55.13 2d8m n ARG 10 Cb 0.47 -1.75 -0.01 0.00 0.45 0.00 0.00 32.46 31.61 2d8m n ARG 10 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 2d8m n ARG 11 N -0.29 1.59 0.01 -0.14 0.63 -1.26 -4.92 116.66 112.28 2d8m n ARG 11 Ca 0.31 0.56 -0.13 0.00 -0.92 0.00 0.00 57.85 57.67 2d8m n ARG 11 Cb 1.11 -2.01 -0.10 0.00 0.45 0.00 0.00 32.46 31.92 2d8m n ARG 11 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2d8m h PRO 12 N 2.29 -0.05 -5.42 -0.14 0.13 -2.03 -3.43 132.00 123.35 2d8m h PRO 12 Ca -0.42 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.12 2d8m h PRO 12 Cb 1.32 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.36 2d8m h PRO 12 CO 0.62 0.42 -0.38 0.50 -0.23 0.00 0.00 178.00 178.93 2d8m s ARG 13 N -4.21 4.24 0.60 0.86 6.06 -1.26 -5.07 118.95 120.16 2d8m s ARG 13 Ca -0.16 -0.00 -0.19 0.00 -2.50 0.00 0.00 55.73 52.89 2d8m s ARG 13 Cb 0.02 -3.43 -0.03 0.00 0.06 0.00 0.00 34.95 31.56 2d8m s ARG 13 CO 0.65 0.25 1.20 0.00 -2.50 0.00 0.00 175.30 174.90 2d8m s ALA 14 N 0.46 2.53 0.00 6.12 0.00 -1.26 -5.04 121.76 124.58 2d8m s ALA 14 Ca 0.14 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.08 2d8m s ALA 14 Cb -0.12 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2d8m s ALA 14 CO 0.02 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2d8m n GLY 15 N 0.46 5.90 0.00 0.00 0.00 -1.26 -5.00 105.19 105.29 2d8m n GLY 15 Ca 0.13 -1.57 0.06 0.00 0.00 0.00 0.00 46.02 44.65 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 0.49 -0.07 1.61 -0.04 -1.26 -3.18 135.00 132.54 2d8m n PRO 16 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2d8m n PRO 16 Cb 0.00 -1.39 -0.07 0.00 -0.04 0.00 0.00 33.50 31.99 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 0.00 -0.84 0.54 4.81 -1.95 -2.31 114.58 114.84 2d8m h GLU 17 Ca 0.00 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 59.41 2d8m h GLU 17 Cb 0.00 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 2d8m h GLU 17 CO 0.00 0.58 0.56 0.93 -0.73 0.00 0.00 179.01 180.35 2d8m h GLU 18 N -1.00 0.38 0.02 1.92 5.08 -1.90 0.74 114.58 119.83 2d8m h GLU 18 Ca -0.05 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.05 2d8m h GLU 18 Cb 0.68 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2d8m h GLU 18 CO -0.03 0.25 -1.18 -0.07 -1.00 0.00 0.00 179.01 176.99 2d8m h LEU 19 N 0.40 0.08 0.00 1.33 4.07 -1.69 -3.25 115.31 116.25 2d8m h LEU 19 Ca 0.42 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 58.29 2d8m h LEU 19 Cb 1.04 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.76 2d8m h LEU 19 CO -0.14 1.07 0.00 0.61 -1.08 0.00 0.00 178.44 178.90 2d8m n GLY 20 N 1.43 -0.49 0.98 0.83 0.00 0.49 -0.46 105.19 107.97 2d8m n GLY 20 Ca -0.05 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.06 2d8m n GLY 20 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d8m n LYS 21 N -1.39 2.30 -0.08 1.61 4.76 -1.15 -4.00 118.16 120.21 2d8m n LYS 21 Ca 0.01 -2.11 -0.08 0.00 -2.87 0.00 0.00 58.31 53.27 2d8m n LYS 21 Cb 0.03 -1.43 -0.03 0.00 -1.84 0.00 0.00 35.03 31.75 2d8m n LYS 21 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2d8m n ILE 22 N 1.23 1.44 -1.80 -0.18 5.41 0.39 -4.52 119.36 121.33 2d8m n ILE 22 Ca 0.16 0.17 -0.32 0.00 1.00 0.00 0.00 62.75 63.76 2d8m n ILE 22 Cb 0.53 -2.34 0.04 0.00 -0.71 0.00 0.00 39.64 37.17 2d8m n ILE 22 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2d8m n LEU 23 N -4.58 6.54 -4.62 1.39 4.77 0.13 -4.91 117.00 115.73 2d8m n LEU 23 Ca -0.12 -4.66 -0.43 0.00 -0.03 0.00 0.00 56.01 50.78 2d8m n LEU 23 Cb 0.35 -0.76 -0.02 0.00 -2.33 0.00 0.00 43.42 40.65 2d8m n LEU 23 CO 0.12 1.80 1.37 -1.58 -1.33 0.00 0.00 177.39 177.78 2d8m s GLN 24 N -3.78 3.68 0.00 3.23 2.00 -1.25 -2.57 119.66 120.97 2d8m s GLN 24 Ca 0.56 1.50 0.00 0.00 -2.00 0.00 0.00 55.36 55.42 2d8m s GLN 24 Cb 0.45 -4.06 0.00 0.00 0.80 0.00 0.00 33.01 30.21 2d8m s GLN 24 CO -0.11 -1.44 0.00 0.41 -0.50 0.00 0.00 175.29 173.65 2d8m n GLY 25 N 4.85 1.31 3.44 2.59 0.00 -1.25 -5.07 105.19 111.05 2d8m n GLY 25 Ca 0.19 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 2.62 -0.25 1.61 1.01 -1.06 -5.05 120.40 117.27 2d8m s VAL 26 Ca 0.00 -1.44 0.01 0.00 0.00 0.00 0.00 61.98 60.56 2d8m s VAL 26 Cb 0.00 -2.14 0.07 0.00 0.00 0.00 0.00 36.38 34.31 2d8m s VAL 26 CO 0.00 0.21 -0.04 -0.69 0.00 0.00 0.00 175.10 174.58 2d8m s VAL 27 N -1.01 1.67 0.13 2.92 1.01 -1.26 -0.10 120.40 123.76 2d8m s VAL 27 Ca 0.15 -1.42 0.03 0.00 0.00 0.00 0.00 61.98 60.75 2d8m s VAL 27 Cb -0.10 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2d8m s VAL 27 CO 0.07 -0.18 0.18 0.68 0.00 0.00 0.00 175.10 175.85 2d8m s VAL 28 N 1.31 4.86 -0.07 2.92 -7.23 0.51 -2.61 120.40 120.09 2d8m s VAL 28 Ca -0.04 -0.81 0.01 0.00 -1.81 0.00 0.00 61.98 59.34 2d8m s VAL 28 Cb -0.19 -3.45 0.02 0.00 0.56 0.00 0.00 36.38 33.32 2d8m s VAL 28 CO -0.07 -0.02 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.91 2d8m s VAL 29 N -1.64 0.95 -0.10 1.32 1.01 -1.21 -3.01 120.40 117.72 2d8m s VAL 29 Ca 0.32 -0.34 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 2d8m s VAL 29 Cb -0.11 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 2d8m s VAL 29 CO 0.25 0.32 0.91 -0.76 0.00 0.00 0.00 175.10 175.83 2d8m s LEU 30 N 0.96 4.26 -0.18 3.92 1.43 -1.26 -1.58 118.68 126.24 2d8m s LEU 30 Ca -0.09 1.41 -0.08 0.00 -1.03 0.00 0.00 54.13 54.34 2d8m s LEU 30 Cb -0.15 -3.40 0.07 0.00 0.03 0.00 0.00 46.19 42.74 2d8m s LEU 30 CO 0.00 -0.35 0.40 -0.94 0.23 0.00 0.00 176.35 175.69 2d8m s SER 31 N 1.05 -0.33 0.00 2.29 1.04 -1.12 -4.90 113.70 111.73 2d8m s SER 31 Ca 0.45 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.79 2d8m s SER 31 Cb -0.18 1.03 0.00 0.00 0.10 0.00 0.00 66.02 66.97 2d8m s SER 31 CO 0.18 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.80 2d8m n GLY 32 N 4.87 1.11 3.46 7.32 0.00 -1.26 -2.89 105.19 117.80 2d8m n GLY 32 Ca -0.15 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 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 2.19 -0.07 1.61 0.08 -1.26 -4.59 117.98 113.94 2d8m s PHE 33 Ca 0.00 -0.45 -0.01 0.00 0.12 0.00 0.00 56.93 56.59 2d8m s PHE 33 Cb 0.00 -1.07 0.03 0.00 -0.57 0.00 0.00 43.02 41.41 2d8m s PHE 33 CO 0.00 0.58 0.00 -0.65 -0.10 0.00 0.00 175.22 175.05 2d8m s GLN 34 N -3.58 0.58 0.74 0.44 -1.52 -1.26 -4.80 119.66 110.26 2d8m s GLN 34 Ca 0.29 0.10 -0.16 0.00 -1.95 0.00 0.00 55.36 53.64 2d8m s GLN 34 Cb -0.02 -0.92 -0.04 0.00 -0.22 0.00 0.00 33.01 31.82 2d8m s GLN 34 CO 0.14 -0.28 0.47 0.27 -0.25 0.00 0.00 175.29 175.64 2d8m n ASN 35 N 5.01 -1.46 0.14 5.90 6.94 -1.26 -1.67 115.26 128.87 2d8m n ASN 35 Ca -0.09 0.57 0.12 0.00 -0.02 0.00 0.00 54.58 55.16 2d8m n ASN 35 Cb 0.50 -1.19 0.51 0.00 -2.36 0.00 0.00 39.78 37.24 2d8m n ASN 35 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 2d8m h PRO 36 N -0.45 0.00 -0.53 -0.53 0.13 -2.01 -3.45 132.00 125.15 2d8m h PRO 36 Ca -0.45 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.73 2d8m h PRO 36 Cb 1.35 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.41 2d8m h PRO 36 CO 0.41 0.00 -0.31 0.34 -0.23 0.00 0.00 178.00 178.21 2d8m n PHE 37 N -2.30 -0.23 -0.30 1.56 7.35 -0.67 0.11 117.46 122.98 2d8m n PHE 37 Ca 0.02 0.67 0.12 0.00 -0.76 0.00 0.00 57.45 57.49 2d8m n PHE 37 Cb 0.23 -0.51 0.27 0.00 0.35 0.00 0.00 39.48 39.82 2d8m n PHE 37 CO 0.00 0.00 0.00 0.07 -0.76 0.00 0.00 176.76 176.07 2d8m h ARG 38 N 0.00 0.16 0.72 -4.13 0.11 -1.86 0.15 114.38 109.52 2d8m h ARG 38 Ca 0.09 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.12 2d8m h ARG 38 Cb 0.22 -0.04 0.01 0.00 1.11 0.00 0.00 29.97 31.27 2d8m h ARG 38 CO -0.50 0.10 -0.34 1.03 0.10 0.00 0.00 179.97 180.36 2d8m h SER 39 N 0.16 -0.82 -0.03 0.08 0.87 0.39 -1.84 113.55 112.37 2d8m h SER 39 Ca 0.54 0.01 0.04 0.00 -1.23 0.00 0.00 61.79 61.14 2d8m h SER 39 Cb 1.07 0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 63.18 2d8m h SER 39 CO -0.69 -0.54 -0.34 -0.08 -0.53 0.00 0.00 176.83 174.65 2d8m h GLU 40 N -1.03 -0.46 -1.00 2.24 4.81 0.35 -0.24 114.58 119.26 2d8m h GLU 40 Ca -0.10 0.03 0.23 0.00 -0.13 0.00 0.00 59.36 59.40 2d8m h GLU 40 Cb 0.75 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 30.15 2d8m h GLU 40 CO 0.16 -0.31 0.64 1.25 -0.73 0.00 0.00 179.01 180.02 2d8m h LEU 41 N -0.48 0.53 -0.02 1.64 5.85 -0.76 -0.70 115.31 121.37 2d8m h LEU 41 Ca 0.07 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2d8m h LEU 41 Cb 0.58 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 2d8m h LEU 41 CO -0.30 0.15 -0.01 -0.09 -0.34 0.00 0.00 178.44 177.85 2d8m h ARG 42 N 0.49 0.04 -0.73 1.25 2.43 -0.26 -2.08 114.38 115.52 2d8m h ARG 42 Ca 0.57 -0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.88 2d8m h ARG 42 Cb 1.28 -0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.70 2d8m h ARG 42 CO -0.30 0.46 -0.02 0.22 -1.51 0.00 0.00 179.97 178.82 2d8m h ASP 43 N -0.38 -0.38 -0.37 -3.80 1.82 0.43 0.52 116.42 114.26 2d8m h ASP 43 Ca 0.00 0.19 -0.08 0.00 -0.39 0.00 0.00 57.03 56.76 2d8m h ASP 43 Cb 0.45 0.35 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 2d8m h ASP 43 CO 0.00 -0.18 -0.07 0.11 -1.61 0.00 0.00 179.24 177.49 2d8m h LYS 44 N 0.09 0.71 -0.67 0.28 1.57 -1.45 -2.62 116.57 114.48 2d8m h LYS 44 Ca 0.39 -0.26 0.16 0.00 -1.87 0.00 0.00 60.65 59.07 2d8m h LYS 44 Cb 0.68 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.90 2d8m h LYS 44 CO -0.66 0.85 0.47 0.00 -0.57 0.00 0.00 179.45 179.54 2d8m h ALA 45 N 0.84 2.35 0.01 3.86 0.00 -0.22 -1.52 119.26 124.58 2d8m h ALA 45 Ca 0.10 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2d8m h ALA 45 Cb 0.58 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2d8m h ALA 45 CO 0.03 -0.54 -0.44 -0.07 0.00 0.00 0.00 179.25 178.24 2d8m h LEU 46 N 0.20 0.37 -0.98 0.00 3.38 -0.94 -2.02 115.31 115.31 2d8m h LEU 46 Ca 0.33 -0.79 0.24 0.00 0.09 0.00 0.00 57.88 57.74 2d8m h LEU 46 Cb 1.01 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 2d8m h LEU 46 CO -0.06 1.11 0.55 -0.33 0.09 0.00 0.00 178.44 179.81 2d8m h GLU 47 N -0.34 0.54 0.00 1.13 3.07 -0.92 0.86 114.58 118.93 2d8m h GLU 47 Ca -0.06 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.73 2d8m h GLU 47 Cb 1.19 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.97 2d8m h GLU 47 CO 0.09 0.36 -0.18 -0.07 -1.40 0.00 0.00 179.01 177.81 2d8m h LEU 48 N 0.56 0.00 0.00 1.33 3.38 -1.54 0.14 115.31 119.18 2d8m h LEU 48 Ca 0.62 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.59 2d8m h LEU 48 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2d8m h LEU 48 CO -0.48 0.18 0.00 0.61 0.09 0.00 0.00 178.44 178.84 2d8m n GLY 49 N -0.32 1.26 3.88 0.83 0.00 0.30 0.19 105.19 111.34 2d8m n GLY 49 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 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 3.58 0.11 4.61 0.00 -0.76 -3.95 121.76 123.35 2d8m s ALA 50 Ca 0.00 -0.37 -0.17 0.00 0.00 0.00 0.00 51.96 51.43 2d8m s ALA 50 Cb 0.00 -2.39 -0.07 0.00 0.00 0.00 0.00 23.12 20.66 2d8m s ALA 50 CO 0.00 0.41 0.56 0.15 0.00 0.00 0.00 175.76 176.88 2d8m s LYS 51 N -3.07 4.08 -0.23 0.00 1.02 0.86 -4.18 119.74 118.21 2d8m s LYS 51 Ca 0.46 0.60 -0.05 0.00 0.02 0.00 0.00 55.97 57.01 2d8m s LYS 51 Cb -0.11 -3.07 -0.01 0.00 -0.52 0.00 0.00 37.83 34.12 2d8m s LYS 51 CO 0.24 0.55 -0.01 -0.47 -0.92 0.00 0.00 175.35 174.75 2d8m s TYR 52 N -1.30 3.00 0.03 3.18 5.04 -1.26 -0.37 117.35 125.67 2d8m s TYR 52 Ca 0.34 -0.80 0.08 0.00 -2.44 0.00 0.00 57.07 54.25 2d8m s TYR 52 Cb -0.17 -2.14 -0.03 0.00 0.35 0.00 0.00 41.96 39.97 2d8m s TYR 52 CO 0.19 -0.50 -0.22 1.03 -1.34 0.00 0.00 175.55 174.71 2d8m s ARG 53 N 1.52 1.99 0.42 4.97 1.81 -1.16 -5.02 118.95 123.47 2d8m s ARG 53 Ca 0.06 -1.01 0.21 0.00 -1.72 0.00 0.00 55.73 53.27 2d8m s ARG 53 Cb -0.14 -2.10 0.91 0.00 -0.45 0.00 0.00 34.95 33.17 2d8m s ARG 53 CO -0.01 0.54 1.84 -1.00 -0.68 0.00 0.00 175.30 175.98 2d8m h PRO 54 N 4.77 0.00 -4.02 3.54 0.13 -1.93 -3.36 132.00 131.13 2d8m h PRO 54 Ca -0.47 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 2d8m h PRO 54 Cb 1.15 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.14 2d8m h PRO 54 CO 0.46 0.28 -0.45 0.34 -0.23 0.00 0.00 178.00 178.40 2d8m s ASP 55 N -6.38 0.18 -0.30 1.44 2.15 -1.26 -4.93 116.67 107.57 2d8m s ASP 55 Ca -0.01 -0.90 -0.32 0.00 0.43 0.00 0.00 52.55 51.75 2d8m s ASP 55 Cb 0.12 0.35 -0.09 0.00 -0.30 0.00 0.00 42.92 43.00 2d8m s ASP 55 CO 0.66 -0.77 2.21 1.87 -0.17 0.00 0.00 175.17 178.96 2d8m n TRP 56 N -0.10 1.74 -3.68 -5.34 -0.00 -1.26 -4.94 117.44 103.86 2d8m n TRP 56 Ca -0.10 0.12 -0.22 0.00 -0.00 0.00 0.00 57.50 57.30 2d8m n TRP 56 Cb 0.63 -2.61 -0.01 0.00 -0.00 0.00 0.00 31.31 29.31 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 7.75 5.06 0.21 5.87 -4.23 -1.26 -4.98 115.64 124.06 2d8m s THR 57 Ca 1.06 -0.78 0.35 0.00 -1.18 0.00 0.00 61.69 61.15 2d8m s THR 57 Cb -0.65 -3.81 0.38 0.00 1.34 0.00 0.00 72.50 69.76 2d8m s THR 57 CO 0.43 -0.40 2.06 -0.09 -0.54 0.00 0.00 174.62 176.09 2d8m h ARG 58 N 0.96 0.00 -0.02 3.99 9.65 -2.04 -0.79 114.38 126.14 2d8m h ARG 58 Ca -0.50 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 2d8m h ARG 58 Cb 1.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2d8m h ARG 58 CO 0.60 0.00 -0.14 -0.40 2.80 0.00 0.00 179.97 182.83 2d8m n ASP 59 N -2.91 1.79 -4.67 -3.80 5.68 -1.26 -4.92 116.55 106.46 2d8m n ASP 59 Ca -0.01 -1.46 -0.42 0.00 -0.50 0.00 0.00 54.79 52.41 2d8m n ASP 59 Cb 0.19 0.11 -0.03 0.00 -1.14 0.00 0.00 41.12 40.25 2d8m n ASP 59 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2d8m s SER 60 N -2.21 6.46 -0.16 -1.12 0.01 -0.30 -4.60 113.70 111.78 2d8m s SER 60 Ca 0.29 2.67 0.12 0.00 1.31 0.00 0.00 55.95 60.34 2d8m s SER 60 Cb 0.20 -2.55 -0.19 0.00 0.21 0.00 0.00 66.02 63.70 2d8m s SER 60 CO 0.41 -1.02 0.02 0.35 0.41 0.00 0.00 173.24 173.41 2d8m n THR 61 N 5.21 1.09 -3.79 1.44 -2.24 -1.10 -4.88 114.28 110.01 2d8m n THR 61 Ca 0.19 -0.64 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 2d8m n THR 61 Cb 0.40 -0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 67.83 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 -2.38 -0.18 -0.17 4.78 3.76 -1.07 -3.35 115.29 116.67 2d8m s HIS 62 Ca -0.10 0.46 -0.07 0.00 -0.15 0.00 0.00 55.06 55.19 2d8m s HIS 62 Cb 0.05 0.01 -0.04 0.00 1.11 0.00 0.00 32.58 33.71 2d8m s HIS 62 CO 0.62 -0.12 0.05 -1.17 -0.85 0.00 0.00 174.74 173.27 2d8m s LEU 63 N 0.52 3.75 -0.82 0.89 2.96 -0.12 -3.29 118.68 122.57 2d8m s LEU 63 Ca -0.04 0.07 -0.16 0.00 -0.22 0.00 0.00 54.13 53.78 2d8m s LEU 63 Cb -0.05 -1.94 0.18 0.00 0.50 0.00 0.00 46.19 44.88 2d8m s LEU 63 CO -0.02 0.19 0.84 -0.63 -1.32 0.00 0.00 176.35 175.41 2d8m s ILE 64 N 0.30 5.29 0.41 6.68 -1.09 -0.62 -2.42 121.20 129.76 2d8m s ILE 64 Ca 0.03 -2.06 -0.04 0.00 -2.23 0.00 0.00 60.65 56.35 2d8m s ILE 64 Cb -0.12 -4.55 -0.04 0.00 -1.58 0.00 0.00 42.46 36.17 2d8m s ILE 64 CO 0.01 -1.16 0.67 0.00 -1.23 0.00 0.00 174.94 173.23 2d8m n ALA 66 N -1.87 1.48 -3.49 0.00 0.00 -1.14 -3.40 120.51 112.09 2d8m n ALA 66 Ca -0.01 -1.10 -0.15 0.00 0.00 0.00 0.00 53.44 52.17 2d8m n ALA 66 Cb 0.55 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 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 -2.49 -0.61 1.31 0.00 -0.12 -1.26 -4.91 117.98 109.90 2d8m s PHE 67 Ca -0.29 1.26 -0.22 0.00 -0.05 0.00 0.00 56.93 57.63 2d8m s PHE 67 Cb 0.08 0.29 0.33 0.00 -0.63 0.00 0.00 43.02 43.09 2d8m s PHE 67 CO 0.61 -0.45 0.94 0.00 -0.05 0.00 0.00 175.22 176.27 2d8m n ALA 68 N 1.78 -4.24 -2.89 1.99 0.00 -1.26 -4.15 120.51 111.74 2d8m n ALA 68 Ca -0.17 -1.52 -0.19 0.00 0.00 0.00 0.00 53.44 51.56 2d8m n ALA 68 Cb 0.56 -0.12 0.03 0.00 0.00 0.00 0.00 19.45 19.92 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 -5.30 -5.37 -4.68 0.00 3.02 -1.26 -5.01 115.26 96.66 2d8m n ASN 69 Ca 0.14 -0.24 -0.23 0.00 -0.03 0.00 0.00 54.58 54.22 2d8m n ASN 69 Cb 0.57 -4.21 -0.07 0.00 -0.61 0.00 0.00 39.78 35.47 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 -3.07 3.67 0.30 3.41 -4.23 -1.26 -5.03 115.64 109.43 2d8m s THR 70 Ca 0.25 -1.73 0.09 0.00 -1.18 0.00 0.00 61.69 59.12 2d8m s THR 70 Cb -0.11 -2.95 0.03 0.00 1.34 0.00 0.00 72.50 70.81 2d8m s THR 70 CO 0.31 -0.32 1.70 1.55 -0.54 0.00 0.00 174.62 177.32 2d8m h PRO 71 N 1.97 0.11 0.00 3.99 0.13 -1.94 -2.99 132.00 133.28 2d8m h PRO 71 Ca -0.46 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 64.47 2d8m h PRO 71 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 2d8m h PRO 71 CO 0.60 0.57 -0.86 -0.22 -0.23 0.00 0.00 178.00 177.86 2d8m h LYS 72 N 0.09 0.00 0.74 0.86 1.63 -1.98 -3.19 116.57 114.72 2d8m h LYS 72 Ca 0.00 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 2d8m h LYS 72 Cb 0.88 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.52 2d8m h LYS 72 CO 0.07 0.54 -0.35 -0.92 -3.45 0.00 0.00 179.45 175.33 2d8m h TYR 73 N 0.00 -0.92 -0.48 1.91 3.20 -1.90 -2.47 116.97 116.32 2d8m h TYR 73 Ca -0.05 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.81 2d8m h TYR 73 Cb 1.52 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 40.07 2d8m h TYR 73 CO 0.00 -0.55 0.32 1.03 -1.64 0.00 0.00 178.16 177.32 2d8m h SER 74 N -1.15 0.52 0.04 -2.11 0.87 -1.69 -0.29 113.55 109.74 2d8m h SER 74 Ca -0.10 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.47 2d8m h SER 74 Cb 0.78 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 2d8m h SER 74 CO 0.17 0.37 -0.14 -0.61 -0.53 0.00 0.00 176.83 176.08 2d8m h GLN 75 N 0.61 -0.25 0.00 2.24 4.15 -1.51 -1.55 115.11 118.80 2d8m h GLN 75 Ca 0.18 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2d8m h GLN 75 Cb -0.02 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.73 2d8m h GLN 75 CO -0.04 -0.17 0.00 0.28 -1.93 0.00 0.00 178.83 176.97 2d8m n VAL 76 N -5.27 0.68 0.04 2.39 0.31 -0.94 -2.89 118.33 112.64 2d8m n VAL 76 Ca -0.06 -0.15 -0.12 0.00 -0.01 0.00 0.00 64.34 64.00 2d8m n VAL 76 Cb 0.19 -0.75 -0.09 0.00 -0.91 0.00 0.00 33.84 32.28 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 -0.13 -0.55 7.52 6.46 -0.14 -1.06 115.31 127.41 2d8m h LEU 77 Ca 0.00 -0.41 -0.14 0.00 -0.12 0.00 0.00 57.88 57.21 2d8m h LEU 77 Cb 0.64 0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.60 2d8m h LEU 77 CO 0.00 0.39 -0.37 1.23 -0.62 0.00 0.00 178.44 179.07 2d8m h GLY 78 N -0.70 0.83 0.64 3.75 0.00 -1.38 -3.22 103.07 102.98 2d8m h GLY 78 Ca -0.02 -0.82 0.03 0.00 0.00 0.00 0.00 47.33 46.53 2d8m h GLY 78 CO 0.03 0.74 -0.09 1.41 0.00 0.00 0.00 176.54 178.62 2d8m h LEU 79 N 0.63 -0.29 0.00 3.11 3.38 -1.61 -3.47 115.31 117.06 2d8m h LEU 79 Ca 0.06 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2d8m h LEU 79 Cb 0.91 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2d8m h LEU 79 CO 0.08 -0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.09 2d8m n GLY 80 N -1.23 0.49 3.82 0.83 0.00 -1.07 -4.92 105.19 103.11 2d8m n GLY 80 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.06 1.66 -0.67 -0.02 0.00 -0.43 -4.98 107.32 101.81 2d8m s GLY 81 Ca 0.00 0.03 -0.22 0.00 0.00 0.00 0.00 44.72 44.53 2d8m s GLY 81 CO 0.00 0.36 0.94 -1.60 0.00 0.00 0.00 173.10 172.80 2d8m s ARG 82 N -5.07 3.14 -0.18 2.90 6.06 -1.21 -4.74 118.95 119.86 2d8m s ARG 82 Ca 0.59 -0.99 -0.23 0.00 -2.50 0.00 0.00 55.73 52.60 2d8m s ARG 82 Cb -0.14 -4.30 -0.02 0.00 0.06 0.00 0.00 34.95 30.55 2d8m s ARG 82 CO 0.55 -1.78 0.72 0.42 -2.50 0.00 0.00 175.30 172.71 2d8m s ILE 83 N 3.74 4.96 0.23 4.11 1.01 -1.26 -0.94 121.20 133.05 2d8m s ILE 83 Ca 0.22 1.39 0.01 0.00 0.00 0.00 0.00 60.65 62.26 2d8m s ILE 83 Cb -0.17 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2d8m s ILE 83 CO 0.08 0.08 0.16 0.68 0.00 0.00 0.00 174.94 175.93 2d8m s VAL 84 N 1.99 0.05 1.03 2.92 -7.23 -1.01 -1.44 120.40 116.71 2d8m s VAL 84 Ca 0.33 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.34 2d8m s VAL 84 Cb -0.16 -2.51 0.21 0.00 0.56 0.00 0.00 36.38 34.48 2d8m s VAL 84 CO 0.11 0.00 1.20 -0.13 -0.31 0.00 0.00 175.10 175.97 2d8m s ARG 85 N -4.00 0.14 0.03 4.82 1.81 -1.15 -2.76 118.95 117.85 2d8m s ARG 85 Ca 0.39 -0.10 0.05 0.00 -1.72 0.00 0.00 55.73 54.35 2d8m s ARG 85 Cb 0.06 -1.76 -0.24 0.00 -0.45 0.00 0.00 34.95 32.56 2d8m s ARG 85 CO 0.15 -2.80 0.96 1.57 -0.68 0.00 0.00 175.30 174.51 2d8m h LYS 86 N -1.92 0.09 -1.51 3.54 2.10 -1.91 -3.32 116.57 113.64 2d8m h LYS 86 Ca -0.46 -0.15 0.44 0.00 -2.00 0.00 0.00 60.65 58.48 2d8m h LYS 86 Cb 1.28 0.06 -0.07 0.00 -0.90 0.00 0.00 32.23 32.60 2d8m h LYS 86 CO 0.43 0.90 1.07 0.93 -2.00 0.00 0.00 179.45 180.79 2d8m h GLU 87 N 0.02 0.02 -0.15 0.07 5.08 -1.94 -0.45 114.58 117.24 2d8m h GLU 87 Ca -0.17 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2d8m h GLU 87 Cb 1.92 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 31.10 2d8m h GLU 87 CO 0.13 0.01 -0.49 2.35 -1.00 0.00 0.00 179.01 180.01 2d8m h TRP 88 N 0.02 -1.44 0.70 4.33 7.01 -1.97 0.19 115.95 124.80 2d8m h TRP 88 Ca 0.73 0.06 -0.03 0.00 2.11 0.00 0.00 58.89 61.76 2d8m h TRP 88 Cb 2.86 0.65 0.01 0.00 -2.10 0.00 0.00 29.16 30.58 2d8m h TRP 88 CO -0.00 -0.52 -0.34 0.28 -2.79 0.00 0.00 178.44 175.07 2d8m h VAL 89 N -0.54 0.25 -0.03 2.65 2.07 -1.35 -0.14 116.25 119.17 2d8m h VAL 89 Ca 0.06 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2d8m h VAL 89 Cb 0.66 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2d8m h VAL 89 CO -0.43 0.01 -0.04 -0.07 0.02 0.00 0.00 177.57 177.07 2d8m h LEU 90 N -1.05 -0.12 -0.81 2.57 3.38 -1.41 0.27 115.31 118.14 2d8m h LEU 90 Ca -0.10 0.02 0.17 0.00 0.09 0.00 0.00 57.88 58.06 2d8m h LEU 90 Cb 0.75 0.05 -0.11 0.00 0.09 0.00 0.00 40.66 41.44 2d8m h LEU 90 CO 0.16 -0.02 0.34 0.44 0.09 0.00 0.00 178.44 179.44 2d8m h ASP 91 N -0.02 0.30 -0.67 -0.43 5.19 -0.71 0.34 116.42 120.42 2d8m h ASP 91 Ca 0.01 0.13 0.08 0.00 -0.62 0.00 0.00 57.03 56.62 2d8m h ASP 91 Cb 0.04 0.10 -0.07 0.00 0.18 0.00 0.00 39.33 39.58 2d8m h ASP 91 CO -0.04 0.07 0.33 0.00 -3.12 0.00 0.00 179.24 176.48 2d8m h HIS 93 N 0.57 -0.28 -1.43 0.00 -0.00 0.15 1.14 115.15 115.31 2d8m h HIS 93 Ca 0.32 -0.01 0.48 0.00 -0.00 0.00 0.00 60.37 61.17 2d8m h HIS 93 Cb 0.32 0.09 -0.13 0.00 -0.00 0.00 0.00 27.41 27.69 2d8m h HIS 93 CO -0.11 -0.17 0.94 -0.09 -0.00 0.00 0.00 177.93 178.49 2d8m h ARG 94 N -0.87 0.02 0.00 5.26 9.65 -0.36 1.58 114.38 129.66 2d8m h ARG 94 Ca -0.03 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2d8m h ARG 94 Cb 0.23 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 2d8m h ARG 94 CO 0.05 0.01 -1.48 -1.33 2.80 0.00 0.00 179.97 180.03 2d8m n MET 95 N -4.64 0.63 -3.73 0.20 2.81 0.25 -5.00 117.12 107.64 2d8m n MET 95 Ca 0.40 -0.10 -0.25 0.00 -1.81 0.00 0.00 57.70 55.94 2d8m n MET 95 Cb 1.59 -1.44 0.05 0.00 -0.71 0.00 0.00 33.22 32.70 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 -1.87 -5.98 -4.21 0.03 1.74 0.54 -4.98 116.66 101.93 2d8m n ARG 96 Ca -0.01 0.68 -0.12 0.00 -0.77 0.00 0.00 57.85 57.63 2d8m n ARG 96 Cb 0.42 -5.52 -0.10 0.00 -1.02 0.00 0.00 32.46 26.24 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 -6.21 1.21 -0.54 5.56 1.70 -0.13 -4.96 118.95 115.59 2d8m s ARG 97 Ca 0.37 -1.64 -0.19 0.00 -0.47 0.00 0.00 55.73 53.80 2d8m s ARG 97 Cb -0.18 0.24 0.07 0.00 -0.57 0.00 0.00 34.95 34.52 2d8m s ARG 97 CO 0.79 -0.39 0.66 0.50 -1.08 0.00 0.00 175.30 175.78 2d8m s ARG 98 N -4.15 3.09 0.20 3.89 3.52 -1.26 -4.58 118.95 119.67 2d8m s ARG 98 Ca 0.39 -1.04 -0.11 0.00 -0.13 0.00 0.00 55.73 54.84 2d8m s ARG 98 Cb 0.07 -4.16 -0.07 0.00 -1.56 0.00 0.00 34.95 29.23 2d8m s ARG 98 CO 0.12 -1.34 0.55 -0.51 -0.81 0.00 0.00 175.30 173.31 2d8m s LEU 99 N 2.67 4.22 -0.49 -0.88 1.43 -1.26 -5.01 118.68 119.37 2d8m s LEU 99 Ca 0.14 0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 53.94 2d8m s LEU 99 Cb -0.21 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.46 2d8m s LEU 99 CO 0.10 -0.01 1.78 -2.16 0.23 0.00 0.00 176.35 176.29 2d8m s PRO 100 N -2.52 3.00 0.34 1.29 0.04 -1.26 -4.84 135.00 131.04 2d8m s PRO 100 Ca 0.44 0.95 0.25 0.00 0.04 0.00 0.00 61.00 62.67 2d8m s PRO 100 Cb -0.12 -4.28 1.21 0.00 0.04 0.00 0.00 34.50 31.35 2d8m s PRO 100 CO 0.20 -2.28 1.75 0.77 0.04 0.00 0.00 177.00 177.49 2d8m h SER 101 N 13.69 0.00 0.37 6.66 0.02 -2.00 -1.80 113.55 130.50 2d8m h SER 101 Ca -0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2d8m h SER 101 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2d8m h SER 101 CO 1.13 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.82 2d8m n GLN 102 N -2.36 0.06 0.03 3.45 6.02 -1.26 -1.35 117.38 121.96 2d8m n GLN 102 Ca -0.00 0.39 0.11 0.00 -0.01 0.00 0.00 57.00 57.49 2d8m n GLN 102 Cb 0.12 -1.63 -0.01 0.00 1.02 0.00 0.00 30.24 29.75 2d8m n GLN 102 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2d8m n ARG 103 N -1.74 0.32 -0.02 -1.09 1.74 -0.67 -4.02 116.66 111.18 2d8m n ARG 103 Ca 0.02 -0.02 0.08 0.00 -0.77 0.00 0.00 57.85 57.16 2d8m n ARG 103 Cb 0.13 -1.59 0.08 0.00 -1.02 0.00 0.00 32.46 30.05 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 -2.00 0.05 -1.55 -1.55 4.02 -0.46 -4.99 117.16 110.68 2d8m n TYR 104 Ca 0.01 -0.04 -0.54 0.00 -0.01 0.00 0.00 57.90 57.32 2d8m n TYR 104 Cb 0.45 -0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.69 2d8m n TYR 104 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2d8m n LEU 105 N 0.88 2.23 -0.08 7.72 4.77 -0.87 -2.95 117.00 128.70 2d8m n LEU 105 Ca 0.10 0.75 -0.14 0.00 -0.03 0.00 0.00 56.01 56.68 2d8m n LEU 105 Cb 0.40 -1.19 -0.10 0.00 -2.33 0.00 0.00 43.42 40.20 2d8m n LEU 105 CO 0.10 -0.55 -0.10 0.24 -1.33 0.00 0.00 177.39 175.74 2d8m h MET 106 N 9.79 0.00 -7.39 3.23 2.86 -1.58 -3.48 114.93 118.36 2d8m h MET 106 Ca -0.35 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 56.81 2d8m h MET 106 Cb 1.32 0.00 0.08 0.00 0.06 0.00 0.00 31.60 33.06 2d8m h MET 106 CO 1.00 0.77 0.32 0.00 1.06 0.00 0.00 176.91 180.06 2d8m s ALA 107 N -2.37 2.99 0.43 6.32 0.00 -1.25 -4.93 121.76 122.95 2d8m s ALA 107 Ca -0.20 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.15 2d8m s ALA 107 Cb 0.01 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.31 2d8m s ALA 107 CO 0.52 -1.20 0.00 0.41 0.00 0.00 0.00 175.76 175.48 2d8m n GLY 108 N -2.95 -3.86 0.21 0.00 0.00 -1.26 -4.67 105.19 92.65 2d8m n GLY 108 Ca 0.07 -0.93 0.07 0.00 0.00 0.00 0.00 46.02 45.23 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 0.40 0.00 0.00 1.61 0.13 -1.97 -3.46 132.00 128.72 2d8m h PRO 109 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2d8m h PRO 109 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2d8m h PRO 109 CO 0.00 0.30 0.00 0.41 -0.23 0.00 0.00 178.00 178.48 2d8m n GLY 110 N -0.09 1.47 3.56 1.56 0.00 -1.26 -5.07 105.19 105.36 2d8m n GLY 110 Ca -0.01 0.44 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 6.59 -1.03 1.61 0.01 -1.26 -4.90 113.70 114.72 2d8m s SER 111 Ca 0.00 -1.71 -0.05 0.00 1.31 0.00 0.00 55.95 55.49 2d8m s SER 111 Cb 0.00 -2.57 0.27 0.00 0.21 0.00 0.00 66.02 63.93 2d8m s SER 111 CO 0.00 -1.41 1.07 -1.20 0.41 0.00 0.00 173.24 172.10 2d8m n SER 112 N 8.70 5.21 -3.34 2.44 7.64 -1.26 -4.65 113.62 128.36 2d8m n SER 112 Ca 0.37 -3.14 -0.22 0.00 1.01 0.00 0.00 58.87 56.88 2d8m n SER 112 Cb 0.50 -1.24 0.07 0.00 -1.01 0.00 0.00 64.21 62.53 2d8m n SER 112 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2d8m n SER 113 N 2.27 -6.04 -4.06 6.43 7.64 -1.26 -4.97 113.62 113.62 2d8m n SER 113 Ca 0.24 -0.49 -0.34 0.00 1.01 0.00 0.00 58.87 59.28 2d8m n SER 113 Cb 0.38 -4.66 -0.11 0.00 -1.01 0.00 0.00 64.21 58.80 2d8m n SER 113 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2d8m s GLU 114 N -6.21 2.21 0.38 1.43 2.56 -1.26 -5.09 118.70 112.73 2d8m s GLU 114 Ca 0.54 -2.34 0.07 0.00 0.00 0.00 0.00 54.97 53.24 2d8m s GLU 114 Cb -0.24 -3.56 -0.00 0.00 2.00 0.00 0.00 34.13 32.33 2d8m s GLU 114 CO 0.67 -1.12 0.48 -1.21 -0.56 0.00 0.00 175.26 173.52 2d8m s GLU 115 N 0.22 2.86 0.15 4.30 2.02 -1.26 -5.02 118.70 121.98 2d8m s GLU 115 Ca 0.15 -1.22 0.11 0.00 0.02 0.00 0.00 54.97 54.02 2d8m s GLU 115 Cb -0.22 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.28 2d8m s GLU 115 CO -0.03 -0.11 -0.24 0.34 0.02 0.00 0.00 175.26 175.23 2d8m s ASP 116 N -4.22 3.48 0.04 -0.19 -1.08 -1.26 -5.05 116.67 108.38 2d8m s ASP 116 Ca 0.49 -0.76 -0.19 0.00 -0.52 0.00 0.00 52.55 51.58 2d8m s ASP 116 Cb -0.08 -0.30 -0.17 0.00 -1.46 0.00 0.00 42.92 40.91 2d8m s ASP 116 CO 0.31 0.16 1.24 -0.33 0.52 0.00 0.00 175.17 177.07 2d8m h GLU 117 N 3.59 0.46 -0.71 4.34 5.08 -2.07 -3.46 114.58 121.81 2d8m h GLU 117 Ca -0.49 -0.35 0.20 0.00 -1.00 0.00 0.00 59.36 57.72 2d8m h GLU 117 Cb 1.18 0.06 -0.24 0.00 0.50 0.00 0.00 28.75 30.26 2d8m h GLU 117 CO 0.44 0.97 0.22 0.00 -1.00 0.00 0.00 179.01 179.64 2d8m s ALA 118 N -3.78 -2.96 0.23 3.43 0.00 -1.26 -5.15 121.76 112.27 2d8m s ALA 118 Ca -0.13 1.85 -0.30 0.00 0.00 0.00 0.00 51.96 53.38 2d8m s ALA 118 Cb 0.05 -2.20 -0.09 0.00 0.00 0.00 0.00 23.12 20.87 2d8m s ALA 118 CO 0.80 -1.10 1.33 -1.12 0.00 0.00 0.00 175.76 175.67 2d8m s SER 119 N 2.54 6.84 -0.45 0.00 0.01 -1.26 -4.99 113.70 116.39 2d8m s SER 119 Ca -0.01 2.49 -0.10 0.00 1.31 0.00 0.00 55.95 59.64 2d8m s SER 119 Cb -0.07 -2.62 0.10 0.00 0.21 0.00 0.00 66.02 63.64 2d8m s SER 119 CO -0.16 -0.55 0.31 -1.00 0.41 0.00 0.00 173.24 172.25 2d8m s HIS 120 N -0.09 3.36 -0.13 2.43 3.76 -1.26 -4.94 115.29 118.42 2d8m s HIS 120 Ca 0.56 -1.61 -0.22 0.00 -0.15 0.00 0.00 55.06 53.63 2d8m s HIS 120 Cb -0.38 -3.23 -0.20 0.00 1.11 0.00 0.00 32.58 29.88 2d8m s HIS 120 CO 0.41 -0.91 0.58 0.66 -0.85 0.00 0.00 174.74 174.63 2d8m h SER 121 N 8.47 0.00 0.00 1.40 4.64 -1.94 -3.50 113.55 122.63 2d8m h SER 121 Ca -0.23 -0.77 0.00 0.00 -0.47 0.00 0.00 61.79 60.33 2d8m h SER 121 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2d8m h SER 121 CO 0.82 0.91 0.00 0.61 -0.87 0.00 0.00 176.83 178.30 2d8m n GLY 122 N 1.64 1.19 4.01 -0.77 0.00 -1.26 -5.01 105.19 105.00 2d8m n GLY 122 Ca -0.09 -0.82 -0.21 0.00 0.00 0.00 0.00 46.02 44.90 2d8m n GLY 122 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2d8m s GLY 123 N 0.00 1.75 0.36 -0.02 0.00 -1.26 -5.13 107.32 103.02 2d8m s GLY 123 Ca 0.00 -1.93 -0.15 0.00 0.00 0.00 0.00 44.72 42.63 2d8m s GLY 123 CO 0.00 -1.42 0.75 -0.56 0.00 0.00 0.00 173.10 171.86 2d8m s SER 124 N -4.69 0.04 0.00 1.64 0.01 -1.26 -5.16 113.70 104.27 2d8m s SER 124 Ca 0.64 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2d8m s SER 124 Cb -0.06 0.81 0.00 0.00 0.21 0.00 0.00 66.02 66.99 2d8m s SER 124 CO 0.41 -1.59 0.00 0.61 0.41 0.00 0.00 173.24 173.08 2d8m n GLY 125 N -0.52 -1.40 3.60 3.44 0.00 -1.26 -4.87 105.19 104.18 2d8m n GLY 125 Ca -0.07 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.14 2d8m n GLY 125 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8m s PRO 126 N -4.57 3.38 -0.02 1.61 0.04 -1.26 -4.98 135.00 129.20 2d8m s PRO 126 Ca 0.00 1.29 0.01 0.00 0.04 0.00 0.00 61.00 62.34 2d8m s PRO 126 Cb 0.00 -4.16 0.01 0.00 0.04 0.00 0.00 34.50 30.39 2d8m s PRO 126 CO 0.00 -1.80 -0.04 0.45 0.04 0.00 0.00 177.00 175.65 2d8m s SER 127 N 5.60 0.67 -1.76 6.66 0.15 -1.26 -4.84 113.70 118.92 2d8m s SER 127 Ca 0.75 -0.09 -0.18 0.00 0.70 0.00 0.00 55.95 57.13 2d8m s SER 127 Cb -0.20 -0.23 0.18 0.00 -1.71 0.00 0.00 66.02 64.06 2d8m s SER 127 CO 0.33 -0.01 0.45 -1.20 1.20 0.00 0.00 173.24 174.01 2d8m n SER 128 N 3.59 -1.18 0.00 5.45 7.64 -1.26 -5.22 113.62 122.63 2d8m n SER 128 Ca -0.21 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.46 2d8m n SER 128 Cb 0.54 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 2d8m n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64