#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8m n SER 2 N 0.00 3.40 -2.32 1.61 7.64 -1.26 -4.90 113.62 117.79 2d8m n SER 2 Ca 0.00 1.14 -0.32 0.00 1.01 0.00 0.00 58.87 60.69 2d8m n SER 2 Cb 0.00 -1.61 0.07 0.00 -1.01 0.00 0.00 64.21 61.66 2d8m n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2d8m n SER 3 N -0.07 7.48 0.00 6.43 3.41 -1.26 -5.00 113.62 124.61 2d8m n SER 3 Ca 0.05 -3.67 0.00 0.00 -0.26 0.00 0.00 58.87 54.99 2d8m n SER 3 Cb 0.41 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2d8m n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d8m n GLY 4 N -0.65 -0.34 3.00 5.00 0.00 -1.26 -5.04 105.19 105.91 2d8m n GLY 4 Ca 0.57 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 2d8m n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d8m s SER 5 N -4.00 -0.16 0.08 1.61 0.01 -1.26 -5.07 113.70 104.91 2d8m s SER 5 Ca 0.00 0.35 -0.36 0.00 1.31 0.00 0.00 55.95 57.25 2d8m s SER 5 Cb 0.00 0.29 -0.18 0.00 0.21 0.00 0.00 66.02 66.35 2d8m s SER 5 CO 0.00 -0.11 1.57 0.28 0.41 0.00 0.00 173.24 175.39 2d8m h SER 6 N 6.57 -1.37 -5.00 2.44 0.02 -2.03 -3.49 113.55 110.69 2d8m h SER 6 Ca -0.34 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2d8m h SER 6 Cb 1.17 0.45 0.00 0.00 0.14 0.00 0.00 62.40 64.16 2d8m h SER 6 CO 0.41 -0.68 0.00 0.61 -1.14 0.00 0.00 176.83 176.02 2d8m n GLY 7 N -1.58 2.58 3.30 -3.77 0.00 -1.26 -5.12 105.19 99.34 2d8m n GLY 7 Ca -0.13 -2.11 -0.14 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.17 0.58 1.14 1.61 8.01 -1.26 -5.03 118.70 121.58 2d8m s GLU 8 Ca 0.00 0.29 -0.17 0.00 0.01 0.00 0.00 54.97 55.10 2d8m s GLU 8 Cb 0.00 0.27 0.26 0.00 -4.31 0.00 0.00 34.13 30.35 2d8m s GLU 8 CO 0.00 -0.12 1.10 -1.25 0.01 0.00 0.00 175.26 175.01 2d8m s PRO 9 N -0.40 -0.73 0.08 0.39 0.04 -1.26 -4.99 135.00 128.13 2d8m s PRO 9 Ca -0.05 0.11 0.20 0.00 0.04 0.00 0.00 61.00 61.30 2d8m s PRO 9 Cb -0.03 -1.64 -0.13 0.00 0.04 0.00 0.00 34.50 32.74 2d8m s PRO 9 CO 0.02 -3.42 0.79 0.54 0.04 0.00 0.00 177.00 174.97 2d8m n ARG 10 N -4.59 0.63 -2.93 4.56 5.12 -1.26 -4.89 116.66 113.30 2d8m n ARG 10 Ca 0.11 0.08 -0.40 0.00 -1.93 0.00 0.00 57.85 55.71 2d8m n ARG 10 Cb 0.59 -1.74 -0.05 0.00 -1.16 0.00 0.00 32.46 30.10 2d8m n ARG 10 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2d8m s ARG 11 N -3.19 4.53 0.00 5.56 6.06 -1.26 -4.93 118.95 125.72 2d8m s ARG 11 Ca -0.03 1.14 0.15 0.00 -2.50 0.00 0.00 55.73 54.49 2d8m s ARG 11 Cb 0.10 -3.38 0.92 0.00 0.06 0.00 0.00 34.95 32.65 2d8m s ARG 11 CO 0.82 0.24 1.33 -0.35 -2.50 0.00 0.00 175.30 174.84 2d8m n PRO 12 N 2.92 0.49 -1.34 5.12 -0.04 -1.26 -4.85 135.00 136.03 2d8m n PRO 12 Ca -0.01 0.00 -0.58 0.00 -0.04 0.00 0.00 63.50 62.86 2d8m n PRO 12 Cb 0.50 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 2d8m n PRO 12 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2d8m n ARG 13 N -0.99 0.00 -4.02 0.54 0.00 -1.26 -4.89 116.66 106.03 2d8m n ARG 13 Ca 0.12 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.62 2d8m n ARG 13 Cb 0.05 -1.39 -0.09 0.00 0.00 0.00 0.00 32.46 31.03 2d8m n ARG 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2d8m s ALA 14 N 4.48 3.44 0.22 5.13 0.00 -1.26 -5.11 121.76 128.67 2d8m s ALA 14 Ca 1.06 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2d8m s ALA 14 Cb -1.39 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 19.84 2d8m s ALA 14 CO 0.67 0.25 0.00 0.41 0.00 0.00 0.00 175.76 177.09 2d8m n GLY 15 N 3.28 1.29 0.00 0.00 0.00 -1.26 -4.95 105.19 103.54 2d8m n GLY 15 Ca -0.17 -2.01 0.08 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.77 0.34 0.04 1.61 -0.04 -1.26 -2.63 135.00 132.29 2d8m n PRO 16 Ca 0.00 0.08 -0.20 0.00 -0.04 0.00 0.00 63.50 63.33 2d8m n PRO 16 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 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 0.30 -0.69 0.54 4.57 -1.94 -3.35 114.58 114.02 2d8m h GLU 17 Ca 0.00 -0.51 0.12 0.00 -1.18 0.00 0.00 59.36 57.80 2d8m h GLU 17 Cb 0.07 0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.81 2d8m h GLU 17 CO 0.00 1.19 0.46 1.49 -1.18 0.00 0.00 179.01 180.97 2d8m h GLU 18 N 0.08 0.41 0.28 1.92 4.57 -1.87 -2.08 114.58 117.89 2d8m h GLU 18 Ca -0.35 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 57.79 2d8m h GLU 18 Cb 2.06 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 30.56 2d8m h GLU 18 CO 0.14 0.27 -0.13 -0.07 -1.18 0.00 0.00 179.01 178.03 2d8m h LEU 19 N 0.42 -0.32 -2.08 1.64 -0.00 -1.70 -1.78 115.31 111.49 2d8m h LEU 19 Ca 0.33 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.22 2d8m h LEU 19 Cb 0.70 0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.44 2d8m h LEU 19 CO -0.10 -0.23 0.07 1.23 -0.00 0.00 0.00 178.44 179.42 2d8m h GLY 20 N -0.38 0.00 1.20 0.83 0.00 0.11 0.29 103.07 105.12 2d8m h GLY 20 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2d8m h GLY 20 CO 0.06 0.00 -0.35 0.28 0.00 0.00 0.00 176.54 176.53 2d8m n LYS 21 N -2.65 0.07 -0.01 4.80 4.76 -0.69 -2.97 118.16 121.47 2d8m n LYS 21 Ca -0.02 -0.04 -0.03 0.00 -2.87 0.00 0.00 58.31 55.36 2d8m n LYS 21 Cb 0.12 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.09 0.16 -0.92 -0.18 2.04 -0.21 -3.37 117.51 115.12 2d8m h ILE 22 Ca 0.00 -1.04 -0.63 0.00 1.00 0.00 0.00 64.86 64.19 2d8m h ILE 22 Cb 0.49 0.29 -0.32 0.00 -0.74 0.00 0.00 36.82 36.54 2d8m h ILE 22 CO 0.00 0.05 0.41 0.18 0.00 0.00 0.00 178.15 178.79 2d8m n LEU 23 N -4.82 6.88 -4.65 1.44 4.77 0.94 -4.85 117.00 116.72 2d8m n LEU 23 Ca -0.02 -4.38 -0.42 0.00 -0.03 0.00 0.00 56.01 51.15 2d8m n LEU 23 Cb 0.07 -0.80 -0.03 0.00 -2.33 0.00 0.00 43.42 40.34 2d8m n LEU 23 CO 0.06 1.62 1.43 -1.58 -1.33 0.00 0.00 177.39 177.59 2d8m s GLN 24 N -3.74 4.02 0.00 3.23 2.00 -1.16 -1.80 119.66 122.21 2d8m s GLN 24 Ca 0.61 2.11 0.00 0.00 -2.00 0.00 0.00 55.36 56.08 2d8m s GLN 24 Cb 0.48 -4.04 0.00 0.00 0.80 0.00 0.00 33.01 30.25 2d8m s GLN 24 CO 0.01 -1.05 0.00 0.41 -0.50 0.00 0.00 175.29 174.16 2d8m n GLY 25 N 4.41 0.64 3.68 2.59 0.00 -1.25 -5.06 105.19 110.19 2d8m n GLY 25 Ca 0.19 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2d8m n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d8m s VAL 26 N -2.00 3.97 -0.08 1.61 1.01 -0.74 -5.05 120.40 119.12 2d8m s VAL 26 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.02 2d8m s VAL 26 Cb 0.00 -2.88 0.01 0.00 0.00 0.00 0.00 36.38 33.52 2d8m s VAL 26 CO 0.00 0.14 -0.13 -0.69 0.00 0.00 0.00 175.10 174.43 2d8m s VAL 27 N -1.28 1.24 0.30 2.92 1.01 -1.26 -1.27 120.40 122.06 2d8m s VAL 27 Ca 0.25 -0.52 0.10 0.00 0.00 0.00 0.00 61.98 61.81 2d8m s VAL 27 Cb -0.12 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2d8m s VAL 27 CO 0.17 0.38 -0.05 0.68 0.00 0.00 0.00 175.10 176.28 2d8m s VAL 28 N 0.80 2.81 -0.03 2.92 -7.23 0.86 -1.45 120.40 119.08 2d8m s VAL 28 Ca -0.12 -2.08 -0.01 0.00 -1.81 0.00 0.00 61.98 57.97 2d8m s VAL 28 Cb -0.15 -2.68 0.03 0.00 0.56 0.00 0.00 36.38 34.14 2d8m s VAL 28 CO 0.02 -0.30 0.06 -0.69 -0.31 0.00 0.00 175.10 173.87 2d8m s VAL 29 N -2.46 -0.05 -0.23 1.32 1.01 -1.19 -2.78 120.40 116.02 2d8m s VAL 29 Ca 0.32 0.17 -0.21 0.00 0.00 0.00 0.00 61.98 62.26 2d8m s VAL 29 Cb -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.22 2d8m s VAL 29 CO 0.18 0.07 0.67 -0.76 0.00 0.00 0.00 175.10 175.27 2d8m s LEU 30 N 0.91 4.09 -0.25 3.92 1.43 -1.26 -0.48 118.68 127.04 2d8m s LEU 30 Ca -0.07 0.82 -0.02 0.00 -1.03 0.00 0.00 54.13 53.83 2d8m s LEU 30 Cb -0.10 -2.94 0.13 0.00 0.03 0.00 0.00 46.19 43.30 2d8m s LEU 30 CO -0.03 -0.37 0.31 -0.55 0.23 0.00 0.00 176.35 175.94 2d8m s SER 31 N 1.35 1.09 0.00 2.29 0.15 -0.87 -4.87 113.70 112.83 2d8m s SER 31 Ca 0.29 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.64 2d8m s SER 31 Cb -0.16 0.69 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2d8m s SER 31 CO 0.09 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2d8m n GLY 32 N 5.33 1.44 3.49 9.45 0.00 -1.26 -3.51 105.19 120.13 2d8m n GLY 32 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 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 2.34 -0.04 1.61 0.08 -1.26 -4.48 117.98 114.23 2d8m s PHE 33 Ca 0.00 -0.32 0.01 0.00 0.12 0.00 0.00 56.93 56.74 2d8m s PHE 33 Cb 0.00 -1.03 0.02 0.00 -0.57 0.00 0.00 43.02 41.44 2d8m s PHE 33 CO 0.00 0.69 -0.03 -0.65 -0.10 0.00 0.00 175.22 175.12 2d8m s GLN 34 N -3.44 0.68 0.95 0.44 -0.21 -1.26 -4.80 119.66 112.02 2d8m s GLN 34 Ca 0.29 -0.05 -0.12 0.00 0.02 0.00 0.00 55.36 55.51 2d8m s GLN 34 Cb -0.05 -0.75 0.10 0.00 1.00 0.00 0.00 33.01 33.31 2d8m s GLN 34 CO 0.15 -0.10 0.78 0.27 -2.12 0.00 0.00 175.29 174.27 2d8m n ASN 35 N 4.11 -0.91 0.00 5.90 0.23 -1.26 -1.73 115.26 121.60 2d8m n ASN 35 Ca -0.25 0.34 0.07 0.00 -0.53 0.00 0.00 54.58 54.22 2d8m n ASN 35 Cb 0.51 -1.33 0.40 0.00 -2.08 0.00 0.00 39.78 37.28 2d8m n ASN 35 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2d8m n PRO 36 N -3.08 0.31 0.03 -0.53 -0.04 -1.26 -4.79 135.00 125.65 2d8m n PRO 36 Ca 0.09 0.09 -0.15 0.00 -0.04 0.00 0.00 63.50 63.49 2d8m n PRO 36 Cb 0.53 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.40 2d8m n PRO 36 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2d8m h PHE 37 N 0.00 -1.49 -0.74 0.54 3.57 -1.76 0.12 116.94 117.18 2d8m h PHE 37 Ca 0.00 0.05 0.13 0.00 3.53 0.00 0.00 57.97 61.68 2d8m h PHE 37 Cb 0.09 0.66 -0.09 0.00 2.79 0.00 0.00 35.95 39.39 2d8m h PHE 37 CO 0.00 -0.53 0.31 0.07 -2.23 0.00 0.00 178.31 175.93 2d8m h ARG 38 N -0.61 0.46 -0.18 1.11 0.11 -1.85 0.18 114.38 113.61 2d8m h ARG 38 Ca 0.02 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 2d8m h ARG 38 Cb 0.67 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.63 2d8m h ARG 38 CO -0.36 0.31 0.07 1.03 0.10 0.00 0.00 179.97 181.12 2d8m h SER 39 N 0.48 0.22 0.00 0.08 0.87 -1.62 -1.86 113.55 111.71 2d8m h SER 39 Ca 0.39 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.93 2d8m h SER 39 Cb 0.56 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2d8m h SER 39 CO -0.37 0.21 -0.05 -0.08 -0.53 0.00 0.00 176.83 176.01 2d8m h GLU 40 N 0.25 0.03 -0.56 2.24 4.57 0.19 -3.08 114.58 118.22 2d8m h GLU 40 Ca 0.06 -0.04 0.10 0.00 -1.18 0.00 0.00 59.36 58.30 2d8m h GLU 40 Cb 0.06 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.59 2d8m h GLU 40 CO -0.01 0.84 0.14 -0.07 -1.18 0.00 0.00 179.01 178.74 2d8m h LEU 41 N -0.77 0.06 0.60 1.64 3.38 -0.72 -2.22 115.31 117.29 2d8m h LEU 41 Ca -0.01 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2d8m h LEU 41 Cb 0.86 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2d8m h LEU 41 CO 0.01 0.05 -0.49 -0.09 0.09 0.00 0.00 178.44 178.01 2d8m h ARG 42 N 0.29 -1.02 -0.74 1.13 2.43 -1.45 0.31 114.38 115.34 2d8m h ARG 42 Ca 0.28 0.07 0.09 0.00 -0.81 0.00 0.00 59.98 59.62 2d8m h ARG 42 Cb 0.39 0.23 -0.12 0.00 -0.42 0.00 0.00 29.97 30.05 2d8m h ARG 42 CO -0.34 -0.68 -0.49 0.22 -1.51 0.00 0.00 179.97 177.17 2d8m h ASP 43 N -1.06 -1.73 -0.63 -3.80 3.58 -1.39 0.17 116.42 111.56 2d8m h ASP 43 Ca -0.08 0.28 0.01 0.00 0.42 0.00 0.00 57.03 57.66 2d8m h ASP 43 Cb 0.89 0.78 -0.03 0.00 1.72 0.00 0.00 39.33 42.69 2d8m h ASP 43 CO 0.00 -0.31 0.42 0.11 -2.88 0.00 0.00 179.24 176.58 2d8m h LYS 44 N -0.15 0.82 -0.53 0.28 1.57 -1.27 -1.79 116.57 115.50 2d8m h LYS 44 Ca 0.19 -0.05 0.11 0.00 -1.87 0.00 0.00 60.65 59.03 2d8m h LYS 44 Cb 0.53 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 2d8m h LYS 44 CO -0.79 0.54 0.36 0.00 -0.57 0.00 0.00 179.45 178.99 2d8m h ALA 45 N 1.24 2.19 -0.39 3.86 0.00 0.23 -1.13 119.26 125.25 2d8m h ALA 45 Ca 0.23 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 2d8m h ALA 45 Cb -0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2d8m h ALA 45 CO -0.06 -0.32 -0.25 -0.07 0.00 0.00 0.00 179.25 178.55 2d8m h LEU 46 N 0.23 0.89 -0.13 0.00 3.38 0.08 -2.69 115.31 117.07 2d8m h LEU 46 Ca 0.25 -0.43 0.04 0.00 0.09 0.00 0.00 57.88 57.83 2d8m h LEU 46 Cb 0.67 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2d8m h LEU 46 CO -0.05 1.13 -0.15 -0.33 0.09 0.00 0.00 178.44 179.13 2d8m h GLU 47 N 0.66 -0.18 0.00 1.13 5.08 -1.01 0.11 114.58 120.38 2d8m h GLU 47 Ca 0.08 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2d8m h GLU 47 Cb 0.82 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2d8m h GLU 47 CO 0.07 -0.12 0.22 -0.07 -1.00 0.00 0.00 179.01 178.11 2d8m h LEU 48 N -0.19 0.00 -0.02 1.33 3.38 -1.53 0.19 115.31 118.48 2d8m h LEU 48 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2d8m h LEU 48 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2d8m h LEU 48 CO -0.24 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.90 2d8m n GLY 49 N -1.26 1.21 3.78 0.83 0.00 0.40 -0.04 105.19 110.12 2d8m n GLY 49 Ca -0.01 -0.42 -0.28 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.02 3.56 0.10 4.61 0.00 -1.02 -3.95 121.76 123.05 2d8m s ALA 50 Ca 0.00 -1.13 -0.19 0.00 0.00 0.00 0.00 51.96 50.64 2d8m s ALA 50 Cb 0.00 -1.39 -0.07 0.00 0.00 0.00 0.00 23.12 21.67 2d8m s ALA 50 CO 0.00 0.61 0.58 0.15 0.00 0.00 0.00 175.76 177.10 2d8m s LYS 51 N -2.79 4.18 -0.33 0.00 3.01 -0.40 -4.33 119.74 119.08 2d8m s LYS 51 Ca 0.30 0.72 -0.04 0.00 -1.01 0.00 0.00 55.97 55.94 2d8m s LYS 51 Cb -0.11 -3.15 0.05 0.00 -1.01 0.00 0.00 37.83 33.61 2d8m s LYS 51 CO 0.23 0.59 0.07 -0.47 0.51 0.00 0.00 175.35 176.27 2d8m s TYR 52 N -1.21 3.28 -0.05 3.18 5.04 -1.26 -0.10 117.35 126.23 2d8m s TYR 52 Ca 0.32 -1.69 -0.03 0.00 -2.44 0.00 0.00 57.07 53.23 2d8m s TYR 52 Cb -0.19 -2.27 -0.04 0.00 0.35 0.00 0.00 41.96 39.82 2d8m s TYR 52 CO 0.19 -0.78 0.10 1.03 -1.34 0.00 0.00 175.55 174.75 2d8m s ARG 53 N 1.32 3.20 0.51 4.97 1.81 -1.12 -5.00 118.95 124.64 2d8m s ARG 53 Ca -0.03 -0.35 0.33 0.00 -1.72 0.00 0.00 55.73 53.96 2d8m s ARG 53 Cb -0.20 -2.97 1.35 0.00 -0.45 0.00 0.00 34.95 32.68 2d8m s ARG 53 CO 0.01 0.70 1.96 -1.00 -0.68 0.00 0.00 175.30 176.28 2d8m h PRO 54 N 4.49 0.00 -2.99 3.54 0.13 -1.94 -3.37 132.00 131.85 2d8m h PRO 54 Ca -0.51 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 2d8m h PRO 54 Cb 1.20 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.16 2d8m h PRO 54 CO 0.61 0.00 -0.09 -0.51 -0.23 0.00 0.00 178.00 177.77 2d8m s ASP 55 N -5.43 -0.30 0.14 1.44 1.01 -1.26 -4.94 116.67 107.33 2d8m s ASP 55 Ca 0.01 0.03 -0.31 0.00 0.71 0.00 0.00 52.55 52.99 2d8m s ASP 55 Cb 0.09 0.43 -0.11 0.00 1.01 0.00 0.00 42.92 44.34 2d8m s ASP 55 CO 0.51 -0.66 1.82 0.86 0.21 0.00 0.00 175.17 177.91 2d8m s TRP 56 N -2.42 2.26 0.31 4.23 -0.11 -1.26 -4.97 118.94 116.98 2d8m s TRP 56 Ca -0.06 0.02 0.03 0.00 1.22 0.00 0.00 56.10 57.31 2d8m s TRP 56 Cb -0.01 -4.18 -0.05 0.00 -1.50 0.00 0.00 33.47 27.73 2d8m s TRP 56 CO -0.02 -4.81 0.09 -0.08 -4.62 0.00 0.00 176.95 167.51 2d8m s THR 57 N 2.50 0.77 -0.97 5.86 -1.32 -1.26 -5.00 115.64 116.21 2d8m s THR 57 Ca 0.80 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 59.33 2d8m s THR 57 Cb -0.47 -2.65 0.04 0.00 -1.51 0.00 0.00 72.50 67.92 2d8m s THR 57 CO 0.36 0.00 1.17 -1.14 -2.21 0.00 0.00 174.62 172.79 2d8m n ARG 58 N -0.61 0.01 0.02 7.08 0.63 -1.26 -0.79 116.66 121.74 2d8m n ARG 58 Ca -0.01 0.43 0.11 0.00 -0.92 0.00 0.00 57.85 57.45 2d8m n ARG 58 Cb 0.66 -1.52 -0.09 0.00 0.45 0.00 0.00 32.46 31.97 2d8m n ARG 58 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2d8m n ASP 59 N -1.53 0.40 -4.68 6.15 8.00 -1.26 -4.91 116.55 118.73 2d8m n ASP 59 Ca 0.01 -0.09 -0.42 0.00 0.71 0.00 0.00 54.79 55.00 2d8m n ASP 59 Cb 0.06 1.33 -0.03 0.00 -0.02 0.00 0.00 41.12 42.46 2d8m n ASP 59 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2d8m s SER 60 N -4.39 6.85 -0.18 -2.24 0.01 0.03 -4.75 113.70 109.03 2d8m s SER 60 Ca -0.02 2.04 -0.15 0.00 1.31 0.00 0.00 55.95 59.13 2d8m s SER 60 Cb 0.13 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.75 2d8m s SER 60 CO 0.86 -0.75 -0.24 0.35 0.41 0.00 0.00 173.24 173.86 2d8m n THR 61 N 4.93 1.48 -4.51 1.44 -2.24 -1.18 -4.84 114.28 109.36 2d8m n THR 61 Ca 0.14 0.10 -0.33 0.00 -2.27 0.00 0.00 64.05 61.68 2d8m n THR 61 Cb 0.44 -2.29 -0.10 0.00 -2.10 0.00 0.00 70.33 66.27 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 -2.58 2.96 -0.13 4.78 3.76 -0.53 -2.75 115.29 120.81 2d8m s HIS 62 Ca -0.25 0.03 -0.02 0.00 -0.15 0.00 0.00 55.06 54.67 2d8m s HIS 62 Cb 0.05 -1.68 -0.02 0.00 1.11 0.00 0.00 32.58 32.03 2d8m s HIS 62 CO 0.37 0.38 -0.07 -1.17 -0.85 0.00 0.00 174.74 173.40 2d8m s LEU 63 N -1.09 3.11 -0.46 0.89 2.96 -1.06 -3.15 118.68 119.87 2d8m s LEU 63 Ca 0.15 -0.16 -0.17 0.00 -0.22 0.00 0.00 54.13 53.73 2d8m s LEU 63 Cb -0.11 -1.72 0.05 0.00 0.50 0.00 0.00 46.19 44.90 2d8m s LEU 63 CO 0.04 0.20 0.48 -0.63 -1.32 0.00 0.00 176.35 175.13 2d8m s ILE 64 N 0.15 5.07 0.12 6.68 -1.09 0.37 -2.63 121.20 129.87 2d8m s ILE 64 Ca -0.03 -0.61 0.06 0.00 -2.23 0.00 0.00 60.65 57.85 2d8m s ILE 64 Cb -0.14 -4.14 -0.04 0.00 -1.58 0.00 0.00 42.46 36.56 2d8m s ILE 64 CO 0.03 -0.59 -0.04 0.00 -1.23 0.00 0.00 174.94 173.11 2d8m h ALA 66 N 3.31 0.40 -2.90 0.00 0.00 -1.78 -3.11 119.26 115.17 2d8m h ALA 66 Ca -0.48 -1.27 -0.01 0.00 0.00 0.00 0.00 54.91 53.15 2d8m h ALA 66 Cb 1.18 0.47 -0.10 0.00 0.00 0.00 0.00 17.79 19.34 2d8m h ALA 66 CO 0.56 1.26 0.08 -0.59 0.00 0.00 0.00 179.25 180.57 2d8m s PHE 67 N -2.59 -0.23 0.87 0.00 -0.12 -1.26 -4.87 117.98 109.77 2d8m s PHE 67 Ca -0.13 -0.09 -0.15 0.00 -0.05 0.00 0.00 56.93 56.51 2d8m s PHE 67 Cb 0.07 0.45 0.20 0.00 -0.63 0.00 0.00 43.02 43.12 2d8m s PHE 67 CO 0.82 -0.92 1.05 0.00 -0.05 0.00 0.00 175.22 176.12 2d8m n ALA 68 N -0.35 -1.70 -3.38 1.99 0.00 -1.26 -4.46 120.51 111.35 2d8m n ALA 68 Ca -0.12 -1.41 -0.18 0.00 0.00 0.00 0.00 53.44 51.73 2d8m n ALA 68 Cb 0.63 -0.08 0.08 0.00 0.00 0.00 0.00 19.45 20.08 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 -3.94 -3.63 -4.46 0.00 3.02 -1.26 -5.02 115.26 99.97 2d8m n ASN 69 Ca 0.13 -0.54 -0.25 0.00 -0.03 0.00 0.00 54.58 53.90 2d8m n ASN 69 Cb 0.48 -4.69 -0.10 0.00 -0.61 0.00 0.00 39.78 34.85 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 -3.31 2.47 0.32 3.41 -4.23 -1.26 -5.04 115.64 107.99 2d8m s THR 70 Ca 0.21 -2.33 0.13 0.00 -1.18 0.00 0.00 61.69 58.52 2d8m s THR 70 Cb -0.09 -2.27 0.05 0.00 1.34 0.00 0.00 72.50 71.52 2d8m s THR 70 CO 0.67 -0.34 1.74 1.55 -0.54 0.00 0.00 174.62 177.69 2d8m h PRO 71 N 2.45 0.00 0.00 3.99 0.13 -1.96 -2.83 132.00 133.77 2d8m h PRO 71 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2d8m h PRO 71 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2d8m h PRO 71 CO 0.58 0.47 -0.60 -0.22 -0.23 0.00 0.00 178.00 178.00 2d8m h LYS 72 N 0.00 0.00 0.09 0.86 1.63 -1.98 -3.25 116.57 113.92 2d8m h LYS 72 Ca -0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2d8m h LYS 72 Cb 0.85 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.48 2d8m h LYS 72 CO 0.06 0.00 -0.04 -0.92 -3.45 0.00 0.00 179.45 175.10 2d8m h TYR 73 N 0.00 -0.11 -0.48 1.91 5.03 -1.88 -3.03 116.97 118.40 2d8m h TYR 73 Ca 0.00 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2d8m h TYR 73 Cb 0.93 0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.22 2d8m h TYR 73 CO 0.00 0.43 0.31 0.77 -1.32 0.00 0.00 178.16 178.35 2d8m h SER 74 N -0.78 0.57 0.01 -2.11 0.02 -1.68 -1.98 113.55 107.61 2d8m h SER 74 Ca -0.01 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2d8m h SER 74 Cb 0.59 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2d8m h SER 74 CO 0.02 0.44 -0.06 -0.61 -1.14 0.00 0.00 176.83 175.48 2d8m h GLN 75 N 0.65 -0.09 0.00 3.45 5.75 -1.65 0.28 115.11 123.50 2d8m h GLN 75 Ca 0.18 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.68 2d8m h GLN 75 Cb -0.04 0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2d8m h GLN 75 CO -0.04 -0.06 0.15 0.28 -2.65 0.00 0.00 178.83 176.52 2d8m n VAL 76 N -2.82 0.81 -0.03 2.39 0.31 -1.15 -1.40 118.33 116.45 2d8m n VAL 76 Ca -0.01 0.75 -0.13 0.00 -0.01 0.00 0.00 64.34 64.93 2d8m n VAL 76 Cb 0.05 -1.75 -0.09 0.00 -0.91 0.00 0.00 33.84 31.14 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 0.14 -0.18 7.52 6.46 -0.16 -2.36 115.31 126.74 2d8m h LEU 77 Ca 0.00 -0.55 -0.22 0.00 -0.12 0.00 0.00 57.88 56.98 2d8m h LEU 77 Cb 0.31 -0.04 0.01 0.00 -0.73 0.00 0.00 40.66 40.20 2d8m h LEU 77 CO 0.00 0.67 -0.82 1.23 -0.62 0.00 0.00 178.44 178.90 2d8m h GLY 78 N -0.38 0.77 0.13 3.75 0.00 -0.58 -3.31 103.07 103.46 2d8m h GLY 78 Ca 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 47.33 46.25 2d8m h GLY 78 CO 0.02 1.01 -0.29 1.41 0.00 0.00 0.00 176.54 178.69 2d8m h LEU 79 N 0.46 -0.92 0.00 3.11 3.38 -1.54 -3.46 115.31 116.33 2d8m h LEU 79 Ca -0.06 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2d8m h LEU 79 Cb 1.45 0.41 0.00 0.00 0.09 0.00 0.00 40.66 42.60 2d8m h LEU 79 CO 0.16 -0.33 0.00 0.61 0.09 0.00 0.00 178.44 178.98 2d8m n GLY 80 N -1.40 1.00 3.94 0.83 0.00 -1.16 -5.12 105.19 103.29 2d8m n GLY 80 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.00 1.72 -0.64 -0.02 0.00 -0.90 -5.04 107.32 101.45 2d8m s GLY 81 Ca 0.00 -1.02 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 2d8m s GLY 81 CO 0.00 -0.66 0.63 -1.60 0.00 0.00 0.00 173.10 171.47 2d8m s ARG 82 N -5.10 3.18 -0.22 2.90 3.52 -1.11 -4.81 118.95 117.31 2d8m s ARG 82 Ca 0.59 -1.83 -0.27 0.00 -0.13 0.00 0.00 55.73 54.09 2d8m s ARG 82 Cb -0.11 -4.35 0.00 0.00 -1.56 0.00 0.00 34.95 28.93 2d8m s ARG 82 CO 0.43 -1.38 0.93 0.42 -0.81 0.00 0.00 175.30 174.90 2d8m s ILE 83 N 1.47 4.77 0.36 4.11 1.01 -1.26 -2.55 121.20 129.11 2d8m s ILE 83 Ca 0.10 1.80 0.03 0.00 0.00 0.00 0.00 60.65 62.58 2d8m s ILE 83 Cb -0.23 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 2d8m s ILE 83 CO 0.00 -0.11 0.11 0.68 0.00 0.00 0.00 174.94 175.62 2d8m s VAL 84 N 2.91 0.76 0.82 2.92 -7.23 -1.08 -1.28 120.40 118.21 2d8m s VAL 84 Ca 0.40 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.48 2d8m s VAL 84 Cb -0.15 -2.52 0.14 0.00 0.56 0.00 0.00 36.38 34.40 2d8m s VAL 84 CO 0.08 0.00 1.14 -0.13 -0.31 0.00 0.00 175.10 175.88 2d8m s ARG 85 N -3.80 1.40 0.12 4.82 1.81 -1.18 -2.96 118.95 119.14 2d8m s ARG 85 Ca 0.30 -0.57 -0.10 0.00 -1.72 0.00 0.00 55.73 53.64 2d8m s ARG 85 Cb 0.05 -2.08 -0.10 0.00 -0.45 0.00 0.00 34.95 32.37 2d8m s ARG 85 CO 0.15 -1.79 1.34 1.57 -0.68 0.00 0.00 175.30 175.88 2d8m h LYS 86 N -1.02 0.72 -1.65 3.54 2.10 -1.88 -3.18 116.57 115.21 2d8m h LYS 86 Ca -0.42 -0.58 0.51 0.00 -2.00 0.00 0.00 60.65 58.16 2d8m h LYS 86 Cb 1.27 0.12 -0.10 0.00 -0.90 0.00 0.00 32.23 32.61 2d8m h LYS 86 CO 0.45 1.19 1.14 0.93 -2.00 0.00 0.00 179.45 181.17 2d8m h GLU 87 N 0.50 0.02 -0.44 0.07 4.39 -1.95 0.67 114.58 117.84 2d8m h GLU 87 Ca -0.04 -0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.72 2d8m h GLU 87 Cb 1.37 -0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.93 2d8m h GLU 87 CO 0.15 0.01 -0.47 2.35 -1.16 0.00 0.00 179.01 179.90 2d8m h TRP 88 N 0.02 -1.38 0.38 4.33 7.01 -1.95 0.26 115.95 124.62 2d8m h TRP 88 Ca 0.88 0.08 -0.02 0.00 2.11 0.00 0.00 58.89 61.93 2d8m h TRP 88 Cb 3.21 0.67 0.00 0.00 -2.10 0.00 0.00 29.16 30.94 2d8m h TRP 88 CO -0.00 -0.45 -0.18 0.28 -2.79 0.00 0.00 178.44 175.29 2d8m h VAL 89 N -0.33 0.00 -0.87 2.65 2.07 -1.11 0.63 116.25 119.29 2d8m h VAL 89 Ca 0.13 -0.30 0.17 0.00 0.82 0.00 0.00 66.70 67.52 2d8m h VAL 89 Cb 0.59 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.19 2d8m h VAL 89 CO -0.60 0.00 -0.22 0.18 0.02 0.00 0.00 177.57 176.95 2d8m n LEU 90 N -4.22 -0.32 0.10 2.57 4.77 -1.15 -0.47 117.00 118.27 2d8m n LEU 90 Ca -0.06 1.49 -0.04 0.00 -0.03 0.00 0.00 56.01 57.36 2d8m n LEU 90 Cb 0.20 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 40.83 2d8m n LEU 90 CO 0.15 -1.43 0.22 0.44 -1.33 0.00 0.00 177.39 175.45 2d8m h ASP 91 N 0.00 -0.24 -1.00 -1.43 3.32 -0.53 -1.27 116.42 115.27 2d8m h ASP 91 Ca 0.41 0.01 0.36 0.00 0.02 0.00 0.00 57.03 57.82 2d8m h ASP 91 Cb 0.63 0.06 -0.11 0.00 0.22 0.00 0.00 39.33 40.13 2d8m h ASP 91 CO -0.89 -0.03 0.63 0.00 -1.72 0.00 0.00 179.24 177.22 2d8m h HIS 93 N 0.00 -0.06 -0.84 0.00 -0.00 -0.81 -0.25 115.15 113.20 2d8m h HIS 93 Ca 0.67 -0.00 0.13 0.00 -0.00 0.00 0.00 60.37 61.16 2d8m h HIS 93 Cb 2.08 0.02 -0.14 0.00 -0.00 0.00 0.00 27.41 29.37 2d8m h HIS 93 CO -0.01 -0.00 -0.40 -0.09 -0.00 0.00 0.00 177.93 177.43 2d8m h ARG 94 N -1.01 -0.07 -0.00 5.26 9.65 0.12 1.07 114.38 129.39 2d8m h ARG 94 Ca -0.01 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2d8m h ARG 94 Cb 0.08 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.68 2d8m h ARG 94 CO 0.01 -0.05 -0.10 -1.33 2.80 0.00 0.00 179.97 181.31 2d8m n MET 95 N -5.43 0.17 -3.98 0.20 2.81 0.36 -4.92 117.12 106.33 2d8m n MET 95 Ca 0.07 -0.03 -0.29 0.00 -1.81 0.00 0.00 57.70 55.63 2d8m n MET 95 Cb 0.37 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 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 -1.39 -4.27 -3.95 0.03 1.74 0.37 -4.96 116.66 104.23 2d8m n ARG 96 Ca 0.09 0.49 -0.08 0.00 -0.77 0.00 0.00 57.85 57.58 2d8m n ARG 96 Cb 0.31 -5.11 -0.09 0.00 -1.02 0.00 0.00 32.46 26.55 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 -6.60 0.70 -0.28 5.56 1.70 -0.27 -4.89 118.95 114.87 2d8m s ARG 97 Ca 0.43 -0.98 -0.26 0.00 -0.47 0.00 0.00 55.73 54.45 2d8m s ARG 97 Cb -0.23 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.43 2d8m s ARG 97 CO 0.87 -0.18 0.93 0.50 -1.08 0.00 0.00 175.30 176.33 2d8m s ARG 98 N -3.52 4.09 0.05 3.89 3.52 -1.26 -4.40 118.95 121.33 2d8m s ARG 98 Ca 0.03 0.95 0.01 0.00 -0.13 0.00 0.00 55.73 56.59 2d8m s ARG 98 Cb 0.04 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.69 2d8m s ARG 98 CO -0.09 -0.70 0.10 -0.51 -0.81 0.00 0.00 175.30 173.29 2d8m s LEU 99 N 3.18 3.93 -0.60 -0.88 1.43 -1.26 -5.04 118.68 119.44 2d8m s LEU 99 Ca 0.39 0.09 -0.27 0.00 -1.03 0.00 0.00 54.13 53.31 2d8m s LEU 99 Cb -0.14 -2.51 -0.02 0.00 0.03 0.00 0.00 46.19 43.55 2d8m s LEU 99 CO 0.11 0.20 1.86 -2.16 0.23 0.00 0.00 176.35 176.59 2d8m s PRO 100 N -2.22 2.66 0.58 1.29 0.04 -1.26 -4.82 135.00 131.25 2d8m s PRO 100 Ca 0.28 0.65 0.33 0.00 0.04 0.00 0.00 61.00 62.30 2d8m s PRO 100 Cb -0.12 -4.38 1.80 0.00 0.04 0.00 0.00 34.50 31.84 2d8m s PRO 100 CO 0.21 -2.69 2.00 0.77 0.04 0.00 0.00 177.00 177.33 2d8m h SER 101 N 14.87 0.00 0.00 6.66 0.02 -1.99 -0.60 113.55 132.51 2d8m h SER 101 Ca -0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 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 1.21 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.90 2d8m n GLN 102 N -2.78 0.09 -0.05 3.45 6.02 -1.26 -0.77 117.38 122.09 2d8m n GLN 102 Ca -0.02 0.59 -0.10 0.00 -0.01 0.00 0.00 57.00 57.46 2d8m n GLN 102 Cb 0.19 -1.81 -0.15 0.00 1.02 0.00 0.00 30.24 29.49 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 -2.00 0.66 0.00 -1.09 1.74 -0.23 -4.10 116.66 111.63 2d8m n ARG 103 Ca -0.01 0.19 0.13 0.00 -0.77 0.00 0.00 57.85 57.39 2d8m n ARG 103 Cb 0.02 -1.69 0.33 0.00 -1.02 0.00 0.00 32.46 30.11 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 -2.98 0.00 -1.56 -1.55 4.02 -0.15 -4.96 117.16 109.98 2d8m n TYR 104 Ca -0.24 0.00 -0.54 0.00 -0.01 0.00 0.00 57.90 57.11 2d8m n TYR 104 Cb 1.09 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 40.30 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 0.09 1.11 -0.12 7.72 4.77 0.05 -3.13 117.00 127.49 2d8m n LEU 105 Ca 0.15 1.13 -0.26 0.00 -0.03 0.00 0.00 56.01 57.00 2d8m n LEU 105 Cb 0.41 -1.11 -0.11 0.00 -2.33 0.00 0.00 43.42 40.29 2d8m n LEU 105 CO 0.21 -1.34 -1.09 0.23 -1.33 0.00 0.00 177.39 174.07 2d8m n MET 106 N 2.16 0.59 -3.48 3.23 2.81 -0.41 -4.94 117.12 117.08 2d8m n MET 106 Ca 0.19 0.37 -0.24 0.00 -1.81 0.00 0.00 57.70 56.21 2d8m n MET 106 Cb 0.16 -1.59 -0.01 0.00 -0.71 0.00 0.00 33.22 31.06 2d8m n MET 106 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2d8m s ALA 107 N -2.46 3.74 0.00 3.04 0.00 -1.26 -5.00 121.76 119.82 2d8m s ALA 107 Ca -0.35 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 50.67 2d8m s ALA 107 Cb 0.11 -2.05 0.00 0.00 0.00 0.00 0.00 23.12 21.18 2d8m s ALA 107 CO 0.54 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.76 2d8m n GLY 108 N -1.66 -0.47 0.26 0.00 0.00 -1.26 -4.75 105.19 97.30 2d8m n GLY 108 Ca -0.05 -1.48 0.14 0.00 0.00 0.00 0.00 46.02 44.63 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 0.00 0.00 0.00 1.61 0.13 -2.00 -3.48 132.00 128.25 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 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2d8m h PRO 109 CO 0.00 0.10 0.00 0.41 -0.23 0.00 0.00 178.00 178.28 2d8m n GLY 110 N -0.04 -0.83 3.56 1.56 0.00 -1.26 -5.06 105.19 103.11 2d8m n GLY 110 Ca -0.00 0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 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 -4.00 6.28 0.01 1.61 1.04 -1.26 -4.64 113.70 112.75 2d8m s SER 111 Ca 0.00 -1.11 -0.01 0.00 0.48 0.00 0.00 55.95 55.31 2d8m s SER 111 Cb 0.00 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.55 2d8m s SER 111 CO 0.00 -1.71 -0.02 -0.24 0.98 0.00 0.00 173.24 172.25 2d8m n SER 112 N 9.51 0.46 -2.46 7.02 2.88 -1.26 -4.78 113.62 124.99 2d8m n SER 112 Ca 0.26 0.06 -0.36 0.00 -1.33 0.00 0.00 58.87 57.51 2d8m n SER 112 Cb 0.50 -0.15 0.07 0.00 -0.75 0.00 0.00 64.21 63.88 2d8m n SER 112 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2d8m n SER 113 N -3.24 7.57 -4.57 -3.46 3.41 -1.26 -4.92 113.62 107.15 2d8m n SER 113 Ca -0.03 -3.80 -0.29 0.00 -0.26 0.00 0.00 58.87 54.50 2d8m n SER 113 Cb 0.37 -0.98 -0.05 0.00 -0.26 0.00 0.00 64.21 63.29 2d8m n SER 113 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2d8m s GLU 114 N -3.88 2.61 1.06 4.33 2.12 -1.26 -4.94 118.70 118.73 2d8m s GLU 114 Ca 0.61 -0.97 -0.17 0.00 0.36 0.00 0.00 54.97 54.80 2d8m s GLU 114 Cb 0.49 -5.21 0.23 0.00 0.26 0.00 0.00 34.13 29.90 2d8m s GLU 114 CO -0.11 -3.70 1.22 -1.21 -0.54 0.00 0.00 175.26 170.92 2d8m s GLU 115 N 6.48 -0.10 0.26 4.30 2.02 -1.26 -4.94 118.70 125.46 2d8m s GLU 115 Ca 0.68 -0.20 -0.27 0.00 0.02 0.00 0.00 54.97 55.20 2d8m s GLU 115 Cb -0.02 -1.74 -0.16 0.00 0.10 0.00 0.00 34.13 32.31 2d8m s GLU 115 CO 0.09 -2.94 0.61 -0.40 0.02 0.00 0.00 175.26 172.64 2d8m n ASP 116 N -4.19 -0.70 -0.74 -0.19 5.75 -1.26 -4.88 116.55 110.35 2d8m n ASP 116 Ca 0.14 1.09 0.08 0.00 -0.01 0.00 0.00 54.79 56.08 2d8m n ASP 116 Cb 0.59 -1.05 0.22 0.00 -1.03 0.00 0.00 41.12 39.85 2d8m n ASP 116 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2d8m n GLU 117 N 0.91 2.79 -2.76 0.11 1.02 -1.26 -4.90 120.64 116.55 2d8m n GLU 117 Ca 0.15 -2.60 -0.43 0.00 -0.02 0.00 0.00 57.16 54.26 2d8m n GLU 117 Cb 0.30 -1.66 -0.02 0.00 -0.02 0.00 0.00 31.44 30.04 2d8m n GLU 117 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d8m s ALA 118 N -2.35 3.31 0.22 0.62 0.00 -1.26 -4.96 121.76 117.34 2d8m s ALA 118 Ca 0.36 -2.78 0.05 0.00 0.00 0.00 0.00 51.96 49.58 2d8m s ALA 118 Cb 0.27 -4.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.02 2d8m s ALA 118 CO 0.10 -3.18 -0.06 -1.54 0.00 0.00 0.00 175.76 171.08 2d8m s SER 119 N 3.95 2.14 0.31 0.00 1.04 -1.26 -5.17 113.70 114.72 2d8m s SER 119 Ca 0.43 -1.14 0.04 0.00 0.48 0.00 0.00 55.95 55.75 2d8m s SER 119 Cb -0.01 -0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.04 2d8m s SER 119 CO -0.04 -0.39 0.33 1.41 0.98 0.00 0.00 173.24 175.53 2d8m n HIS 120 N -0.40 -0.98 -0.07 5.02 8.25 -1.26 -5.07 115.22 120.71 2d8m n HIS 120 Ca -0.07 -2.40 -0.13 0.00 -0.26 0.00 0.00 57.72 54.87 2d8m n HIS 120 Cb 0.63 0.36 -0.14 0.00 1.12 0.00 0.00 29.99 31.95 2d8m n HIS 120 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2d8m n SER 121 N -1.75 0.93 0.00 0.41 3.41 -1.26 -5.08 113.62 110.28 2d8m n SER 121 Ca 0.05 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 2d8m n SER 121 Cb 0.55 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 2d8m n SER 121 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d8m n GLY 122 N 1.82 0.02 0.00 5.00 0.00 -1.26 -5.04 105.19 105.74 2d8m n GLY 122 Ca -0.30 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.71 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 2.55 3.46 -0.02 0.00 -1.26 -5.13 105.19 104.79 2d8m n GLY 123 Ca 0.00 -0.56 -0.51 0.00 0.00 0.00 0.00 46.02 44.95 2d8m n GLY 123 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d8m n SER 124 N 0.00 -0.45 -4.46 1.61 7.64 -1.26 -4.97 113.62 111.73 2d8m n SER 124 Ca 0.00 1.14 -0.24 0.00 1.01 0.00 0.00 58.87 60.78 2d8m n SER 124 Cb 0.00 -1.00 -0.10 0.00 -1.01 0.00 0.00 64.21 62.10 2d8m n SER 124 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2d8m s GLY 125 N -0.59 2.29 0.82 0.23 0.00 -1.26 -5.15 107.32 103.66 2d8m s GLY 125 Ca 0.72 -1.88 -0.11 0.00 0.00 0.00 0.00 44.72 43.45 2d8m s GLY 125 CO 0.56 -1.90 1.09 2.56 0.00 0.00 0.00 173.10 175.42 2d8m s PRO 126 N -3.83 1.91 0.17 2.90 0.04 -1.26 -4.97 135.00 129.96 2d8m s PRO 126 Ca 0.32 1.05 -0.31 0.00 0.04 0.00 0.00 61.00 62.10 2d8m s PRO 126 Cb 0.08 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.66 2d8m s PRO 126 CO 0.15 -1.85 1.39 -1.12 0.04 0.00 0.00 177.00 175.61 2d8m s SER 127 N -3.41 6.79 0.12 6.66 0.01 -1.26 -4.93 113.70 117.69 2d8m s SER 127 Ca 0.62 2.45 -0.11 0.00 1.31 0.00 0.00 55.95 60.21 2d8m s SER 127 Cb -0.17 -2.60 -0.10 0.00 0.21 0.00 0.00 66.02 63.35 2d8m s SER 127 CO 0.56 -0.63 1.37 0.77 0.41 0.00 0.00 173.24 175.72 2d8m h SER 128 N 5.96 0.93 -0.02 2.44 4.64 -2.08 -3.58 113.55 121.85 2d8m h SER 128 Ca -0.44 -0.55 0.00 0.00 -0.47 0.00 0.00 61.79 60.33 2d8m h SER 128 Cb 1.21 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2d8m h SER 128 CO 0.82 1.35 0.00 0.61 -0.87 0.00 0.00 176.83 178.74