#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yue s SER 2 N 0.00 7.03 -0.62 1.61 0.15 -1.26 -3.96 113.70 116.65 2yue s SER 2 Ca 0.00 2.11 -0.01 0.00 0.70 0.00 0.00 55.95 58.74 2yue s SER 2 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2yue s SER 2 CO 0.00 -0.49 0.60 -0.24 1.20 0.00 0.00 173.24 174.30 2yue n SER 3 N 3.75 -7.05 0.00 5.45 2.88 -1.26 -5.02 113.62 112.38 2yue n SER 3 Ca 0.09 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 2yue n SER 3 Cb 0.45 -4.75 0.00 0.00 -0.75 0.00 0.00 64.21 59.16 2yue n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yue n GLY 4 N -1.54 3.14 3.49 0.46 0.00 -1.25 -5.17 105.19 104.32 2yue n GLY 4 Ca 0.01 -1.16 -0.16 0.00 0.00 0.00 0.00 46.02 44.72 2yue n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yue s SER 5 N 0.00 -0.60 -0.43 1.61 0.15 -1.26 -4.42 113.70 108.75 2yue s SER 5 Ca 0.00 0.88 0.10 0.00 0.70 0.00 0.00 55.95 57.63 2yue s SER 5 Cb 0.00 0.84 0.33 0.00 -1.71 0.00 0.00 66.02 65.47 2yue s SER 5 CO 0.00 -0.42 0.74 -1.20 1.20 0.00 0.00 173.24 173.55 2yue n SER 6 N 1.74 1.57 0.07 5.45 7.64 -1.26 -4.96 113.62 123.87 2yue n SER 6 Ca -0.17 -3.11 -0.04 0.00 1.01 0.00 0.00 58.87 56.57 2yue n SER 6 Cb 0.56 -0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 2yue n SER 6 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2yue h GLY 7 N 3.23 -0.25 -0.08 0.23 0.00 -2.06 -3.47 103.07 100.68 2yue h GLY 7 Ca 0.11 0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 2yue h GLY 7 CO 0.57 -0.09 0.01 -1.55 0.00 0.00 0.00 176.54 175.48 2yue n PRO 8 N -4.17 -1.20 -4.70 4.80 -0.04 -1.26 -5.05 135.00 123.38 2yue n PRO 8 Ca -0.03 -0.15 -0.33 0.00 -0.04 0.00 0.00 63.50 62.95 2yue n PRO 8 Cb 0.09 -0.14 -0.14 0.00 -0.04 0.00 0.00 33.50 33.28 2yue n PRO 8 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2yue s LEU 9 N 0.00 2.86 0.00 1.53 2.96 -1.26 -4.98 118.68 119.79 2yue s LEU 9 Ca 0.06 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.73 2yue s LEU 9 Cb -0.01 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 2yue s LEU 9 CO 0.05 0.19 0.05 0.00 -1.32 0.00 0.00 176.35 175.32 2yue n GLN 10 N 3.34 0.60 -3.03 1.98 6.02 -1.26 -4.67 117.38 120.36 2yue n GLN 10 Ca -0.18 -0.93 -0.35 0.00 -0.01 0.00 0.00 57.00 55.53 2yue n GLN 10 Cb 0.53 0.59 -0.06 0.00 1.02 0.00 0.00 30.24 32.31 2yue n GLN 10 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2yue s PHE 11 N -2.09 3.57 0.43 1.08 0.08 -1.26 -1.68 117.98 118.10 2yue s PHE 11 Ca 0.07 1.44 -0.12 0.00 0.12 0.00 0.00 56.93 58.45 2yue s PHE 11 Cb 0.00 -2.67 -0.07 0.00 -0.57 0.00 0.00 43.02 39.71 2yue s PHE 11 CO 0.05 0.22 0.81 -1.58 -0.10 0.00 0.00 175.22 174.62 2yue s HIS 12 N -1.70 3.47 0.28 0.36 2.46 -1.20 -4.48 115.29 114.48 2yue s HIS 12 Ca 0.48 1.12 0.01 0.00 0.47 0.00 0.00 55.06 57.15 2yue s HIS 12 Cb -0.15 -2.51 0.60 0.00 -0.13 0.00 0.00 32.58 30.40 2yue s HIS 12 CO 0.20 -0.16 1.77 0.77 -2.47 0.00 0.00 174.74 174.85 2yue h SER 13 N 1.18 0.64 -2.40 9.88 0.02 -1.93 -3.40 113.55 117.54 2yue h SER 13 Ca -0.47 0.09 -0.53 0.00 -0.84 0.00 0.00 61.79 60.04 2yue h SER 13 Cb 1.19 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 63.72 2yue h SER 13 CO 0.63 0.26 1.21 0.54 -1.14 0.00 0.00 176.83 178.34 2yue s VAL 14 N -5.93 3.08 0.10 2.27 0.11 -1.26 -4.92 120.40 113.85 2yue s VAL 14 Ca -0.12 0.10 -0.17 0.00 -2.93 0.00 0.00 61.98 58.86 2yue s VAL 14 Cb 0.23 -3.07 0.04 0.00 -1.53 0.00 0.00 36.38 32.05 2yue s VAL 14 CO 0.79 -0.01 0.42 -1.38 -3.33 0.00 0.00 175.10 171.59 2yue s HIS 15 N 4.38 -0.25 1.07 1.54 -0.00 -1.26 -4.08 115.29 116.69 2yue s HIS 15 Ca 0.87 0.03 -0.17 0.00 -0.00 0.00 0.00 55.06 55.79 2yue s HIS 15 Cb -0.42 0.27 0.08 0.00 -0.00 0.00 0.00 32.58 32.52 2yue s HIS 15 CO 0.40 -0.67 0.11 0.41 -0.00 0.00 0.00 174.74 174.98 2yue n GLY 16 N -0.02 -2.38 0.49 -1.38 0.00 0.61 -4.76 105.19 97.75 2yue n GLY 16 Ca -0.17 -0.77 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 2yue n GLY 16 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2yue h ASP 17 N -1.91 -1.54 -1.85 1.61 3.58 -1.40 -2.91 116.42 112.00 2yue h ASP 17 Ca -0.51 0.15 -0.78 0.00 0.42 0.00 0.00 57.03 56.31 2yue h ASP 17 Cb 1.34 0.55 -0.21 0.00 1.72 0.00 0.00 39.33 42.73 2yue h ASP 17 CO 0.37 -0.59 1.56 0.59 -2.88 0.00 0.00 179.24 178.29 2yue n ASN 18 N -5.51 7.56 -3.79 2.28 5.03 -1.22 -4.87 115.26 114.74 2yue n ASN 18 Ca -0.10 -3.47 -0.30 0.00 0.87 0.00 0.00 54.58 51.59 2yue n ASN 18 Cb 0.43 -1.25 -0.15 0.00 -1.02 0.00 0.00 39.78 37.79 2yue n ASN 18 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2yue s ILE 19 N -3.03 1.11 -0.50 2.41 -1.09 -1.10 -3.19 121.20 115.80 2yue s ILE 19 Ca 0.44 -1.48 -0.22 0.00 -2.23 0.00 0.00 60.65 57.16 2yue s ILE 19 Cb 0.18 -1.79 0.04 0.00 -1.58 0.00 0.00 42.46 39.31 2yue s ILE 19 CO -0.11 -0.60 0.80 -0.60 -1.23 0.00 0.00 174.94 173.19 2yue s ARG 20 N 1.51 3.29 -0.40 2.79 6.06 0.17 -4.76 118.95 127.61 2yue s ARG 20 Ca 0.08 -0.39 -0.04 0.00 -2.50 0.00 0.00 55.73 52.88 2yue s ARG 20 Cb -0.18 -4.03 0.10 0.00 0.06 0.00 0.00 34.95 30.91 2yue s ARG 20 CO -0.21 -1.29 0.20 0.42 -2.50 0.00 0.00 175.30 171.93 2yue s ILE 21 N 3.35 3.38 -0.29 4.11 1.01 -1.26 -1.04 121.20 130.46 2yue s ILE 21 Ca 0.26 -1.93 -0.16 0.00 0.00 0.00 0.00 60.65 58.82 2yue s ILE 21 Cb -0.14 -3.26 0.13 0.00 0.01 0.00 0.00 42.46 39.19 2yue s ILE 21 CO 0.18 -0.63 0.89 -0.55 0.00 0.00 0.00 174.94 174.83 2yue s SER 22 N 1.84 -0.64 0.30 3.58 0.15 -1.06 -4.98 113.70 112.89 2yue s SER 22 Ca 0.06 1.03 -0.18 0.00 0.70 0.00 0.00 55.95 57.56 2yue s SER 22 Cb -0.23 1.27 0.02 0.00 -1.71 0.00 0.00 66.02 65.38 2yue s SER 22 CO -0.03 -0.16 0.68 -0.60 1.20 0.00 0.00 173.24 174.32 2yue s ARG 23 N 1.45 1.83 0.58 5.44 3.52 -1.26 -4.76 118.95 125.75 2yue s ARG 23 Ca -0.09 -1.15 0.28 0.00 -0.13 0.00 0.00 55.73 54.63 2yue s ARG 23 Cb -0.04 0.58 1.74 0.00 -1.56 0.00 0.00 34.95 35.67 2yue s ARG 23 CO -0.16 -0.83 2.23 0.22 -0.81 0.00 0.00 175.30 175.95 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 1.82 -2.03 -3.38 116.42 112.77 2yue h ASP 24 Ca -0.23 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.41 2yue h ASP 24 Cb 1.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.26 2yue h ASP 24 CO 0.29 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.53 2yue n GLY 25 N -1.36 -0.17 0.00 -0.78 0.00 -1.26 -5.12 105.19 96.51 2yue n GLY 25 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2yue n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2yue n THR 26 N -3.44 0.00 -3.58 2.61 5.66 -1.26 -5.00 114.28 109.28 2yue n THR 26 Ca 0.00 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.84 2yue n THR 26 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 2yue n THR 26 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2yue s LEU 27 N 0.00 -0.21 -0.06 1.09 0.20 -1.26 -3.95 118.68 114.48 2yue s LEU 27 Ca 0.00 0.42 0.05 0.00 0.69 0.00 0.00 54.13 55.28 2yue s LEU 27 Cb 0.00 2.19 -0.00 0.00 -0.43 0.00 0.00 46.19 47.95 2yue s LEU 27 CO 0.00 -0.63 -0.21 0.00 -0.29 0.00 0.00 176.35 175.22 2yue s ALA 28 N -1.69 1.87 -0.00 5.97 0.00 0.32 -2.56 121.76 125.67 2yue s ALA 28 Ca -0.09 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.02 2yue s ALA 28 Cb -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.47 2yue s ALA 28 CO 0.05 0.31 -0.03 -0.98 0.00 0.00 0.00 175.76 175.12 2yue s ARG 29 N 0.09 0.24 -0.12 0.00 1.70 -0.21 -0.18 118.95 120.47 2yue s ARG 29 Ca -0.08 -0.09 -0.15 0.00 -0.47 0.00 0.00 55.73 54.95 2yue s ARG 29 Cb -0.14 -0.25 -0.05 0.00 -0.57 0.00 0.00 34.95 33.94 2yue s ARG 29 CO 0.04 0.04 0.34 -0.98 -1.08 0.00 0.00 175.30 173.67 2yue s ARG 30 N 0.04 4.18 -0.10 3.89 1.04 -1.14 -0.65 118.95 126.21 2yue s ARG 30 Ca -0.00 0.21 -0.28 0.00 -1.04 0.00 0.00 55.73 54.63 2yue s ARG 30 Cb -0.02 -3.38 -0.25 0.00 -2.04 0.00 0.00 34.95 29.26 2yue s ARG 30 CO -0.00 0.32 0.92 0.35 -0.04 0.00 0.00 175.30 176.85 2yue h PHE 31 N 6.29 0.05 0.00 5.89 3.04 -1.91 -3.46 116.94 126.84 2yue h PHE 31 Ca -0.43 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.48 2yue h PHE 31 Cb 1.18 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.68 2yue h PHE 31 CO 0.63 0.88 -0.01 -0.85 -2.02 0.00 0.00 178.31 176.94 2yue n GLU 32 N -4.64 0.03 -1.95 1.11 0.28 -1.26 -5.13 120.64 109.08 2yue n GLU 32 Ca -0.10 -0.05 -0.42 0.00 -0.16 0.00 0.00 57.16 56.43 2yue n GLU 32 Cb 0.44 0.23 -0.03 0.00 1.43 0.00 0.00 31.44 33.51 2yue n GLU 32 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2yue s SER 33 N -0.05 6.59 -0.14 -1.84 0.15 -1.25 -4.91 113.70 112.26 2yue s SER 33 Ca 0.00 2.64 0.15 0.00 0.70 0.00 0.00 55.95 59.44 2yue s SER 33 Cb 0.01 -2.60 0.34 0.00 -1.71 0.00 0.00 66.02 62.06 2yue s SER 33 CO -0.00 -0.80 1.17 0.49 1.20 0.00 0.00 173.24 175.30 2yue n PHE 34 N 3.56 0.00 0.01 3.44 3.72 -1.26 -4.90 117.46 122.03 2yue n PHE 34 Ca 0.12 -1.10 0.00 0.00 -0.05 0.00 0.00 57.45 56.42 2yue n PHE 34 Cb 0.39 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 2yue n PHE 34 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2yue n ARG 36 N -2.82 3.24 -3.57 0.00 1.74 -1.25 -4.11 116.66 109.88 2yue n ARG 36 Ca 0.00 -3.34 -0.28 0.00 -0.77 0.00 0.00 57.85 53.46 2yue n ARG 36 Cb 0.00 -3.25 -0.11 0.00 -1.02 0.00 0.00 32.46 28.08 2yue n ARG 36 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yue s ALA 37 N 2.72 2.09 0.08 7.54 0.00 -1.26 -0.94 121.76 132.00 2yue s ALA 37 Ca 0.47 -2.78 0.05 0.00 0.00 0.00 0.00 51.96 49.70 2yue s ALA 37 Cb 0.05 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 2yue s ALA 37 CO 0.01 -2.03 -0.15 0.42 0.00 0.00 0.00 175.76 174.02 2yue s ILE 38 N -0.21 1.17 0.04 0.00 1.09 -1.26 -2.13 121.20 119.91 2yue s ILE 38 Ca 0.27 -1.36 -0.03 0.00 -1.10 0.00 0.00 60.65 58.43 2yue s ILE 38 Cb -0.05 -1.15 -0.02 0.00 -1.06 0.00 0.00 42.46 40.18 2yue s ILE 38 CO -0.14 -0.23 0.04 0.42 -0.10 0.00 0.00 174.94 174.92 2yue s THR 39 N -1.35 0.16 0.21 2.92 -4.23 0.87 -0.29 115.64 113.94 2yue s THR 39 Ca -0.00 -1.34 0.03 0.00 -1.18 0.00 0.00 61.69 59.20 2yue s THR 39 Cb -0.10 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.66 2yue s THR 39 CO 0.02 -0.74 0.11 0.49 -0.54 0.00 0.00 174.62 173.97 2yue n PHE 40 N 0.57 -0.13 -3.28 3.99 3.01 -1.26 -0.69 117.46 119.66 2yue n PHE 40 Ca -0.17 -1.51 -0.38 0.00 1.01 0.00 0.00 57.45 56.40 2yue n PHE 40 Cb 0.59 0.06 -0.06 0.00 -0.01 0.00 0.00 39.48 40.07 2yue n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2yue s SER 41 N -2.36 7.01 0.24 4.37 1.04 -0.94 -3.23 113.70 119.82 2yue s SER 41 Ca 0.16 1.23 -0.01 0.00 0.48 0.00 0.00 55.95 57.81 2yue s SER 41 Cb 0.01 -2.35 0.26 0.00 0.10 0.00 0.00 66.02 64.05 2yue s SER 41 CO 0.11 0.22 1.63 0.00 0.98 0.00 0.00 173.24 176.18 2yue h ALA 42 N 4.25 0.92 -2.75 5.32 0.00 -1.54 -3.39 119.26 122.07 2yue h ALA 42 Ca -0.49 -0.41 -0.21 0.00 0.00 0.00 0.00 54.91 53.80 2yue h ALA 42 Cb 1.21 -0.12 -0.19 0.00 0.00 0.00 0.00 17.79 18.70 2yue h ALA 42 CO 0.64 0.62 -0.71 1.03 0.00 0.00 0.00 179.25 180.83 2yue s ARG 43 N -4.33 0.56 0.18 0.00 0.52 -1.26 -4.86 118.95 109.76 2yue s ARG 43 Ca -0.07 -0.94 -0.30 0.00 -0.52 0.00 0.00 55.73 53.90 2yue s ARG 43 Cb 0.13 -0.09 -0.08 0.00 0.52 0.00 0.00 34.95 35.42 2yue s ARG 43 CO 0.82 -0.02 1.31 -1.25 0.02 0.00 0.00 175.30 176.18 2yue s PRO 44 N -2.48 4.38 0.32 3.54 0.04 -1.26 -4.85 135.00 134.69 2yue s PRO 44 Ca -0.03 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.12 2yue s PRO 44 Cb -0.03 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.27 2yue s PRO 44 CO -0.03 -0.27 0.31 0.14 0.04 0.00 0.00 177.00 177.19 2yue s VAL 45 N 0.26 3.82 0.71 -0.36 -7.23 -1.15 -4.98 120.40 111.46 2yue s VAL 45 Ca 0.58 -1.30 -0.01 0.00 -1.81 0.00 0.00 61.98 59.43 2yue s VAL 45 Cb -0.36 -3.28 0.12 0.00 0.56 0.00 0.00 36.38 33.42 2yue s VAL 45 CO 0.37 -0.20 0.98 -0.13 -0.31 0.00 0.00 175.10 175.80 2yue s ARG 46 N -4.00 1.77 0.01 4.82 0.52 -1.26 -4.35 118.95 116.46 2yue s ARG 46 Ca 0.40 -1.02 -0.08 0.00 -0.52 0.00 0.00 55.73 54.51 2yue s ARG 46 Cb -0.07 -2.33 -0.04 0.00 0.52 0.00 0.00 34.95 33.03 2yue s ARG 46 CO 0.27 -1.38 1.06 0.82 0.02 0.00 0.00 175.30 176.09 2yue h ILE 47 N -0.49 0.00 0.00 1.52 1.08 -1.96 -2.95 117.51 114.71 2yue h ILE 47 Ca -0.38 -0.01 -0.00 0.00 -0.39 0.00 0.00 64.86 64.08 2yue h ILE 47 Cb 1.27 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.02 2yue h ILE 47 CO 0.42 0.00 -0.00 0.78 -0.69 0.00 0.00 178.15 178.66 2yue h ASN 48 N -0.30 0.00 -2.51 1.72 -0.26 -1.91 -2.92 115.58 109.39 2yue h ASN 48 Ca -0.03 0.00 -0.53 0.00 -0.56 0.00 0.00 56.30 55.18 2yue h ASN 48 Cb 0.22 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.50 2yue h ASN 48 CO 0.05 0.00 1.14 -0.70 -1.06 0.00 0.00 177.43 176.86 2yue s GLU 49 N -4.04 4.16 -0.05 0.81 2.12 -1.12 -4.85 118.70 115.73 2yue s GLU 49 Ca -0.04 2.47 -0.01 0.00 0.36 0.00 0.00 54.97 57.75 2yue s GLU 49 Cb 0.12 -3.92 -0.04 0.00 0.26 0.00 0.00 34.13 30.56 2yue s GLU 49 CO 0.44 -0.87 0.04 -0.98 -0.54 0.00 0.00 175.26 173.35 2yue s ARG 50 N 3.72 3.01 -0.20 4.30 3.03 -1.26 -4.52 118.95 127.02 2yue s ARG 50 Ca 0.81 -0.45 -0.03 0.00 2.03 0.00 0.00 55.73 58.09 2yue s ARG 50 Cb -0.41 -2.82 -0.01 0.00 -1.03 0.00 0.00 34.95 30.68 2yue s ARG 50 CO 0.36 0.68 -0.08 0.42 -1.13 0.00 0.00 175.30 175.55 2yue s ILE 51 N -1.04 3.16 0.08 4.99 1.09 -0.29 -4.42 121.20 124.77 2yue s ILE 51 Ca 0.18 -0.57 -0.10 0.00 -1.10 0.00 0.00 60.65 59.05 2yue s ILE 51 Cb -0.12 -2.41 -0.06 0.00 -1.06 0.00 0.00 42.46 38.81 2yue s ILE 51 CO 0.08 0.45 0.41 0.00 -0.10 0.00 0.00 174.94 175.78 2yue s VAL 53 N -1.39 -0.15 -0.18 0.00 1.01 0.72 -0.95 120.40 119.46 2yue s VAL 53 Ca 0.33 0.08 -0.23 0.00 0.00 0.00 0.00 61.98 62.16 2yue s VAL 53 Cb -0.14 -0.43 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 2yue s VAL 53 CO 0.18 -0.08 0.73 -0.75 0.00 0.00 0.00 175.10 175.17 2yue s LYS 54 N 2.20 4.26 -1.16 2.72 2.20 0.11 -1.24 119.74 128.83 2yue s LYS 54 Ca 0.04 0.81 -0.22 0.00 -0.36 0.00 0.00 55.97 56.24 2yue s LYS 54 Cb -0.14 -3.57 -0.06 0.00 -1.51 0.00 0.00 37.83 32.55 2yue s LYS 54 CO -0.07 -0.27 1.90 -0.06 -0.36 0.00 0.00 175.35 176.48 2yue s PHE 55 N 1.99 2.05 0.05 4.03 0.08 -0.47 -1.37 117.98 124.33 2yue s PHE 55 Ca 0.33 0.20 -0.23 0.00 0.12 0.00 0.00 56.93 57.35 2yue s PHE 55 Cb -0.16 -4.12 -0.12 0.00 -0.57 0.00 0.00 43.02 38.05 2yue s PHE 55 CO 0.11 -1.37 1.35 0.00 -0.10 0.00 0.00 175.22 175.22 2yue h ALA 56 N 9.68 -1.12 -4.30 5.36 0.00 -1.80 0.74 119.26 127.82 2yue h ALA 56 Ca 0.23 -0.15 -0.69 0.00 0.00 0.00 0.00 54.91 54.29 2yue h ALA 56 Cb 0.94 0.45 -0.28 0.00 0.00 0.00 0.00 17.79 18.90 2yue h ALA 56 CO 1.26 -1.10 -0.85 -1.21 0.00 0.00 0.00 179.25 177.35 2yue s GLU 57 N -4.83 2.34 -0.01 0.00 2.02 0.46 -4.48 118.70 114.20 2yue s GLU 57 Ca -0.12 -0.85 0.03 0.00 0.02 0.00 0.00 54.97 54.06 2yue s GLU 57 Cb 0.02 -2.18 -0.01 0.00 0.10 0.00 0.00 34.13 32.06 2yue s GLU 57 CO 0.38 0.54 -0.10 0.42 0.02 0.00 0.00 175.26 176.52 2yue s ILE 58 N -0.55 0.77 -0.26 -1.63 -1.09 -1.26 -1.00 121.20 116.18 2yue s ILE 58 Ca 0.08 -0.44 -0.09 0.00 -2.23 0.00 0.00 60.65 57.96 2yue s ILE 58 Cb -0.11 -0.65 -0.04 0.00 -1.58 0.00 0.00 42.46 40.08 2yue s ILE 58 CO 0.00 0.20 0.13 -0.94 -1.23 0.00 0.00 174.94 173.10 2yue s SER 59 N -0.28 5.62 -0.79 3.58 1.04 -1.26 -4.77 113.70 116.84 2yue s SER 59 Ca 0.03 -0.08 0.02 0.00 0.48 0.00 0.00 55.95 56.41 2yue s SER 59 Cb -0.04 -2.02 0.24 0.00 0.10 0.00 0.00 66.02 64.29 2yue s SER 59 CO -0.00 -0.02 0.83 -3.20 0.98 0.00 0.00 173.24 171.83 2yue n ASN 60 N 4.83 4.18 0.00 7.02 5.15 -1.26 -4.31 115.26 130.88 2yue n ASN 60 Ca -0.15 -3.32 0.00 0.00 -0.60 0.00 0.00 54.58 50.51 2yue n ASN 60 Cb 0.52 -0.88 0.00 0.00 -0.53 0.00 0.00 39.78 38.88 2yue n ASN 60 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2yue n ASN 61 N 1.51 0.00 -2.27 1.20 5.15 -1.26 -5.14 115.26 114.45 2yue n ASN 61 Ca 0.25 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 54.23 2yue n ASN 61 Cb 0.38 0.07 0.00 0.00 -0.53 0.00 0.00 39.78 39.69 2yue n ASN 61 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 2yue n TRP 62 N -1.64 -3.52 -4.14 1.20 5.03 -1.26 -5.10 117.44 108.02 2yue n TRP 62 Ca 0.00 -0.02 -0.16 0.00 3.03 0.00 0.00 57.50 60.35 2yue n TRP 62 Cb 0.00 -0.02 -0.12 0.00 -1.03 0.00 0.00 31.31 30.15 2yue n TRP 62 CO 0.00 0.00 0.00 -0.80 -0.03 0.00 0.00 177.69 176.86 2yue s ASN 63 N -1.30 1.31 0.00 -0.99 -0.87 -1.22 -4.92 114.94 106.94 2yue s ASN 63 Ca 0.01 -0.57 0.00 0.00 -1.57 0.00 0.00 52.86 50.73 2yue s ASN 63 Cb -0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 41.25 41.21 2yue s ASN 63 CO 0.01 -0.12 0.00 0.61 -2.57 0.00 0.00 177.10 175.03 2yue n GLY 64 N 1.43 1.38 3.20 0.66 0.00 -1.26 -4.70 105.19 105.90 2yue n GLY 64 Ca -0.22 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.51 2yue n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yue n GLY 65 N 2.23 -2.85 3.83 -0.02 0.00 -1.26 -3.47 105.19 103.65 2yue n GLY 65 Ca 0.00 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 2yue n GLY 65 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2yue s ILE 66 N -2.17 1.92 -0.04 -0.61 -4.36 -1.26 -4.65 121.20 110.04 2yue s ILE 66 Ca 0.54 0.00 -0.02 0.00 -0.26 0.00 0.00 60.65 60.92 2yue s ILE 66 Cb -0.12 -2.85 0.03 0.00 1.25 0.00 0.00 42.46 40.78 2yue s ILE 66 CO 0.52 0.00 0.09 -0.13 0.24 0.00 0.00 174.94 175.67 2yue s ARG 67 N -5.61 0.03 0.18 0.37 3.00 -1.24 -3.84 118.95 111.84 2yue s ARG 67 Ca 0.69 0.29 -0.18 0.00 0.00 0.00 0.00 55.73 56.53 2yue s ARG 67 Cb -0.08 -0.21 0.03 0.00 0.00 0.00 0.00 34.95 34.69 2yue s ARG 67 CO 0.53 -0.16 0.51 -0.59 0.00 0.00 0.00 175.30 175.59 2yue s PHE 68 N 1.11 -0.17 -2.32 -0.53 -0.71 -0.96 -0.29 117.98 114.12 2yue s PHE 68 Ca -0.09 -0.16 0.00 0.00 -1.04 0.00 0.00 56.93 55.64 2yue s PHE 68 Cb -0.12 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.08 2yue s PHE 68 CO -0.05 -0.88 0.00 0.41 -1.34 0.00 0.00 175.22 173.37 2yue n GLY 69 N -0.33 -0.65 3.52 1.99 0.00 -0.11 -0.99 105.19 108.62 2yue n GLY 69 Ca -0.12 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 2yue n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yue s PHE 70 N -4.00 1.93 -0.09 1.61 0.08 0.78 -0.42 117.98 117.87 2yue s PHE 70 Ca 0.00 -1.05 -0.24 0.00 0.12 0.00 0.00 56.93 55.76 2yue s PHE 70 Cb 0.00 -1.31 0.06 0.00 -0.57 0.00 0.00 43.02 41.19 2yue s PHE 70 CO 0.00 -0.04 0.57 -0.08 -0.10 0.00 0.00 175.22 175.57 2yue s THR 71 N -3.18 0.01 0.03 0.64 -1.32 0.70 -0.07 115.64 112.46 2yue s THR 71 Ca 0.28 -0.11 -0.10 0.00 -1.21 0.00 0.00 61.69 60.55 2yue s THR 71 Cb 0.06 -0.86 -0.32 0.00 -1.51 0.00 0.00 72.50 69.87 2yue s THR 71 CO 0.14 -0.06 1.00 0.77 -2.21 0.00 0.00 174.62 174.25 2yue h SER 72 N 3.82 0.63 -4.13 8.08 4.64 -0.85 -2.58 113.55 123.16 2yue h SER 72 Ca -0.28 -0.72 -0.51 0.00 -0.47 0.00 0.00 61.79 59.82 2yue h SER 72 Cb 1.16 -0.21 0.09 0.00 -0.31 0.00 0.00 62.40 63.13 2yue h SER 72 CO 0.32 1.57 0.41 0.20 -0.87 0.00 0.00 176.83 178.46 2yue s ASN 73 N -7.34 5.42 0.41 4.97 0.01 -1.22 -4.85 114.94 112.34 2yue s ASN 73 Ca -0.08 2.13 -0.22 0.00 -0.71 0.00 0.00 52.86 53.98 2yue s ASN 73 Cb 0.06 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 39.04 2yue s ASN 73 CO 0.91 -1.42 0.96 -1.81 -1.51 0.00 0.00 177.10 174.22 2yue s ASP 74 N -2.06 6.98 0.27 -1.22 1.01 -1.26 -4.77 116.67 115.62 2yue s ASP 74 Ca 0.71 1.76 0.05 0.00 0.71 0.00 0.00 52.55 55.77 2yue s ASP 74 Cb -0.23 -2.55 0.37 0.00 1.01 0.00 0.00 42.92 41.52 2yue s ASP 74 CO 0.33 -0.33 1.65 1.55 0.21 0.00 0.00 175.17 178.58 2yue h PRO 75 N 2.20 0.29 0.00 8.23 0.13 -1.95 -2.92 132.00 137.98 2yue h PRO 75 Ca -0.48 -0.15 -0.01 0.00 -0.87 0.00 0.00 66.00 64.49 2yue h PRO 75 Cb 1.19 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2yue h PRO 75 CO 0.62 0.69 -0.04 -0.39 -0.23 0.00 0.00 178.00 178.65 2yue h VAL 76 N 0.23 0.66 -0.11 1.56 -1.51 -1.93 0.59 116.25 115.75 2yue h VAL 76 Ca 0.02 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.34 2yue h VAL 76 Cb 0.90 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 2yue h VAL 76 CO 0.07 0.04 0.00 0.35 -1.23 0.00 0.00 177.57 176.80 2yue n THR 77 N -3.96 0.14 -0.01 7.19 -2.24 -1.10 -3.36 114.28 110.93 2yue n THR 77 Ca -0.03 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2yue n THR 77 Cb 0.12 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 2yue n THR 77 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2yue n LEU 78 N -0.13 0.23 -4.70 3.22 4.77 0.15 -4.97 117.00 115.57 2yue n LEU 78 Ca 0.14 -0.59 -0.44 0.00 -0.03 0.00 0.00 56.01 55.10 2yue n LEU 78 Cb 0.21 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2yue n LEU 78 CO 0.11 0.06 1.29 1.21 -1.33 0.00 0.00 177.39 178.72 2yue n GLU 79 N -0.72 2.51 -3.85 3.23 2.13 -0.93 -2.22 120.64 120.80 2yue n GLU 79 Ca 0.00 0.90 -0.26 0.00 0.66 0.00 0.00 57.16 58.47 2yue n GLU 79 Cb 0.00 -2.71 0.02 0.00 0.27 0.00 0.00 31.44 29.02 2yue n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2yue n GLY 80 N 3.63 -0.34 1.46 8.31 0.00 -1.26 -4.82 105.19 112.17 2yue n GLY 80 Ca 0.16 0.15 -0.02 0.00 0.00 0.00 0.00 46.02 46.31 2yue n GLY 80 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2yue n THR 81 N -4.42 0.00 -3.42 2.61 5.66 -0.94 -5.15 114.28 108.62 2yue n THR 81 Ca -0.19 -0.26 -0.31 0.00 -3.05 0.00 0.00 64.05 60.25 2yue n THR 81 Cb 0.63 0.51 -0.05 0.00 -1.55 0.00 0.00 70.33 69.87 2yue n THR 81 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2yue s LEU 82 N -1.06 4.15 0.00 1.09 1.43 -1.24 -4.93 118.68 118.12 2yue s LEU 82 Ca 0.02 0.83 -0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2yue s LEU 82 Cb 0.12 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.75 2yue s LEU 82 CO -0.03 -0.09 0.09 -0.81 0.23 0.00 0.00 176.35 175.73 2yue n PRO 83 N -0.32 -1.19 -0.01 1.29 -0.04 -1.26 -4.91 135.00 128.56 2yue n PRO 83 Ca -0.00 -0.14 0.13 0.00 -0.04 0.00 0.00 63.50 63.45 2yue n PRO 83 Cb 0.53 -0.13 0.71 0.00 -0.04 0.00 0.00 33.50 34.57 2yue n PRO 83 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2yue n LYS 84 N -1.77 1.18 -3.62 0.54 5.02 -1.26 -4.73 118.16 113.52 2yue n LYS 84 Ca 0.01 -0.26 -0.08 0.00 -2.02 0.00 0.00 58.31 55.96 2yue n LYS 84 Cb 0.05 -1.43 -0.06 0.00 -0.02 0.00 0.00 35.03 33.57 2yue n LYS 84 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2yue s TYR 85 N -1.98 -0.31 -0.42 2.13 6.14 -1.26 -3.95 117.35 117.70 2yue s TYR 85 Ca 0.39 0.66 0.19 0.00 0.64 0.00 0.00 57.07 58.96 2yue s TYR 85 Cb 0.19 0.43 0.94 0.00 0.42 0.00 0.00 41.96 43.94 2yue s TYR 85 CO 0.31 -0.20 1.58 0.00 0.64 0.00 0.00 175.55 177.88 2yue n ALA 86 N 1.42 1.24 -3.55 3.97 0.00 -1.26 -3.40 120.51 118.92 2yue n ALA 86 Ca -0.10 0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.39 2yue n ALA 86 Cb 0.57 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.70 2yue n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yue n PRO 88 N 0.12 0.10 0.00 0.00 -0.04 -1.26 -4.83 135.00 129.09 2yue n PRO 88 Ca -0.07 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2yue n PRO 88 Cb 0.60 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 2yue n PRO 88 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2yue n ASP 89 N -1.39 0.00 -3.63 3.54 8.00 -1.26 -1.12 116.55 120.69 2yue n ASP 89 Ca 0.05 0.66 -0.41 0.00 0.71 0.00 0.00 54.79 55.80 2yue n ASP 89 Cb 0.14 -0.16 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 2yue n ASP 89 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2yue n LEU 90 N -1.55 5.82 0.00 0.64 4.77 -0.89 -2.96 117.00 122.82 2yue n LEU 90 Ca 0.00 -3.61 0.00 0.00 -0.03 0.00 0.00 56.01 52.37 2yue n LEU 90 Cb 0.00 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.68 2yue n LEU 90 CO 0.00 0.58 0.00 0.35 -1.33 0.00 0.00 177.39 176.99 2yue n THR 91 N 5.30 0.00 -0.32 -5.08 -2.24 -1.04 -4.47 114.28 106.43 2yue n THR 91 Ca 0.52 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.34 2yue n THR 91 Cb 0.37 0.00 0.23 0.00 -2.10 0.00 0.00 70.33 68.83 2yue n THR 91 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2yue h ASN 92 N 0.00 0.94 -4.24 3.42 4.21 -1.01 -3.43 115.58 115.47 2yue h ASN 92 Ca 0.00 0.01 -0.51 0.00 1.21 0.00 0.00 56.30 57.01 2yue h ASN 92 Cb 0.00 -0.19 0.11 0.00 -1.12 0.00 0.00 38.32 37.11 2yue h ASN 92 CO 0.00 0.60 0.36 0.00 -1.29 0.00 0.00 177.43 177.10 2yue s ARG 93 N -5.93 2.71 0.14 0.81 3.03 -1.26 -4.98 118.95 113.46 2yue s ARG 93 Ca -0.12 1.29 -0.31 0.00 2.03 0.00 0.00 55.73 58.62 2yue s ARG 93 Cb 0.20 -1.95 -0.08 0.00 -1.03 0.00 0.00 34.95 32.09 2yue s ARG 93 CO 0.80 -1.31 1.35 -1.25 -1.13 0.00 0.00 175.30 173.76 2yue s PRO 94 N -4.37 4.35 0.00 3.89 0.04 -1.26 -3.88 135.00 133.77 2yue s PRO 94 Ca 0.65 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2yue s PRO 94 Cb -0.19 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2yue s PRO 94 CO 0.46 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.55 2yue n GLY 95 N 3.08 1.30 3.17 0.56 0.00 -1.26 -4.86 105.19 107.19 2yue n GLY 95 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 2yue n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yue s PHE 96 N -2.00 -0.48 -0.07 1.61 0.08 -1.25 -0.15 117.98 115.72 2yue s PHE 96 Ca 0.00 1.07 -0.01 0.00 0.12 0.00 0.00 56.93 58.11 2yue s PHE 96 Cb 0.00 0.17 0.03 0.00 -0.57 0.00 0.00 43.02 42.64 2yue s PHE 96 CO 0.00 -0.30 -0.00 -1.58 -0.10 0.00 0.00 175.22 173.24 2yue s TRP 97 N 1.37 0.69 0.04 0.36 0.51 0.89 -4.89 118.94 117.92 2yue s TRP 97 Ca -0.09 -0.18 0.00 0.00 -2.12 0.00 0.00 56.10 53.71 2yue s TRP 97 Cb -0.09 -0.80 -0.03 0.00 -0.81 0.00 0.00 33.47 31.73 2yue s TRP 97 CO -0.11 -0.33 -0.04 0.00 -0.51 0.00 0.00 176.95 175.97 2yue s ALA 98 N 1.91 0.42 0.36 0.98 0.00 -1.26 -0.15 121.76 124.02 2yue s ALA 98 Ca 0.04 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 2yue s ALA 98 Cb -0.12 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2yue s ALA 98 CO -0.05 -0.23 0.49 1.17 0.00 0.00 0.00 175.76 177.13 2yue n LYS 99 N 0.82 0.70 -4.94 0.00 3.00 -0.16 -4.96 118.16 112.62 2yue n LYS 99 Ca -0.19 -2.96 -0.33 0.00 -0.00 0.00 0.00 58.31 54.84 2yue n LYS 99 Cb 0.58 2.80 -0.15 0.00 0.00 0.00 0.00 35.03 38.26 2yue n LYS 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2yue s ALA 100 N -2.88 2.44 0.29 3.14 0.00 -1.26 -2.26 121.76 121.23 2yue s ALA 100 Ca 0.31 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 51.27 2yue s ALA 100 Cb -0.01 -1.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.00 2yue s ALA 100 CO 0.22 0.26 0.60 -1.17 0.00 0.00 0.00 175.76 175.67 2yue s LEU 101 N 0.36 4.05 0.04 0.00 0.20 -1.25 -5.02 118.68 117.06 2yue s LEU 101 Ca -0.14 0.89 -0.30 0.00 0.69 0.00 0.00 54.13 55.27 2yue s LEU 101 Cb -0.17 -3.70 -0.08 0.00 -0.43 0.00 0.00 46.19 41.81 2yue s LEU 101 CO 0.07 -0.20 1.71 -2.28 -0.29 0.00 0.00 176.35 175.36 2yue s HIS 102 N -2.05 2.13 0.39 5.38 2.46 -1.26 -4.54 115.29 117.81 2yue s HIS 102 Ca 0.47 0.16 0.15 0.00 0.47 0.00 0.00 55.06 56.31 2yue s HIS 102 Cb -0.11 -4.00 1.01 0.00 -0.13 0.00 0.00 32.58 29.35 2yue s HIS 102 CO 0.27 -4.16 1.84 1.05 -2.47 0.00 0.00 174.74 171.27 2yue h GLU 103 N 8.96 0.47 -0.80 2.88 4.11 -1.95 0.19 114.58 128.45 2yue h GLU 103 Ca -0.43 -0.03 0.23 0.00 0.07 0.00 0.00 59.36 59.20 2yue h GLU 103 Cb 1.20 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 2yue h GLU 103 CO 0.94 0.31 0.57 -0.56 0.07 0.00 0.00 179.01 180.34 2yue h GLN 104 N 0.49 0.00 0.00 1.06 3.07 -2.04 0.16 115.11 117.85 2yue h GLN 104 Ca 0.49 -0.00 -0.12 0.00 0.09 0.00 0.00 58.65 59.10 2yue h GLN 104 Cb 1.10 -0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.64 2yue h GLN 104 CO -0.21 0.00 -1.73 0.66 0.09 0.00 0.00 178.83 177.64 2yue n TYR 105 N -4.30 0.47 -1.38 0.06 4.01 0.61 -4.59 117.16 112.04 2yue n TYR 105 Ca 0.16 0.15 -0.39 0.00 -0.16 0.00 0.00 57.90 57.66 2yue n TYR 105 Cb 0.86 -0.86 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 2yue n TYR 105 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2yue s GLU 107 N 3.53 2.19 0.57 0.00 2.02 -1.26 -4.94 118.70 120.81 2yue s GLU 107 Ca 0.53 -1.78 -0.15 0.00 0.02 0.00 0.00 54.97 53.59 2yue s GLU 107 Cb 0.14 -1.98 -0.05 0.00 0.10 0.00 0.00 34.13 32.35 2yue s GLU 107 CO -0.02 0.01 1.03 0.21 0.02 0.00 0.00 175.26 176.50 2yue s LYS 108 N -3.82 3.55 -1.32 1.61 2.20 -1.26 -3.95 119.74 116.75 2yue s LYS 108 Ca 0.38 1.06 -0.01 0.00 -0.36 0.00 0.00 55.97 57.05 2yue s LYS 108 Cb 0.02 -2.07 0.01 0.00 -1.51 0.00 0.00 37.83 34.27 2yue s LYS 108 CO 0.21 -0.61 0.71 -3.47 -0.36 0.00 0.00 175.35 171.84 2yue n ASP 109 N -1.98 -1.39 -3.92 1.43 -0.08 0.25 -4.95 116.55 105.92 2yue n ASP 109 Ca 0.08 -0.82 -0.16 0.00 -1.51 0.00 0.00 54.79 52.38 2yue n ASP 109 Cb 0.53 -4.03 -0.15 0.00 2.34 0.00 0.00 41.12 39.81 2yue n ASP 109 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 2yue s ASN 110 N -4.29 0.54 -0.27 1.67 0.01 -1.25 -4.94 114.94 106.40 2yue s ASN 110 Ca 0.05 -0.07 -0.19 0.00 -0.71 0.00 0.00 52.86 51.93 2yue s ASN 110 Cb -0.02 -0.13 -0.02 0.00 0.41 0.00 0.00 41.25 41.49 2yue s ASN 110 CO 0.81 0.01 0.58 -0.63 -1.51 0.00 0.00 177.10 176.37 2yue s ILE 111 N 0.22 5.01 -0.27 0.60 1.01 -1.26 -1.37 121.20 125.13 2yue s ILE 111 Ca -0.02 0.95 -0.01 0.00 0.00 0.00 0.00 60.65 61.57 2yue s ILE 111 Cb -0.05 -3.90 0.05 0.00 0.01 0.00 0.00 42.46 38.56 2yue s ILE 111 CO -0.00 0.01 -0.05 -0.22 0.00 0.00 0.00 174.94 174.68 2yue s LEU 112 N 2.44 3.56 -0.11 2.97 2.96 -0.37 -0.99 118.68 129.14 2yue s LEU 112 Ca 0.24 -1.19 -0.03 0.00 -0.22 0.00 0.00 54.13 52.93 2yue s LEU 112 Cb -0.15 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 2yue s LEU 112 CO 0.09 -0.20 -0.01 -0.72 -1.32 0.00 0.00 176.35 174.20 2yue s TYR 113 N 1.24 3.12 0.03 5.38 1.13 -0.06 -0.20 117.35 127.98 2yue s TYR 113 Ca -0.05 0.04 0.02 0.00 -1.41 0.00 0.00 57.07 55.68 2yue s TYR 113 Cb -0.19 -1.86 -0.02 0.00 -1.10 0.00 0.00 41.96 38.79 2yue s TYR 113 CO -0.03 0.29 -0.08 1.52 -2.51 0.00 0.00 175.55 174.73 2yue s TYR 114 N -0.39 0.71 0.36 -3.49 1.13 -0.63 -0.84 117.35 114.20 2yue s TYR 114 Ca 0.07 -0.35 -0.17 0.00 -1.41 0.00 0.00 57.07 55.22 2yue s TYR 114 Cb -0.12 -0.43 0.05 0.00 -1.10 0.00 0.00 41.96 40.36 2yue s TYR 114 CO 0.02 -0.04 0.78 1.52 -2.51 0.00 0.00 175.55 175.32 2yue s TYR 115 N -0.90 0.05 0.06 -3.49 -0.85 -0.44 -1.14 117.35 110.64 2yue s TYR 115 Ca -0.04 -0.68 0.07 0.00 -0.52 0.00 0.00 57.07 55.89 2yue s TYR 115 Cb -0.07 0.81 -0.03 0.00 0.38 0.00 0.00 41.96 43.06 2yue s TYR 115 CO 0.00 -1.50 -0.20 0.54 -1.52 0.00 0.00 175.55 172.87 2yue s VAL 116 N -2.65 1.60 0.35 -3.49 0.11 -1.10 0.04 120.40 115.26 2yue s VAL 116 Ca 0.14 -1.26 0.03 0.00 -2.93 0.00 0.00 61.98 57.97 2yue s VAL 116 Cb -0.05 -1.41 0.06 0.00 -1.53 0.00 0.00 36.38 33.44 2yue s VAL 116 CO 0.10 0.11 0.48 -0.46 -3.33 0.00 0.00 175.10 172.01 2yue n ASN 117 N 1.67 1.01 0.00 3.54 0.23 -0.47 -3.46 115.26 117.78 2yue n ASN 117 Ca -0.18 -1.77 0.09 0.00 -0.53 0.00 0.00 54.58 52.19 2yue n ASN 117 Cb 0.54 -0.28 0.44 0.00 -2.08 0.00 0.00 39.78 38.39 2yue n ASN 117 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2yue n GLY 118 N 1.00 -0.94 2.01 4.83 0.00 -1.26 -2.63 105.19 108.20 2yue n GLY 118 Ca 0.09 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 2yue n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yue n ALA 119 N -1.34 5.04 -2.24 4.61 0.00 -1.26 -4.90 120.51 120.43 2yue n ALA 119 Ca 0.08 -2.71 -0.12 0.00 0.00 0.00 0.00 53.44 50.68 2yue n ALA 119 Cb 0.16 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 2yue n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yue n GLY 120 N -0.77 -0.18 3.39 0.00 0.00 -1.08 -4.92 105.19 101.63 2yue n GLY 120 Ca 0.49 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.15 2yue n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yue s ASP 121 N -2.03 4.81 -0.34 1.61 1.01 -1.26 -3.45 116.67 117.02 2yue s ASP 121 Ca 0.00 -0.29 -0.21 0.00 0.71 0.00 0.00 52.55 52.76 2yue s ASP 121 Cb 0.00 -1.85 0.00 0.00 1.01 0.00 0.00 42.92 42.08 2yue s ASP 121 CO 0.00 -0.03 0.68 -0.69 0.21 0.00 0.00 175.17 175.33 2yue s VAL 122 N 1.56 4.86 -0.02 -1.27 1.01 0.87 -1.37 120.40 126.04 2yue s VAL 122 Ca 0.06 0.77 0.01 0.00 0.00 0.00 0.00 61.98 62.82 2yue s VAL 122 Cb -0.15 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 2yue s VAL 122 CO 0.01 -0.29 -0.02 -0.63 0.00 0.00 0.00 175.10 174.17 2yue s ILE 123 N 2.78 4.01 0.23 2.22 1.09 0.11 -0.90 121.20 130.74 2yue s ILE 123 Ca 0.27 -0.57 0.10 0.00 -1.10 0.00 0.00 60.65 59.34 2yue s ILE 123 Cb -0.14 -2.74 -0.05 0.00 -1.06 0.00 0.00 42.46 38.47 2yue s ILE 123 CO 0.14 0.45 -0.17 -0.72 -0.10 0.00 0.00 174.94 174.54 2yue s TYR 124 N -1.00 1.95 0.09 3.97 1.13 -1.21 -1.33 117.35 120.96 2yue s TYR 124 Ca 0.17 -0.46 -0.25 0.00 -1.41 0.00 0.00 57.07 55.11 2yue s TYR 124 Cb -0.11 -0.89 0.08 0.00 -1.10 0.00 0.00 41.96 39.94 2yue s TYR 124 CO 0.07 0.49 0.71 0.20 -2.51 0.00 0.00 175.55 174.51 2yue s GLY 125 N -3.28 -0.56 -0.18 5.49 0.00 -0.02 -1.69 107.32 107.09 2yue s GLY 125 Ca 0.24 0.73 -0.01 0.00 0.00 0.00 0.00 44.72 45.68 2yue s GLY 125 CO 0.10 0.27 -0.13 -0.42 0.00 0.00 0.00 173.10 172.91 2yue s ILE 126 N -3.39 2.73 -1.04 0.90 -1.09 -0.89 -0.88 121.20 117.54 2yue s ILE 126 Ca 0.02 -0.73 -0.02 0.00 -2.23 0.00 0.00 60.65 57.69 2yue s ILE 126 Cb -0.01 -2.18 0.00 0.00 -1.58 0.00 0.00 42.46 38.69 2yue s ILE 126 CO -0.10 0.50 0.87 0.59 -1.23 0.00 0.00 174.94 175.57 2yue n ASN 127 N 4.37 -2.88 -2.05 3.58 3.02 -0.16 -2.38 115.26 118.77 2yue n ASN 127 Ca -0.19 -0.50 -0.18 0.00 -0.03 0.00 0.00 54.58 53.68 2yue n ASN 127 Cb 0.51 -4.36 -0.01 0.00 -0.61 0.00 0.00 39.78 35.31 2yue n ASN 127 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2yue n ASN 128 N -2.67 -5.16 -3.88 6.41 3.02 -1.26 -4.96 115.26 106.75 2yue n ASN 128 Ca -0.18 -0.03 -0.30 0.00 -0.03 0.00 0.00 54.58 54.04 2yue n ASN 128 Cb 0.62 -4.23 -0.13 0.00 -0.61 0.00 0.00 39.78 35.43 2yue n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2yue s GLU 129 N -4.93 1.87 0.56 3.52 2.02 -1.00 -5.10 118.70 115.65 2yue s GLU 129 Ca 0.02 -2.57 -0.20 0.00 0.02 0.00 0.00 54.97 52.24 2yue s GLU 129 Cb -0.01 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 2yue s GLU 129 CO 0.02 -1.15 1.25 -1.83 0.02 0.00 0.00 175.26 173.58 2yue s GLU 130 N -0.29 3.11 -0.01 1.61 1.03 -1.26 -2.10 118.70 120.78 2yue s GLU 130 Ca 0.18 1.95 0.04 0.00 0.03 0.00 0.00 54.97 57.17 2yue s GLU 130 Cb -0.23 -2.08 -0.06 0.00 -0.80 0.00 0.00 34.13 30.96 2yue s GLU 130 CO -0.02 -1.13 0.08 1.63 -1.33 0.00 0.00 175.26 174.49 2yue n LYS 131 N -1.29 0.31 0.00 -4.83 4.76 -0.68 -4.94 118.16 111.49 2yue n LYS 131 Ca 0.12 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 2yue n LYS 131 Cb 0.48 -1.10 0.00 0.00 -1.84 0.00 0.00 35.03 32.57 2yue n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2yue n GLY 132 N 2.30 1.25 3.73 0.72 0.00 -1.26 -5.05 105.19 106.88 2yue n GLY 132 Ca -0.01 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 2yue n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yue s VAL 133 N -1.14 3.16 -0.01 1.61 0.11 -1.26 -3.35 120.40 119.52 2yue s VAL 133 Ca 0.00 0.89 0.01 0.00 -2.93 0.00 0.00 61.98 59.95 2yue s VAL 133 Cb 0.00 -3.57 -0.01 0.00 -1.53 0.00 0.00 36.38 31.27 2yue s VAL 133 CO 0.00 0.10 0.00 0.00 -3.33 0.00 0.00 175.10 171.87 2yue n ILE 134 N 3.32 0.07 -4.39 7.04 3.06 -0.08 -4.97 119.36 123.41 2yue n ILE 134 Ca 0.09 -0.04 -0.20 0.00 -2.50 0.00 0.00 62.75 60.10 2yue n ILE 134 Cb 0.42 -0.97 -0.14 0.00 0.54 0.00 0.00 39.64 39.49 2yue n ILE 134 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 2yue s LEU 135 N -4.08 2.14 0.00 9.51 2.96 -1.10 -4.95 118.68 123.16 2yue s LEU 135 Ca -0.00 -0.40 0.05 0.00 -0.22 0.00 0.00 54.13 53.55 2yue s LEU 135 Cb 0.00 -0.59 -0.02 0.00 0.50 0.00 0.00 46.19 46.08 2yue s LEU 135 CO 0.04 0.05 0.19 0.35 -1.32 0.00 0.00 176.35 175.67 2yue n THR 136 N 2.09 0.00 -0.70 3.68 -2.24 -1.26 -0.09 114.28 115.76 2yue n THR 136 Ca -0.17 -2.13 0.00 0.00 -2.27 0.00 0.00 64.05 59.48 2yue n THR 136 Cb 0.55 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 2yue n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yue n GLY 137 N -0.51 0.62 3.73 3.38 0.00 -1.22 -4.99 105.19 106.19 2yue n GLY 137 Ca 0.01 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 2yue n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yue s ILE 138 N -2.00 5.02 0.39 -0.61 1.09 -1.23 -5.03 121.20 118.83 2yue s ILE 138 Ca 0.00 1.36 -0.10 0.00 -1.10 0.00 0.00 60.65 60.81 2yue s ILE 138 Cb 0.00 -4.00 -0.06 0.00 -1.06 0.00 0.00 42.46 37.34 2yue s ILE 138 CO 0.00 0.30 0.74 -0.62 -0.10 0.00 0.00 174.94 175.26 2yue s ASP 139 N 0.56 6.52 -0.16 3.58 2.15 -1.26 -4.39 116.67 123.68 2yue s ASP 139 Ca 0.35 1.08 0.15 0.00 0.43 0.00 0.00 52.55 54.56 2yue s ASP 139 Cb -0.18 -2.30 0.42 0.00 -0.30 0.00 0.00 42.92 40.57 2yue s ASP 139 CO 0.17 -0.36 1.21 0.35 -0.17 0.00 0.00 175.17 176.36 2yue n THR 140 N -1.21 1.63 -0.10 1.71 -2.24 -1.26 -4.78 114.28 108.03 2yue n THR 140 Ca 0.02 -2.69 -0.20 0.00 -2.27 0.00 0.00 64.05 58.91 2yue n THR 140 Cb 0.54 0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.78 2yue n THR 140 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2yue n ARG 141 N -0.68 0.49 -3.26 -0.78 5.12 -1.26 -5.04 116.66 111.24 2yue n ARG 141 Ca 0.16 0.21 -0.20 0.00 -1.93 0.00 0.00 57.85 56.09 2yue n ARG 141 Cb 0.82 -1.33 0.03 0.00 -1.16 0.00 0.00 32.46 30.82 2yue n ARG 141 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2yue s SER 142 N -6.75 5.13 1.11 0.55 1.04 -1.26 -5.09 113.70 108.42 2yue s SER 142 Ca -0.30 -0.82 -0.18 0.00 0.48 0.00 0.00 55.95 55.13 2yue s SER 142 Cb 0.10 0.00 0.10 0.00 0.10 0.00 0.00 66.02 66.32 2yue s SER 142 CO 0.40 -1.08 0.03 0.18 0.98 0.00 0.00 173.24 173.75 2yue n LEU 143 N -1.98 -2.18 -3.81 2.42 4.77 -1.26 -5.03 117.00 109.94 2yue n LEU 143 Ca 0.09 -0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.85 2yue n LEU 143 Cb 0.62 -0.97 -0.10 0.00 -2.33 0.00 0.00 43.42 40.63 2yue n LEU 143 CO 0.40 -3.12 -0.07 -0.76 -1.33 0.00 0.00 177.39 172.51 2yue s LEU 144 N -1.30 1.15 0.05 2.23 1.43 -1.26 -4.88 118.68 116.10 2yue s LEU 144 Ca 0.56 0.10 0.04 0.00 -1.03 0.00 0.00 54.13 53.80 2yue s LEU 144 Cb -0.12 0.95 -0.03 0.00 0.03 0.00 0.00 46.19 47.02 2yue s LEU 144 CO 0.66 -0.32 -0.12 0.26 0.23 0.00 0.00 176.35 177.06 2yue s TRP 145 N -0.95 1.07 0.33 0.29 0.51 -0.97 -2.96 118.94 116.26 2yue s TRP 145 Ca -0.10 -0.43 -0.02 0.00 -2.12 0.00 0.00 56.10 53.43 2yue s TRP 145 Cb -0.05 -0.62 -0.04 0.00 -0.81 0.00 0.00 33.47 31.95 2yue s TRP 145 CO 0.02 0.02 0.56 0.95 -0.51 0.00 0.00 176.95 177.99 2yue s THR 146 N -1.14 5.07 0.00 2.01 -4.23 -1.26 -0.21 115.64 115.88 2yue s THR 146 Ca -0.03 -0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 2yue s THR 146 Cb -0.09 -3.81 -0.01 0.00 1.34 0.00 0.00 72.50 69.93 2yue s THR 146 CO 0.01 -0.48 0.01 0.68 -0.54 0.00 0.00 174.62 174.30 2yue s VAL 147 N -2.25 0.04 -0.13 2.29 -7.23 0.44 -2.21 120.40 111.34 2yue s VAL 147 Ca 0.42 -0.33 -0.06 0.00 -1.81 0.00 0.00 61.98 60.19 2yue s VAL 147 Cb -0.10 -0.13 0.06 0.00 0.56 0.00 0.00 36.38 36.77 2yue s VAL 147 CO 0.34 -0.18 0.30 -0.63 -0.31 0.00 0.00 175.10 174.63 2yue s ILE 148 N -0.54 -0.15 -0.23 -0.62 1.01 0.13 -0.94 121.20 119.87 2yue s ILE 148 Ca -0.06 0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 2yue s ILE 148 Cb -0.04 -0.47 -0.02 0.00 0.01 0.00 0.00 42.46 41.94 2yue s ILE 148 CO -0.00 0.07 0.01 -0.62 0.00 0.00 0.00 174.94 174.39 2yue s ASP 149 N 1.61 4.73 -0.73 3.58 -1.08 0.61 -0.09 116.67 125.30 2yue s ASP 149 Ca -0.07 -0.28 -0.10 0.00 -0.52 0.00 0.00 52.55 51.58 2yue s ASP 149 Cb -0.10 -1.83 0.19 0.00 -1.46 0.00 0.00 42.92 39.72 2yue s ASP 149 CO -0.10 -0.01 0.62 0.27 0.52 0.00 0.00 175.17 176.47 2yue s ILE 150 N 1.43 4.82 -0.38 4.11 -0.00 -0.90 -3.71 121.20 126.57 2yue s ILE 150 Ca 0.05 -2.59 -0.03 0.00 -0.00 0.00 0.00 60.65 58.08 2yue s ILE 150 Cb -0.15 -4.04 0.20 0.00 -0.00 0.00 0.00 42.46 38.47 2yue s ILE 150 CO 0.00 -0.96 0.97 -0.47 -0.00 0.00 0.00 174.94 174.49 2yue s TYR 151 N 0.18 -0.72 0.00 1.37 5.04 -1.26 -4.71 117.35 117.24 2yue s TYR 151 Ca 0.16 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 2yue s TYR 151 Cb -0.15 0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.30 2yue s TYR 151 CO -0.06 -0.54 0.00 0.41 -1.34 0.00 0.00 175.55 174.02 2yue n GLY 152 N 3.09 1.96 0.83 8.97 0.00 -1.26 -4.95 105.19 113.82 2yue n GLY 152 Ca 0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 2yue n GLY 152 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yue n ASN 153 N 0.00 -0.46 -3.73 1.61 4.13 -1.23 -3.45 115.26 112.13 2yue n ASN 153 Ca 0.00 -1.64 -0.14 0.00 1.68 0.00 0.00 54.58 54.49 2yue n ASN 153 Cb 0.00 0.13 -0.09 0.00 -1.54 0.00 0.00 39.78 38.28 2yue n ASN 153 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2yue n THR 155 N 2.01 0.27 -4.87 0.00 -2.24 -0.84 -4.14 114.28 104.47 2yue n THR 155 Ca -0.17 0.09 -0.33 0.00 -2.27 0.00 0.00 64.05 61.37 2yue n THR 155 Cb 0.57 -1.12 -0.13 0.00 -2.10 0.00 0.00 70.33 67.54 2yue n THR 155 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2yue s GLY 156 N -3.23 1.53 -0.03 3.38 0.00 -0.17 -2.87 107.32 105.92 2yue s GLY 156 Ca 0.00 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.77 2yue s GLY 156 CO 0.00 -0.63 -0.04 -0.26 0.00 0.00 0.00 173.10 172.17 2yue s ILE 157 N -0.47 0.46 -0.18 0.90 -4.36 0.75 -0.40 121.20 117.89 2yue s ILE 157 Ca 0.06 -0.11 -0.00 0.00 -0.26 0.00 0.00 60.65 60.33 2yue s ILE 157 Cb -0.12 -0.48 0.01 0.00 1.25 0.00 0.00 42.46 43.12 2yue s ILE 157 CO 0.02 0.19 -0.14 -0.70 0.24 0.00 0.00 174.94 174.54 2yue s GLU 158 N 0.71 3.17 0.32 0.37 2.12 -0.47 -0.53 118.70 124.39 2yue s GLU 158 Ca -0.09 -0.75 -0.27 0.00 0.36 0.00 0.00 54.97 54.22 2yue s GLU 158 Cb -0.12 -2.70 -0.09 0.00 0.26 0.00 0.00 34.13 31.48 2yue s GLU 158 CO -0.00 -0.12 1.02 -0.06 -0.54 0.00 0.00 175.26 175.55 2yue s PHE 159 N 1.16 3.59 0.34 5.30 0.40 -1.25 0.06 117.98 127.59 2yue s PHE 159 Ca 0.01 1.75 0.08 0.00 -0.60 0.00 0.00 56.93 58.17 2yue s PHE 159 Cb -0.14 -3.09 -0.07 0.00 0.51 0.00 0.00 43.02 40.23 2yue s PHE 159 CO -0.06 -0.19 -0.06 -0.51 0.70 0.00 0.00 175.22 175.10 2yue s LEU 160 N -1.90 2.68 -0.54 -0.37 1.43 -0.12 -4.88 118.68 114.98 2yue s LEU 160 Ca 0.49 -1.24 -0.21 0.00 -1.03 0.00 0.00 54.13 52.14 2yue s LEU 160 Cb -0.25 -0.88 0.06 0.00 0.03 0.00 0.00 46.19 45.15 2yue s LEU 160 CO 0.31 -0.30 0.78 -1.81 0.23 0.00 0.00 176.35 175.56 2yue s ASP 161 N -3.59 6.26 0.51 2.29 1.11 -1.26 -3.85 116.67 118.14 2yue s ASP 161 Ca 0.33 -0.75 0.27 0.00 0.18 0.00 0.00 52.55 52.58 2yue s ASP 161 Cb 0.04 -2.36 1.39 0.00 1.07 0.00 0.00 42.92 43.07 2yue s ASP 161 CO 0.16 -1.08 1.91 0.77 1.18 0.00 0.00 175.17 178.11 2yue h SER 162 N 9.18 0.07 -0.41 0.27 4.64 -1.91 0.23 113.55 125.62 2yue h SER 162 Ca -0.27 0.01 0.12 0.00 -0.47 0.00 0.00 61.79 61.17 2yue h SER 162 Cb 1.08 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 2yue h SER 162 CO 1.04 0.03 0.34 0.03 -0.87 0.00 0.00 176.83 177.40 2yue h ARG 163 N 0.07 0.00 -0.03 4.77 3.08 -1.90 0.18 114.38 120.55 2yue h ARG 163 Ca 0.39 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 60.18 2yue h ARG 163 Cb 1.43 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.50 2yue h ARG 163 CO -0.03 0.00 -0.99 0.82 -1.07 0.00 0.00 179.97 178.69 2yue h ILE 164 N 0.00 1.28 -0.93 2.04 2.04 -0.96 -3.23 117.51 117.76 2yue h ILE 164 Ca 0.19 -2.21 -0.44 0.00 1.00 0.00 0.00 64.86 63.41 2yue h ILE 164 Cb 0.86 2.31 -0.26 0.00 -0.74 0.00 0.00 36.82 38.99 2yue h ILE 164 CO -0.00 0.68 0.55 -1.22 0.00 0.00 0.00 178.15 178.17 2yue n TYR 165 N -3.86 2.92 -4.25 1.37 4.02 -0.17 -4.94 117.16 112.25 2yue n TYR 165 Ca -0.10 -1.67 -0.17 0.00 -0.01 0.00 0.00 57.90 55.95 2yue n TYR 165 Cb 0.86 -0.88 -0.08 0.00 -0.02 0.00 0.00 39.34 39.22 2yue n TYR 165 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 2yue s MET 166 N -3.21 1.66 0.00 -0.72 -1.94 -0.13 -4.99 119.30 109.98 2yue s MET 166 Ca 0.57 -1.91 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 2yue s MET 166 Cb 0.47 0.33 0.00 0.00 2.01 0.00 0.00 34.83 37.64 2yue s MET 166 CO 0.12 -0.61 0.00 2.48 -0.01 0.00 0.00 175.02 177.00 2yue n TYR 167 N -0.55 -0.51 0.93 -0.03 4.11 -1.26 -4.90 117.16 114.95 2yue n TYR 167 Ca 0.06 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 58.07 2yue n TYR 167 Cb 0.63 0.10 0.09 0.00 -0.00 0.00 0.00 39.34 40.16 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.86 177.80