#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 3.41 0.35 1.61 0.01 -1.26 -5.16 113.70 112.66 2d8m s SER 2 Ca 0.00 -0.97 0.03 0.00 1.31 0.00 0.00 55.95 56.32 2d8m s SER 2 Cb 0.00 -0.27 -0.05 0.00 0.21 0.00 0.00 66.02 65.92 2d8m s SER 2 CO 0.00 0.04 0.09 -0.44 0.41 0.00 0.00 173.24 173.35 2d8m s SER 3 N -3.20 2.35 0.00 2.44 0.01 -1.26 -5.15 113.70 108.89 2d8m s SER 3 Ca 0.26 -1.50 0.00 0.00 1.31 0.00 0.00 55.95 56.02 2d8m s SER 3 Cb -0.06 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.37 2d8m s SER 3 CO 0.12 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.62 2d8m n GLY 4 N -0.74 1.71 3.57 3.44 0.00 -1.26 -5.18 105.19 106.73 2d8m n GLY 4 Ca -0.03 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.48 2d8m n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d8m s SER 5 N 2.00 -0.54 -0.07 1.61 0.15 -1.26 -5.14 113.70 110.46 2d8m s SER 5 Ca 0.00 0.71 -0.30 0.00 0.70 0.00 0.00 55.95 57.06 2d8m s SER 5 Cb 0.00 0.60 -0.03 0.00 -1.71 0.00 0.00 66.02 64.88 2d8m s SER 5 CO 0.00 -0.41 1.20 -0.55 1.20 0.00 0.00 173.24 174.68 2d8m s SER 6 N -0.80 7.05 0.00 5.45 0.15 -1.26 -4.48 113.70 119.81 2d8m s SER 6 Ca -0.05 1.79 0.00 0.00 0.70 0.00 0.00 55.95 58.40 2d8m s SER 6 Cb -0.01 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2d8m s SER 6 CO 0.04 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 174.49 2d8m n GLY 7 N 3.38 -2.20 3.39 9.45 0.00 -1.26 -5.10 105.19 112.85 2d8m n GLY 7 Ca 0.11 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 2d8m n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2d8m s GLU 8 N -0.07 2.10 -0.03 1.61 -1.05 -1.26 -5.10 118.70 114.90 2d8m s GLU 8 Ca 0.00 -0.94 -0.30 0.00 -0.15 0.00 0.00 54.97 53.58 2d8m s GLU 8 Cb 0.00 -2.13 -0.05 0.00 -0.44 0.00 0.00 34.13 31.51 2d8m s GLU 8 CO 0.00 0.56 1.47 -1.25 0.95 0.00 0.00 175.26 176.98 2d8m s PRO 9 N -0.99 4.24 0.15 -4.83 0.04 -1.26 -5.02 135.00 127.33 2d8m s PRO 9 Ca 0.12 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.26 2d8m s PRO 9 Cb -0.10 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.69 2d8m s PRO 9 CO 0.02 -0.68 -0.19 -0.98 0.04 0.00 0.00 177.00 175.21 2d8m s ARG 10 N 2.98 1.26 0.26 4.56 3.03 -1.26 -5.15 118.95 124.63 2d8m s ARG 10 Ca 0.66 -1.36 -0.02 0.00 2.03 0.00 0.00 55.73 57.03 2d8m s ARG 10 Cb -0.31 -1.38 -0.04 0.00 -1.03 0.00 0.00 34.95 32.18 2d8m s ARG 10 CO 0.26 0.29 0.49 1.03 -1.13 0.00 0.00 175.30 176.24 2d8m s ARG 11 N -2.59 3.56 0.14 3.89 3.00 -1.26 -4.98 118.95 120.71 2d8m s ARG 11 Ca 0.14 -0.19 0.19 0.00 0.00 0.00 0.00 55.73 55.87 2d8m s ARG 11 Cb -0.07 -2.73 0.81 0.00 0.00 0.00 0.00 34.95 32.96 2d8m s ARG 11 CO 0.06 0.28 1.59 -0.35 0.00 0.00 0.00 175.30 176.88 2d8m n PRO 12 N -0.95 0.10 -1.08 3.54 -0.04 -1.26 -4.70 135.00 130.61 2d8m n PRO 12 Ca -0.03 0.35 -0.29 0.00 -0.04 0.00 0.00 63.50 63.48 2d8m n PRO 12 Cb 0.54 -1.70 0.21 0.00 -0.04 0.00 0.00 33.50 32.51 2d8m n PRO 12 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2d8m s ARG 13 N -3.17 -0.37 -1.16 0.54 1.70 -1.26 -4.85 118.95 110.38 2d8m s ARG 13 Ca 0.05 0.29 -0.23 0.00 -0.47 0.00 0.00 55.73 55.38 2d8m s ARG 13 Cb 0.09 -1.66 -0.08 0.00 -0.57 0.00 0.00 34.95 32.73 2d8m s ARG 13 CO 0.33 -3.22 1.93 0.00 -1.08 0.00 0.00 175.30 173.25 2d8m s ALA 14 N -2.94 1.83 1.00 7.88 0.00 -1.26 -4.93 121.76 123.33 2d8m s ALA 14 Ca 0.68 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 50.53 2d8m s ALA 14 Cb -0.16 -4.66 0.00 0.00 0.00 0.00 0.00 23.12 18.30 2d8m s ALA 14 CO 0.57 -5.14 0.00 0.41 0.00 0.00 0.00 175.76 171.61 2d8m n GLY 15 N 5.91 -3.14 0.00 0.00 0.00 -1.26 -4.76 105.19 101.94 2d8m n GLY 15 Ca 0.44 -1.19 0.06 0.00 0.00 0.00 0.00 46.02 45.34 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 0.18 1.61 -0.04 -1.26 -3.42 135.00 132.55 2d8m n PRO 16 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 2d8m n PRO 16 Cb 0.00 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.46 0.24 0.54 4.11 -1.89 -1.48 114.58 115.65 2d8m h GLU 17 Ca 0.00 0.03 0.01 0.00 0.07 0.00 0.00 59.36 59.47 2d8m h GLU 17 Cb 0.00 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 2d8m h GLU 17 CO 0.00 -0.14 -0.34 0.93 0.07 0.00 0.00 179.01 179.53 2d8m h GLU 18 N -0.85 -0.62 -0.28 1.06 4.39 -1.86 -2.78 114.58 113.64 2d8m h GLU 18 Ca -0.05 0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.76 2d8m h GLU 18 Cb 0.53 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 29.25 2d8m h GLU 18 CO 0.08 -0.41 -0.18 -0.07 -1.16 0.00 0.00 179.01 177.26 2d8m h LEU 19 N -0.65 -0.60 -1.03 1.33 4.07 -1.74 0.17 115.31 116.86 2d8m h LEU 19 Ca 0.00 0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.09 2d8m h LEU 19 Cb 0.62 0.31 0.00 0.00 1.08 0.00 0.00 40.66 42.67 2d8m h LEU 19 CO -0.12 -0.22 0.46 1.23 -1.08 0.00 0.00 178.44 178.70 2d8m h GLY 20 N -0.16 0.00 0.51 0.83 0.00 0.68 0.78 103.07 105.72 2d8m h GLY 20 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.21 2d8m h GLY 20 CO -0.38 0.00 -1.94 0.28 0.00 0.00 0.00 176.54 174.50 2d8m n LYS 21 N -2.35 0.65 0.30 4.80 5.02 0.55 -3.95 118.16 123.18 2d8m n LYS 21 Ca -0.01 0.12 -0.18 0.00 -2.02 0.00 0.00 58.31 56.22 2d8m n LYS 21 Cb 0.48 -1.67 -0.09 0.00 -0.02 0.00 0.00 35.03 33.73 2d8m n LYS 21 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2d8m h ILE 22 N 0.00 0.08 -2.11 -0.18 2.04 0.11 -3.14 117.51 114.30 2d8m h ILE 22 Ca -0.34 0.00 -0.73 0.00 1.00 0.00 0.00 64.86 64.78 2d8m h ILE 22 Cb 1.94 0.08 -0.32 0.00 -0.74 0.00 0.00 36.82 37.78 2d8m h ILE 22 CO 0.05 0.00 0.51 0.18 0.00 0.00 0.00 178.15 178.89 2d8m n LEU 23 N -5.55 6.54 -4.58 1.44 4.77 -0.68 -4.86 117.00 114.08 2d8m n LEU 23 Ca -0.12 -5.29 -0.42 0.00 -0.03 0.00 0.00 56.01 50.14 2d8m n LEU 23 Cb 0.45 -0.94 -0.03 0.00 -2.33 0.00 0.00 43.42 40.57 2d8m n LEU 23 CO 0.28 2.06 1.03 -1.58 -1.33 0.00 0.00 177.39 177.85 2d8m s GLN 24 N -4.01 3.55 0.00 3.23 0.74 -1.19 -3.34 119.66 118.64 2d8m s GLN 24 Ca 0.45 0.28 0.00 0.00 0.05 0.00 0.00 55.36 56.14 2d8m s GLN 24 Cb 0.29 -3.99 0.00 0.00 1.10 0.00 0.00 33.01 30.42 2d8m s GLN 24 CO -0.21 -1.58 0.00 0.41 -0.55 0.00 0.00 175.29 173.36 2d8m n GLY 25 N 5.01 1.42 3.37 2.59 0.00 -1.26 -5.06 105.19 111.26 2d8m n GLY 25 Ca 0.09 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 2.26 -0.23 1.61 1.01 -1.21 -4.64 120.40 117.20 2d8m s VAL 26 Ca 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 61.98 60.64 2d8m s VAL 26 Cb 0.00 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.53 2d8m s VAL 26 CO 0.00 0.36 -0.13 -0.69 0.00 0.00 0.00 175.10 174.63 2d8m s VAL 27 N -0.83 2.08 0.06 2.92 1.01 -1.26 -0.75 120.40 123.63 2d8m s VAL 27 Ca 0.12 -1.39 0.03 0.00 0.00 0.00 0.00 61.98 60.74 2d8m s VAL 27 Cb -0.10 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 2d8m s VAL 27 CO 0.03 0.14 0.06 0.68 0.00 0.00 0.00 175.10 176.01 2d8m s VAL 28 N 1.18 4.48 -0.07 2.92 -7.23 0.13 -2.77 120.40 119.04 2d8m s VAL 28 Ca -0.05 -0.72 0.01 0.00 -1.81 0.00 0.00 61.98 59.42 2d8m s VAL 28 Cb -0.18 -3.13 0.02 0.00 0.56 0.00 0.00 36.38 33.65 2d8m s VAL 28 CO -0.07 0.18 -0.09 -0.69 -0.31 0.00 0.00 175.10 174.12 2d8m s VAL 29 N -1.32 0.93 -0.16 1.32 1.01 -1.21 -2.89 120.40 118.08 2d8m s VAL 29 Ca 0.27 -0.32 -0.22 0.00 0.00 0.00 0.00 61.98 61.71 2d8m s VAL 29 Cb -0.12 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 2d8m s VAL 29 CO 0.19 0.32 0.69 -0.76 0.00 0.00 0.00 175.10 175.55 2d8m s LEU 30 N 1.04 4.19 -0.23 3.92 1.43 -1.26 -1.48 118.68 126.29 2d8m s LEU 30 Ca -0.08 0.99 -0.04 0.00 -1.03 0.00 0.00 54.13 53.97 2d8m s LEU 30 Cb -0.14 -3.01 0.09 0.00 0.03 0.00 0.00 46.19 43.15 2d8m s LEU 30 CO -0.00 -0.27 0.14 -0.55 0.23 0.00 0.00 176.35 175.90 2d8m s SER 31 N 1.09 2.56 0.00 2.29 0.15 -1.19 -4.89 113.70 113.72 2d8m s SER 31 Ca 0.33 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2d8m s SER 31 Cb -0.16 -0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 2d8m s SER 31 CO 0.12 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.79 2d8m n GLY 32 N 5.28 0.50 3.39 9.45 0.00 -1.26 -3.90 105.19 118.65 2d8m n GLY 32 Ca -0.06 -0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.25 1.88 -0.03 1.61 0.08 -1.26 -4.51 117.98 114.50 2d8m s PHE 33 Ca 0.00 -0.59 -0.01 0.00 0.12 0.00 0.00 56.93 56.45 2d8m s PHE 33 Cb 0.00 -0.94 0.03 0.00 -0.57 0.00 0.00 43.02 41.54 2d8m s PHE 33 CO 0.00 0.38 0.05 -1.14 -0.10 0.00 0.00 175.22 174.40 2d8m s GLN 34 N -3.66 -0.06 0.92 0.44 0.74 -1.26 -4.89 119.66 111.89 2d8m s GLN 34 Ca 0.26 0.29 -0.10 0.00 0.05 0.00 0.00 55.36 55.86 2d8m s GLN 34 Cb 0.00 -0.38 0.15 0.00 1.10 0.00 0.00 33.01 33.88 2d8m s GLN 34 CO 0.10 -0.25 1.15 0.54 -0.55 0.00 0.00 175.29 176.28 2d8m s ASN 35 N 1.64 2.85 0.39 6.67 2.20 -1.26 -2.11 114.94 125.32 2d8m s ASN 35 Ca -0.02 2.21 0.18 0.00 -0.94 0.00 0.00 52.86 54.29 2d8m s ASN 35 Cb -0.12 -2.57 0.78 0.00 -2.00 0.00 0.00 41.25 37.33 2d8m s ASN 35 CO -0.03 -3.16 1.80 1.55 -2.94 0.00 0.00 177.10 174.32 2d8m h PRO 36 N -1.90 0.00 -0.84 3.55 0.13 -2.01 -3.43 132.00 127.49 2d8m h PRO 36 Ca -0.43 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 64.91 2d8m h PRO 36 Cb 1.27 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.24 2d8m h PRO 36 CO 0.41 0.36 -0.07 0.34 -0.23 0.00 0.00 178.00 178.81 2d8m n PHE 37 N -3.73 0.44 0.07 1.56 7.35 -1.12 0.42 117.46 122.46 2d8m n PHE 37 Ca -0.01 1.02 -0.12 0.00 -0.76 0.00 0.00 57.45 57.57 2d8m n PHE 37 Cb 0.45 -1.07 -0.06 0.00 0.35 0.00 0.00 39.48 39.15 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 -0.49 0.79 -4.13 2.43 -1.71 0.23 114.38 111.49 2d8m h ARG 38 Ca 0.47 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.63 2d8m h ARG 38 Cb 0.88 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2d8m h ARG 38 CO -0.82 -0.33 -0.42 0.66 -1.51 0.00 0.00 179.97 177.56 2d8m h SER 39 N -0.51 -1.02 -0.57 -3.80 4.64 -0.35 -1.76 113.55 110.19 2d8m h SER 39 Ca 0.05 0.04 0.11 0.00 -0.47 0.00 0.00 61.79 61.53 2d8m h SER 39 Cb 0.59 0.28 -0.11 0.00 -0.31 0.00 0.00 62.40 62.85 2d8m h SER 39 CO -0.27 -0.68 -0.23 -0.08 -0.87 0.00 0.00 176.83 174.69 2d8m h GLU 40 N -1.11 -0.09 -0.43 4.77 4.81 -0.95 -0.10 114.58 121.48 2d8m h GLU 40 Ca -0.11 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.21 2d8m h GLU 40 Cb 0.87 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.20 2d8m h GLU 40 CO 0.15 -0.06 0.01 1.25 -0.73 0.00 0.00 179.01 179.63 2d8m h LEU 41 N -0.10 -0.15 -0.79 1.64 5.85 -0.43 -1.34 115.31 120.00 2d8m h LEU 41 Ca 0.26 0.10 0.06 0.00 0.84 0.00 0.00 57.88 59.13 2d8m h LEU 41 Cb 0.50 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 2d8m h LEU 41 CO -0.63 -0.04 0.48 -0.09 -0.34 0.00 0.00 178.44 177.82 2d8m h ARG 42 N 0.12 0.85 0.40 1.25 2.43 -0.16 -2.23 114.38 117.05 2d8m h ARG 42 Ca 0.21 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 2d8m h ARG 42 Cb 0.30 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2d8m h ARG 42 CO -0.34 0.56 -0.50 0.22 -1.51 0.00 0.00 179.97 178.40 2d8m h ASP 43 N 0.88 -1.39 -0.71 -3.80 1.82 -0.01 -1.51 116.42 111.69 2d8m h ASP 43 Ca 0.34 0.12 0.14 0.00 -0.39 0.00 0.00 57.03 57.25 2d8m h ASP 43 Cb 0.16 0.48 -0.10 0.00 0.68 0.00 0.00 39.33 40.54 2d8m h ASP 43 CO -0.17 -0.63 0.20 0.11 -1.61 0.00 0.00 179.24 177.14 2d8m h LYS 44 N -0.93 0.30 -0.92 0.28 6.56 -1.22 0.44 116.57 121.09 2d8m h LYS 44 Ca -0.04 -0.02 0.10 0.00 -1.06 0.00 0.00 60.65 59.63 2d8m h LYS 44 Cb 0.83 -0.07 -0.08 0.00 -0.57 0.00 0.00 32.23 32.35 2d8m h LYS 44 CO -0.12 0.20 0.56 0.00 -2.06 0.00 0.00 179.45 178.03 2d8m h ALA 45 N 1.56 1.33 -0.66 3.86 0.00 -0.94 -1.52 119.26 122.90 2d8m h ALA 45 Ca 0.39 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 2d8m h ALA 45 Cb 0.62 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2d8m h ALA 45 CO -0.45 0.19 0.25 -0.07 0.00 0.00 0.00 179.25 179.17 2d8m h LEU 46 N 0.92 0.91 -1.23 0.00 3.38 0.10 -2.44 115.31 116.95 2d8m h LEU 46 Ca 0.44 -0.18 0.08 0.00 0.09 0.00 0.00 57.88 58.32 2d8m h LEU 46 Cb 0.38 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 2d8m h LEU 46 CO -0.24 0.84 0.56 -0.33 0.09 0.00 0.00 178.44 179.35 2d8m h GLU 47 N 0.93 0.85 0.00 1.13 3.07 -0.64 0.21 114.58 120.12 2d8m h GLU 47 Ca 0.22 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 2d8m h GLU 47 Cb 0.22 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2d8m h GLU 47 CO -0.02 0.56 0.00 1.28 -1.40 0.00 0.00 179.01 179.44 2d8m n LEU 48 N -4.51 0.70 0.00 1.33 4.77 -0.99 -0.02 117.00 118.28 2d8m n LEU 48 Ca 0.14 0.66 0.00 0.00 -0.03 0.00 0.00 56.01 56.78 2d8m n LEU 48 Cb 0.27 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 2d8m n LEU 48 CO 0.32 -0.53 0.00 0.61 -1.33 0.00 0.00 177.39 176.46 2d8m n GLY 49 N 0.12 0.79 3.83 -0.72 0.00 0.73 -1.68 105.19 108.26 2d8m n GLY 49 Ca 0.02 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 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 3.36 -0.19 4.61 0.00 -0.95 -4.36 121.76 122.23 2d8m s ALA 50 Ca 0.00 0.10 -0.21 0.00 0.00 0.00 0.00 51.96 51.84 2d8m s ALA 50 Cb 0.00 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.30 2d8m s ALA 50 CO 0.00 0.33 0.64 0.15 0.00 0.00 0.00 175.76 176.88 2d8m s LYS 51 N -2.53 4.23 -0.37 0.00 1.02 0.07 -4.38 119.74 117.78 2d8m s LYS 51 Ca 0.49 0.65 -0.13 0.00 0.02 0.00 0.00 55.97 57.01 2d8m s LYS 51 Cb -0.13 -3.57 0.01 0.00 -0.52 0.00 0.00 37.83 33.62 2d8m s LYS 51 CO 0.19 -0.22 0.24 -0.47 -0.92 0.00 0.00 175.35 174.17 2d8m s TYR 52 N 1.84 3.23 -0.02 3.18 5.04 -1.24 0.19 117.35 129.57 2d8m s TYR 52 Ca 0.30 -0.60 0.01 0.00 -2.44 0.00 0.00 57.07 54.34 2d8m s TYR 52 Cb -0.16 -2.49 -0.04 0.00 0.35 0.00 0.00 41.96 39.62 2d8m s TYR 52 CO 0.11 -0.53 0.00 1.03 -1.34 0.00 0.00 175.55 174.82 2d8m s ARG 53 N 1.65 2.84 0.14 4.97 1.81 -1.14 -5.00 118.95 124.22 2d8m s ARG 53 Ca 0.04 -0.56 0.19 0.00 -1.72 0.00 0.00 55.73 53.69 2d8m s ARG 53 Cb -0.18 -2.70 0.81 0.00 -0.45 0.00 0.00 34.95 32.43 2d8m s ARG 53 CO 0.09 0.64 1.59 -0.35 -0.68 0.00 0.00 175.30 176.59 2d8m n PRO 54 N 1.58 0.11 -3.78 3.54 -0.04 -1.26 -4.12 135.00 131.02 2d8m n PRO 54 Ca -0.15 0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 63.56 2d8m n PRO 54 Cb 0.53 -1.70 -0.05 0.00 -0.04 0.00 0.00 33.50 32.24 2d8m n PRO 54 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2d8m s ASP 55 N -3.67 -0.16 -0.48 3.54 1.47 -1.26 -4.98 116.67 111.13 2d8m s ASP 55 Ca 0.05 -0.56 -0.27 0.00 1.18 0.00 0.00 52.55 52.95 2d8m s ASP 55 Cb 0.09 0.51 -0.04 0.00 -0.34 0.00 0.00 42.92 43.14 2d8m s ASP 55 CO 0.33 -0.96 2.10 0.86 0.68 0.00 0.00 175.17 178.18 2d8m s TRP 56 N -3.89 1.40 0.52 2.11 -0.11 -1.26 -4.96 118.94 112.76 2d8m s TRP 56 Ca 0.10 1.04 -0.06 0.00 1.22 0.00 0.00 56.10 58.40 2d8m s TRP 56 Cb 0.01 -3.88 0.11 0.00 -1.50 0.00 0.00 33.47 28.21 2d8m s TRP 56 CO -0.04 -2.69 0.72 0.25 -4.62 0.00 0.00 176.95 170.56 2d8m n THR 57 N 7.61 0.00 1.32 5.86 -2.24 -1.26 -4.99 114.28 120.58 2d8m n THR 57 Ca 0.28 -0.74 0.13 0.00 -2.27 0.00 0.00 64.05 61.46 2d8m n THR 57 Cb 0.52 -1.45 0.42 0.00 -2.10 0.00 0.00 70.33 67.72 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 -2.45 1.09 -0.00 -0.78 0.00 -1.26 -3.73 116.66 109.53 2d8m n ARG 58 Ca 0.10 -0.64 0.07 0.00 -0.00 0.00 0.00 57.85 57.38 2d8m n ARG 58 Cb 0.35 -1.49 -0.10 0.00 -0.00 0.00 0.00 32.46 31.22 2d8m n ARG 58 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2d8m n ASP 59 N -0.39 1.17 -4.63 2.89 9.92 -1.26 -5.00 116.55 119.25 2d8m n ASP 59 Ca 0.14 -0.38 -0.49 0.00 -0.53 0.00 0.00 54.79 53.53 2d8m n ASP 59 Cb 0.35 1.38 -0.05 0.00 -0.64 0.00 0.00 41.12 42.16 2d8m n ASP 59 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2d8m n SER 60 N -1.72 2.38 -0.05 -2.24 7.64 -1.24 -4.74 113.62 113.65 2d8m n SER 60 Ca -0.00 1.10 -0.05 0.00 1.01 0.00 0.00 58.87 60.92 2d8m n SER 60 Cb 0.32 -1.30 -0.07 0.00 -1.01 0.00 0.00 64.21 62.15 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 3.11 0.66 -3.88 0.44 -2.24 -1.15 -4.93 114.28 106.28 2d8m n THR 61 Ca 0.18 -0.39 -0.20 0.00 -2.27 0.00 0.00 64.05 61.38 2d8m n THR 61 Cb 0.23 -0.77 -0.17 0.00 -2.10 0.00 0.00 70.33 67.52 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 -2.23 0.47 -0.36 4.78 3.76 -1.11 -3.19 115.29 117.40 2d8m s HIS 62 Ca -0.06 -0.06 -0.17 0.00 -0.15 0.00 0.00 55.06 54.62 2d8m s HIS 62 Cb 0.03 -0.60 -0.00 0.00 1.11 0.00 0.00 32.58 33.12 2d8m s HIS 62 CO 0.38 -0.22 0.46 -1.17 -0.85 0.00 0.00 174.74 173.34 2d8m s LEU 63 N 1.48 4.46 -0.80 0.89 2.96 0.41 -3.29 118.68 124.79 2d8m s LEU 63 Ca -0.03 -0.20 -0.26 0.00 -0.22 0.00 0.00 54.13 53.42 2d8m s LEU 63 Cb -0.13 -2.49 0.04 0.00 0.50 0.00 0.00 46.19 44.11 2d8m s LEU 63 CO -0.03 -0.47 1.31 -0.63 -1.32 0.00 0.00 176.35 175.22 2d8m s ILE 64 N 2.26 3.77 -0.07 6.68 -1.09 -0.55 -2.07 121.20 130.14 2d8m s ILE 64 Ca 0.16 0.15 -0.08 0.00 -2.23 0.00 0.00 60.65 58.65 2d8m s ILE 64 Cb -0.16 -4.95 -0.04 0.00 -1.58 0.00 0.00 42.46 35.73 2d8m s ILE 64 CO 0.13 -1.87 0.21 0.00 -1.23 0.00 0.00 174.94 172.18 2d8m h ALA 66 N 4.69 0.36 -1.95 0.00 0.00 -1.79 -1.58 119.26 118.99 2d8m h ALA 66 Ca -0.53 -1.12 -0.04 0.00 0.00 0.00 0.00 54.91 53.22 2d8m h ALA 66 Cb 1.22 0.23 -0.21 0.00 0.00 0.00 0.00 17.79 19.03 2d8m h ALA 66 CO 0.61 1.23 0.20 -0.59 0.00 0.00 0.00 179.25 180.69 2d8m s PHE 67 N -2.63 -0.69 1.20 0.00 -0.12 -1.26 -4.78 117.98 109.70 2d8m s PHE 67 Ca -0.06 1.45 -0.20 0.00 -0.05 0.00 0.00 56.93 58.06 2d8m s PHE 67 Cb 0.08 0.35 0.30 0.00 -0.63 0.00 0.00 43.02 43.11 2d8m s PHE 67 CO 0.84 -0.47 1.10 0.00 -0.05 0.00 0.00 175.22 176.64 2d8m n ALA 68 N 1.74 -3.26 -2.93 1.99 0.00 -1.26 -4.33 120.51 112.47 2d8m n ALA 68 Ca -0.16 -1.62 -0.14 0.00 0.00 0.00 0.00 53.44 51.51 2d8m n ALA 68 Cb 0.56 -0.11 0.03 0.00 0.00 0.00 0.00 19.45 19.94 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 -4.78 -4.57 -4.58 0.00 3.02 -1.26 -5.03 115.26 98.06 2d8m n ASN 69 Ca 0.15 -0.25 -0.23 0.00 -0.03 0.00 0.00 54.58 54.22 2d8m n ASN 69 Cb 0.58 -3.32 -0.08 0.00 -0.61 0.00 0.00 39.78 36.35 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 -3.05 3.11 0.32 3.41 -4.23 -1.26 -5.04 115.64 108.90 2d8m s THR 70 Ca 0.27 -2.08 0.12 0.00 -1.18 0.00 0.00 61.69 58.81 2d8m s THR 70 Cb -0.12 -2.66 0.04 0.00 1.34 0.00 0.00 72.50 71.10 2d8m s THR 70 CO 0.33 -0.38 1.73 1.55 -0.54 0.00 0.00 174.62 177.31 2d8m h PRO 71 N 2.02 0.00 0.00 3.99 0.13 -1.96 -2.99 132.00 133.19 2d8m h PRO 71 Ca -0.43 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.54 2d8m h PRO 71 Cb 1.25 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 2d8m h PRO 71 CO 0.60 0.48 -1.05 -0.22 -0.23 0.00 0.00 178.00 177.59 2d8m h LYS 72 N 0.00 0.00 -0.33 0.86 1.63 -1.97 -3.25 116.57 113.51 2d8m h LYS 72 Ca -0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 2d8m h LYS 72 Cb 0.86 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.47 2d8m h LYS 72 CO 0.06 0.51 0.11 -0.92 -3.45 0.00 0.00 179.45 175.77 2d8m h TYR 73 N 0.00 0.53 -0.17 1.91 5.03 -1.90 -2.78 116.97 119.59 2d8m h TYR 73 Ca -0.09 -0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.15 2d8m h TYR 73 Cb 1.59 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 39.71 2d8m h TYR 73 CO 0.00 0.52 0.03 1.03 -1.32 0.00 0.00 178.16 178.42 2d8m h SER 74 N 0.39 0.27 -0.15 -2.11 0.87 -1.66 -2.35 113.55 108.81 2d8m h SER 74 Ca 0.11 -0.25 0.02 0.00 -1.23 0.00 0.00 61.79 60.44 2d8m h SER 74 Cb 0.23 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.08 2d8m h SER 74 CO -0.00 0.46 -0.33 -0.61 -0.53 0.00 0.00 176.83 175.81 2d8m h GLN 75 N 0.08 -0.29 0.00 2.24 4.15 -1.57 0.40 115.11 120.12 2d8m h GLN 75 Ca 0.05 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.49 2d8m h GLN 75 Cb 0.30 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.05 2d8m h GLN 75 CO 0.00 -0.19 0.00 0.28 -1.93 0.00 0.00 178.83 176.99 2d8m n VAL 76 N -4.27 1.01 -0.02 2.39 0.31 -1.05 -1.86 118.33 114.83 2d8m n VAL 76 Ca -0.03 0.71 -0.16 0.00 -0.01 0.00 0.00 64.34 64.85 2d8m n VAL 76 Cb 0.22 -1.70 -0.11 0.00 -0.91 0.00 0.00 33.84 31.33 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 0.35 -0.38 7.52 6.46 0.30 -1.36 115.31 128.20 2d8m h LEU 77 Ca 0.00 -0.74 -0.18 0.00 -0.12 0.00 0.00 57.88 56.84 2d8m h LEU 77 Cb 0.02 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 39.85 2d8m h LEU 77 CO 0.00 1.04 -0.63 1.23 -0.62 0.00 0.00 178.44 179.46 2d8m h GLY 78 N -0.30 0.72 0.81 3.75 0.00 -0.43 -3.24 103.07 104.36 2d8m h GLY 78 Ca -0.04 -0.90 0.03 0.00 0.00 0.00 0.00 47.33 46.42 2d8m h GLY 78 CO 0.07 0.80 0.17 1.41 0.00 0.00 0.00 176.54 178.99 2d8m h LEU 79 N 0.48 0.24 0.00 3.11 3.38 -1.56 -3.47 115.31 117.50 2d8m h LEU 79 Ca -0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2d8m h LEU 79 Cb 1.21 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2d8m h LEU 79 CO 0.12 0.18 0.00 0.61 0.09 0.00 0.00 178.44 179.44 2d8m n GLY 80 N -1.21 1.75 3.90 0.83 0.00 -1.15 -5.12 105.19 104.20 2d8m n GLY 80 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.75 2.02 -0.62 -0.02 0.00 -0.53 -5.03 107.32 101.40 2d8m s GLY 81 Ca 0.00 -0.59 -0.27 0.00 0.00 0.00 0.00 44.72 43.86 2d8m s GLY 81 CO 0.00 -0.50 1.41 -1.60 0.00 0.00 0.00 173.10 172.41 2d8m s ARG 82 N -3.12 3.21 -0.40 2.90 3.52 -1.19 -4.70 118.95 119.17 2d8m s ARG 82 Ca 0.42 0.27 -0.20 0.00 -0.13 0.00 0.00 55.73 56.09 2d8m s ARG 82 Cb -0.11 -4.16 0.01 0.00 -1.56 0.00 0.00 34.95 29.13 2d8m s ARG 82 CO 0.27 -2.06 0.63 0.42 -0.81 0.00 0.00 175.30 173.75 2d8m s ILE 83 N 6.22 4.86 0.31 4.11 1.01 -1.26 -0.44 121.20 136.01 2d8m s ILE 83 Ca 0.49 0.31 0.05 0.00 0.00 0.00 0.00 60.65 61.50 2d8m s ILE 83 Cb -0.10 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.17 2d8m s ILE 83 CO 0.22 -0.46 -0.00 0.68 0.00 0.00 0.00 174.94 175.37 2d8m s VAL 84 N 2.75 1.48 1.06 2.92 -7.23 -0.88 -2.01 120.40 118.49 2d8m s VAL 84 Ca 0.23 -2.06 -0.15 0.00 -1.81 0.00 0.00 61.98 58.19 2d8m s VAL 84 Cb -0.14 -2.64 0.22 0.00 0.56 0.00 0.00 36.38 34.37 2d8m s VAL 84 CO 0.17 -0.15 1.13 -0.13 -0.31 0.00 0.00 175.10 175.81 2d8m s ARG 85 N -3.80 -0.07 0.03 4.82 1.81 -1.10 -1.19 118.95 119.45 2d8m s ARG 85 Ca 0.33 0.14 0.01 0.00 -1.72 0.00 0.00 55.73 54.48 2d8m s ARG 85 Cb 0.07 -1.71 -0.26 0.00 -0.45 0.00 0.00 34.95 32.59 2d8m s ARG 85 CO 0.14 -2.99 0.94 1.57 -0.68 0.00 0.00 175.30 174.29 2d8m h LYS 86 N -2.06 0.17 -1.24 3.54 5.09 -1.58 -3.31 116.57 117.17 2d8m h LYS 86 Ca -0.49 -0.29 0.36 0.00 0.09 0.00 0.00 60.65 60.31 2d8m h LYS 86 Cb 1.31 0.11 -0.06 0.00 0.10 0.00 0.00 32.23 33.68 2d8m h LYS 86 CO 0.48 1.02 0.87 1.49 -2.09 0.00 0.00 179.45 181.22 2d8m h GLU 87 N 0.05 0.07 -0.54 0.07 4.81 -1.94 0.35 114.58 117.44 2d8m h GLU 87 Ca -0.19 -0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.14 2d8m h GLU 87 Cb 1.96 -0.02 -0.10 0.00 0.63 0.00 0.00 28.75 31.23 2d8m h GLU 87 CO 0.15 0.04 -0.11 2.35 -0.73 0.00 0.00 179.01 180.71 2d8m h TRP 88 N 0.07 -0.24 0.38 0.92 7.01 -1.97 0.15 115.95 122.27 2d8m h TRP 88 Ca 0.62 0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.65 2d8m h TRP 88 Cb 2.29 0.19 0.00 0.00 -2.10 0.00 0.00 29.16 29.55 2d8m h TRP 88 CO -0.00 -0.22 -0.18 0.28 -2.79 0.00 0.00 178.44 175.53 2d8m h VAL 89 N 0.02 0.59 -0.04 2.65 2.07 -1.18 -1.84 116.25 118.52 2d8m h VAL 89 Ca 0.26 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.35 2d8m h VAL 89 Cb 0.40 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2d8m h VAL 89 CO -0.54 0.08 -0.30 -0.07 0.02 0.00 0.00 177.57 176.76 2d8m h LEU 90 N -0.78 -0.95 -0.65 2.57 3.38 -1.40 0.70 115.31 118.19 2d8m h LEU 90 Ca -0.05 0.11 0.14 0.00 0.09 0.00 0.00 57.88 58.16 2d8m h LEU 90 Cb 0.52 0.36 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 2d8m h LEU 90 CO 0.09 -0.28 -0.06 -0.78 0.09 0.00 0.00 178.44 177.50 2d8m h ASP 91 N -0.35 -0.40 -0.44 -0.43 3.58 -0.81 0.38 116.42 117.95 2d8m h ASP 91 Ca 0.01 0.17 0.08 0.00 0.42 0.00 0.00 57.03 57.71 2d8m h ASP 91 Cb 0.39 0.33 -0.07 0.00 1.72 0.00 0.00 39.33 41.70 2d8m h ASP 91 CO -0.22 -0.16 0.05 0.00 -2.88 0.00 0.00 179.24 176.02 2d8m h HIS 93 N 0.17 -0.44 -0.97 0.00 -0.00 0.92 1.12 115.15 115.95 2d8m h HIS 93 Ca 0.22 -0.01 0.15 0.00 -0.00 0.00 0.00 60.37 60.73 2d8m h HIS 93 Cb 0.30 0.15 -0.16 0.00 -0.00 0.00 0.00 27.41 27.70 2d8m h HIS 93 CO -0.24 -0.27 -0.38 -2.13 -0.00 0.00 0.00 177.93 174.90 2d8m n ARG 94 N -3.82 -0.23 0.11 5.26 3.00 0.12 0.20 116.66 121.29 2d8m n ARG 94 Ca -0.06 1.49 0.13 0.00 -0.00 0.00 0.00 57.85 59.41 2d8m n ARG 94 Cb 0.19 -2.21 0.37 0.00 0.00 0.00 0.00 32.46 30.80 2d8m n ARG 94 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.63 178.15 2d8m h MET 95 N 0.00 0.00 -5.60 -0.14 2.86 -0.68 -3.47 114.93 107.89 2d8m h MET 95 Ca 0.33 0.00 -0.42 0.00 -2.06 0.00 0.00 59.70 57.56 2d8m h MET 95 Cb 0.58 0.00 0.08 0.00 0.06 0.00 0.00 31.60 32.32 2d8m h MET 95 CO -0.96 0.00 -0.67 0.54 1.06 0.00 0.00 176.91 176.88 2d8m n ARG 96 N -2.31 -6.66 -4.18 1.72 1.74 0.53 -4.99 116.66 102.51 2d8m n ARG 96 Ca 0.05 0.79 -0.11 0.00 -0.77 0.00 0.00 57.85 57.82 2d8m n ARG 96 Cb 0.44 -5.76 -0.10 0.00 -1.02 0.00 0.00 32.46 26.02 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 -6.22 0.86 -0.31 5.56 1.70 0.24 -4.79 118.95 115.99 2d8m s ARG 97 Ca 0.53 -1.35 -0.22 0.00 -0.47 0.00 0.00 55.73 54.22 2d8m s ARG 97 Cb -0.24 -0.23 -0.00 0.00 -0.57 0.00 0.00 34.95 33.90 2d8m s ARG 97 CO 0.66 -0.02 0.70 0.50 -1.08 0.00 0.00 175.30 176.06 2d8m s ARG 98 N -3.83 3.92 0.00 3.89 3.52 -1.26 -4.39 118.95 120.79 2d8m s ARG 98 Ca 0.13 0.43 -0.00 0.00 -0.13 0.00 0.00 55.73 56.15 2d8m s ARG 98 Cb 0.05 -3.73 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 2d8m s ARG 98 CO -0.04 -0.62 0.08 -0.51 -0.81 0.00 0.00 175.30 173.40 2d8m s LEU 99 N 2.77 3.90 -0.58 -0.88 1.43 -1.26 -5.05 118.68 119.02 2d8m s LEU 99 Ca 0.28 0.14 -0.27 0.00 -1.03 0.00 0.00 54.13 53.26 2d8m s LEU 99 Cb -0.15 -2.29 -0.02 0.00 0.03 0.00 0.00 46.19 43.76 2d8m s LEU 99 CO 0.12 0.27 1.85 -2.16 0.23 0.00 0.00 176.35 176.65 2d8m s PRO 100 N -1.78 2.71 0.61 1.29 0.04 -1.26 -4.82 135.00 131.79 2d8m s PRO 100 Ca 0.23 0.68 0.25 0.00 0.04 0.00 0.00 61.00 62.21 2d8m s PRO 100 Cb -0.12 -4.36 1.00 0.00 0.04 0.00 0.00 34.50 31.06 2d8m s PRO 100 CO 0.14 -2.64 1.44 0.66 0.04 0.00 0.00 177.00 176.65 2d8m h SER 101 N 14.69 0.00 -0.75 6.66 4.64 -1.96 0.31 113.55 137.14 2d8m h SER 101 Ca -0.27 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.18 2d8m h SER 101 Cb 1.16 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.17 2d8m h SER 101 CO 1.20 0.00 0.34 1.56 -0.87 0.00 0.00 176.83 179.06 2d8m h GLN 102 N 0.00 0.52 0.00 4.77 7.50 -1.99 0.40 115.11 126.30 2d8m h GLN 102 Ca 0.36 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.48 2d8m h GLN 102 Cb 2.34 -0.12 0.00 0.00 0.05 0.00 0.00 27.48 29.76 2d8m h GLN 102 CO -0.00 0.34 0.00 0.00 -1.50 0.00 0.00 178.83 177.67 2d8m h ARG 103 N 0.53 0.00 -0.43 1.46 2.47 -0.76 -1.12 114.38 116.53 2d8m h ARG 103 Ca 0.40 0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.82 2d8m h ARG 103 Cb 0.53 0.00 -0.21 0.00 -1.65 0.00 0.00 29.97 28.64 2d8m h ARG 103 CO -0.34 0.00 -0.47 0.66 0.56 0.00 0.00 179.97 180.37 2d8m n TYR 104 N -2.69 1.51 -2.79 3.04 4.02 0.14 -5.00 117.16 115.39 2d8m n TYR 104 Ca -0.02 -1.90 -0.43 0.00 -0.01 0.00 0.00 57.90 55.54 2d8m n TYR 104 Cb 0.07 -0.40 -0.04 0.00 -0.02 0.00 0.00 39.34 38.95 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 -3.42 3.95 -0.15 7.72 1.43 -0.43 -2.71 118.68 125.07 2d8m s LEU 105 Ca 0.46 0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 53.60 2d8m s LEU 105 Cb 0.40 -3.24 -0.24 0.00 0.03 0.00 0.00 46.19 43.14 2d8m s LEU 105 CO -0.01 -1.09 0.33 0.24 0.23 0.00 0.00 176.35 176.05 2d8m h MET 106 N 9.11 0.19 -6.74 1.70 2.86 -1.75 -3.44 114.93 116.86 2d8m h MET 106 Ca -0.24 -0.32 -0.49 0.00 -2.06 0.00 0.00 59.70 56.59 2d8m h MET 106 Cb 1.07 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.83 2d8m h MET 106 CO 1.04 1.15 0.20 0.00 1.06 0.00 0.00 176.91 180.37 2d8m s ALA 107 N -2.50 3.30 0.57 6.32 0.00 -1.22 -4.87 121.76 123.37 2d8m s ALA 107 Ca -0.24 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.00 2d8m s ALA 107 Cb 0.06 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2d8m s ALA 107 CO 0.72 0.26 0.00 0.41 0.00 0.00 0.00 175.76 177.15 2d8m n GLY 108 N 0.41 -4.27 3.56 0.00 0.00 -1.26 -4.54 105.19 99.09 2d8m n GLY 108 Ca 0.01 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.04 2d8m n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8m s PRO 109 N -4.54 2.55 1.40 1.61 0.04 -1.26 -4.83 135.00 129.97 2d8m s PRO 109 Ca 0.00 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.68 2d8m s PRO 109 Cb 0.00 -5.08 0.00 0.00 0.04 0.00 0.00 34.50 29.46 2d8m s PRO 109 CO 0.00 -3.42 0.00 0.41 0.04 0.00 0.00 177.00 174.03 2d8m n GLY 110 N 6.77 -1.30 2.99 0.56 0.00 -1.26 -4.77 105.19 108.18 2d8m n GLY 110 Ca 0.41 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 2d8m n GLY 110 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8m s SER 111 N -5.00 3.33 -0.54 1.61 1.04 -1.26 -5.08 113.70 107.80 2d8m s SER 111 Ca 0.00 -0.85 -0.05 0.00 0.48 0.00 0.00 55.95 55.53 2d8m s SER 111 Cb 0.00 -1.21 0.14 0.00 0.10 0.00 0.00 66.02 65.05 2d8m s SER 111 CO 0.00 -0.14 0.37 -0.55 0.98 0.00 0.00 173.24 173.90 2d8m s SER 112 N 1.41 5.44 -1.29 7.02 0.15 -1.26 -4.76 113.70 120.40 2d8m s SER 112 Ca -0.01 -2.40 -0.01 0.00 0.70 0.00 0.00 55.95 54.23 2d8m s SER 112 Cb -0.16 -1.90 0.01 0.00 -1.71 0.00 0.00 66.02 62.26 2d8m s SER 112 CO -0.08 -0.50 0.02 -1.54 1.20 0.00 0.00 173.24 172.34 2d8m n SER 113 N 4.14 0.69 -4.05 5.45 3.41 -1.26 -4.85 113.62 117.15 2d8m n SER 113 Ca 0.02 -1.06 -0.34 0.00 -0.26 0.00 0.00 58.87 57.23 2d8m n SER 113 Cb 0.40 -1.31 -0.08 0.00 -0.26 0.00 0.00 64.21 62.96 2d8m n SER 113 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2d8m s GLU 114 N -6.61 3.04 0.48 4.33 -1.05 -1.26 -5.07 118.70 112.57 2d8m s GLU 114 Ca 0.03 -3.27 0.07 0.00 -0.15 0.00 0.00 54.97 51.65 2d8m s GLU 114 Cb -0.02 -3.81 0.03 0.00 -0.44 0.00 0.00 34.13 29.89 2d8m s GLU 114 CO 0.83 -1.27 0.66 -1.21 0.95 0.00 0.00 175.26 175.23 2d8m s GLU 115 N -1.33 2.63 0.03 -4.83 0.41 -1.26 -5.11 118.70 109.24 2d8m s GLU 115 Ca 0.26 -1.26 0.02 0.00 -0.41 0.00 0.00 54.97 53.59 2d8m s GLU 115 Cb -0.07 -2.68 -0.04 0.00 -1.78 0.00 0.00 34.13 29.56 2d8m s GLU 115 CO -0.13 -0.51 0.02 0.34 -0.49 0.00 0.00 175.26 174.49 2d8m s ASP 116 N -4.45 5.19 0.22 -0.19 -1.08 -1.26 -5.02 116.67 110.08 2d8m s ASP 116 Ca 0.57 -0.04 -0.08 0.00 -0.52 0.00 0.00 52.55 52.48 2d8m s ASP 116 Cb -0.09 -1.34 0.33 0.00 -1.46 0.00 0.00 42.92 40.36 2d8m s ASP 116 CO 0.36 0.24 1.72 -0.33 0.52 0.00 0.00 175.17 177.68 2d8m h GLU 117 N 3.96 0.34 -1.17 4.34 4.39 -2.02 -1.82 114.58 122.60 2d8m h GLU 117 Ca -0.48 -0.02 -0.65 0.00 0.34 0.00 0.00 59.36 58.55 2d8m h GLU 117 Cb 1.17 -0.08 -0.34 0.00 -0.10 0.00 0.00 28.75 29.40 2d8m h GLU 117 CO 0.59 0.23 0.20 0.00 -1.16 0.00 0.00 179.01 178.88 2d8m n ALA 118 N -2.53 5.82 -0.34 3.43 0.00 -1.26 -4.76 120.51 120.87 2d8m n ALA 118 Ca 0.10 -3.79 0.18 0.00 0.00 0.00 0.00 53.44 49.93 2d8m n ALA 118 Cb 0.33 -1.23 0.40 0.00 0.00 0.00 0.00 19.45 18.95 2d8m n ALA 118 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2d8m h SER 119 N 2.30 0.64 -3.47 0.00 0.02 -1.73 -3.33 113.55 107.99 2d8m h SER 119 Ca 0.49 0.11 -0.67 0.00 -0.84 0.00 0.00 61.79 60.88 2d8m h SER 119 Cb 0.90 0.01 -0.17 0.00 0.14 0.00 0.00 62.40 63.28 2d8m h SER 119 CO 1.23 0.14 0.03 -1.38 -1.14 0.00 0.00 176.83 175.71 2d8m s HIS 120 N -5.72 3.08 0.03 3.45 -3.43 -1.26 -4.95 115.29 106.49 2d8m s HIS 120 Ca -0.10 -0.28 -0.27 0.00 -0.80 0.00 0.00 55.06 53.61 2d8m s HIS 120 Cb 0.26 -3.31 -0.17 0.00 -1.43 0.00 0.00 32.58 27.94 2d8m s HIS 120 CO 0.80 -0.89 1.35 0.77 -2.00 0.00 0.00 174.74 174.77 2d8m h SER 121 N 8.89 -0.47 0.00 7.38 0.02 -1.82 -3.49 113.55 124.05 2d8m h SER 121 Ca -0.26 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2d8m h SER 121 Cb 1.10 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2d8m h SER 121 CO 0.89 -0.17 0.00 0.61 -1.14 0.00 0.00 176.83 177.03 2d8m n GLY 122 N -0.69 2.99 7.00 -3.77 0.00 -1.26 -5.10 105.19 104.35 2d8m n GLY 122 Ca -0.11 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 0.00 2.54 3.82 -0.02 0.00 -1.26 -4.85 105.19 105.42 2d8m n GLY 123 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 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 -4.00 -0.05 0.00 1.61 0.15 -1.26 -5.12 113.70 105.03 2d8m s SER 124 Ca 0.00 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2d8m s SER 124 Cb 0.00 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2d8m s SER 124 CO 0.00 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.23 2d8m n GLY 125 N -0.63 0.05 3.77 9.45 0.00 -1.26 -4.72 105.19 111.85 2d8m n GLY 125 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 0.44 4.11 0.18 1.61 0.04 -1.26 -5.05 135.00 135.07 2d8m s PRO 126 Ca 0.00 1.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 2d8m s PRO 126 Cb 0.00 -2.76 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2d8m s PRO 126 CO 0.00 -0.30 0.10 -1.54 0.04 0.00 0.00 177.00 175.30 2d8m s SER 127 N -1.00 0.34 -0.57 6.66 1.04 -1.26 -5.05 113.70 113.86 2d8m s SER 127 Ca 0.55 -1.32 -0.02 0.00 0.48 0.00 0.00 55.95 55.64 2d8m s SER 127 Cb -0.33 0.32 0.33 0.00 0.10 0.00 0.00 66.02 66.45 2d8m s SER 127 CO 0.42 -0.78 2.10 -1.54 0.98 0.00 0.00 173.24 174.41 2d8m n SER 128 N -0.23 7.22 -0.00 7.02 3.41 -1.26 -5.31 113.62 124.46 2d8m n SER 128 Ca -0.01 -3.53 0.16 0.00 -0.26 0.00 0.00 58.87 55.23 2d8m n SER 128 Cb 0.65 -1.04 0.95 0.00 -0.26 0.00 0.00 64.21 64.51 2d8m n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49