#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 2.44 -0.23 1.61 1.04 -1.26 -5.07 113.70 112.23 2yue s SER 2 Ca 0.00 -0.71 -0.16 0.00 0.48 0.00 0.00 55.95 55.56 2yue s SER 2 Cb 0.00 -0.13 -0.10 0.00 0.10 0.00 0.00 66.02 65.89 2yue s SER 2 CO 0.00 0.02 -0.29 -0.24 0.98 0.00 0.00 173.24 173.71 2yue n SER 3 N 0.97 1.93 -0.32 7.02 2.88 -1.26 -5.11 113.62 119.73 2yue n SER 3 Ca -0.19 0.36 0.03 0.00 -1.33 0.00 0.00 58.87 57.74 2yue n SER 3 Cb 0.54 -0.81 -0.01 0.00 -0.75 0.00 0.00 64.21 63.18 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 1.35 -1.99 3.64 0.46 0.00 -1.26 -4.73 105.19 102.66 2yue n GLY 4 Ca -0.38 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 2yue n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yue s SER 5 N -3.67 6.76 0.02 1.61 1.04 -1.26 -4.93 113.70 113.27 2yue s SER 5 Ca 0.00 1.29 -0.05 0.00 0.48 0.00 0.00 55.95 57.67 2yue s SER 5 Cb 0.00 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.60 2yue s SER 5 CO 0.00 -0.99 0.22 -0.24 0.98 0.00 0.00 173.24 173.22 2yue n SER 6 N 7.31 -0.30 -3.13 7.02 2.88 -1.26 -5.09 113.62 121.05 2yue n SER 6 Ca 0.14 -1.13 -0.24 0.00 -1.33 0.00 0.00 58.87 56.32 2yue n SER 6 Cb 0.46 0.48 -0.05 0.00 -0.75 0.00 0.00 64.21 64.35 2yue n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yue n GLY 7 N -0.16 4.47 3.25 0.46 0.00 -1.26 -5.10 105.19 106.85 2yue n GLY 7 Ca 0.00 -2.27 -0.28 0.00 0.00 0.00 0.00 46.02 43.47 2yue n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yue n PRO 8 N 0.33 -3.00 -4.88 1.61 -0.04 -1.26 -5.06 135.00 122.70 2yue n PRO 8 Ca 0.28 -1.62 -0.33 0.00 -0.04 0.00 0.00 63.50 61.79 2yue n PRO 8 Cb 0.50 -1.52 -0.15 0.00 -0.04 0.00 0.00 33.50 32.29 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 2.56 0.00 1.53 2.96 -1.26 -4.97 118.68 119.50 2yue s LEU 9 Ca 0.66 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 54.20 2yue s LEU 9 Cb -0.06 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 2yue s LEU 9 CO 0.50 0.16 0.06 0.00 -1.32 0.00 0.00 176.35 175.76 2yue n GLN 10 N 3.54 0.58 -3.14 1.98 6.02 -1.26 -4.69 117.38 120.41 2yue n GLN 10 Ca -0.18 -1.12 -0.37 0.00 -0.01 0.00 0.00 57.00 55.32 2yue n GLN 10 Cb 0.53 0.71 -0.06 0.00 1.02 0.00 0.00 30.24 32.44 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 -2.18 3.69 0.34 1.08 0.08 -1.26 -1.12 117.98 118.60 2yue s PHE 11 Ca 0.09 1.37 -0.17 0.00 0.12 0.00 0.00 56.93 58.33 2yue s PHE 11 Cb 0.00 -2.59 -0.09 0.00 -0.57 0.00 0.00 43.02 39.77 2yue s PHE 11 CO 0.06 0.40 0.79 -1.58 -0.10 0.00 0.00 175.22 174.79 2yue s HIS 12 N -1.42 3.40 0.28 0.36 2.46 -1.19 -4.45 115.29 114.73 2yue s HIS 12 Ca 0.40 1.35 0.02 0.00 0.47 0.00 0.00 55.06 57.29 2yue s HIS 12 Cb -0.18 -2.63 0.61 0.00 -0.13 0.00 0.00 32.58 30.26 2yue s HIS 12 CO 0.21 0.07 1.77 0.77 -2.47 0.00 0.00 174.74 175.10 2yue h SER 13 N 2.32 0.66 -2.45 9.88 0.02 -1.93 -3.40 113.55 118.65 2yue h SER 13 Ca -0.48 0.09 -0.53 0.00 -0.84 0.00 0.00 61.79 60.03 2yue h SER 13 Cb 1.18 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 63.71 2yue h SER 13 CO 0.64 0.27 1.18 0.54 -1.14 0.00 0.00 176.83 178.32 2yue s VAL 14 N -5.93 3.08 0.19 2.27 0.11 -1.26 -4.95 120.40 113.92 2yue s VAL 14 Ca -0.12 0.19 -0.23 0.00 -2.93 0.00 0.00 61.98 58.90 2yue s VAL 14 Cb 0.23 -3.12 0.05 0.00 -1.53 0.00 0.00 36.38 32.01 2yue s VAL 14 CO 0.79 -0.01 0.71 -1.38 -3.33 0.00 0.00 175.10 171.88 2yue s HIS 15 N 4.09 -0.34 1.12 1.54 -0.00 -1.26 -4.06 115.29 116.38 2yue s HIS 15 Ca 0.84 0.03 -0.18 0.00 -0.00 0.00 0.00 55.06 55.75 2yue s HIS 15 Cb -0.41 0.63 0.14 0.00 -0.00 0.00 0.00 32.58 32.93 2yue s HIS 15 CO 0.38 -0.97 0.11 0.41 -0.00 0.00 0.00 174.74 174.66 2yue n GLY 16 N -0.41 -2.57 0.13 -1.38 0.00 -0.15 -4.77 105.19 96.04 2yue n GLY 16 Ca -0.10 -0.84 -0.21 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.28 0.60 -0.90 1.61 1.82 -1.89 -3.31 116.42 112.06 2yue h ASP 17 Ca -0.48 -0.90 -0.48 0.00 -0.39 0.00 0.00 57.03 54.79 2yue h ASP 17 Cb 1.25 -0.19 -0.18 0.00 0.68 0.00 0.00 39.33 40.89 2yue h ASP 17 CO 0.34 1.44 0.52 0.59 -1.61 0.00 0.00 179.24 180.52 2yue n ASN 18 N -4.03 6.72 -3.91 2.28 5.03 -1.21 -4.87 115.26 115.26 2yue n ASN 18 Ca -0.14 -3.28 -0.18 0.00 0.87 0.00 0.00 54.58 51.85 2yue n ASN 18 Cb 0.86 -1.12 -0.16 0.00 -1.02 0.00 0.00 39.78 38.35 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 -2.82 0.46 -0.35 2.41 -1.09 -1.25 -2.82 121.20 115.74 2yue s ILE 19 Ca 0.48 -0.15 -0.02 0.00 -2.23 0.00 0.00 60.65 58.73 2yue s ILE 19 Cb 0.35 -0.46 0.08 0.00 -1.58 0.00 0.00 42.46 40.85 2yue s ILE 19 CO -0.12 0.18 0.10 -0.60 -1.23 0.00 0.00 174.94 173.27 2yue s ARG 20 N 0.52 2.22 -0.43 2.79 6.06 -0.05 -4.86 118.95 125.20 2yue s ARG 20 Ca -0.06 -1.53 -0.06 0.00 -2.50 0.00 0.00 55.73 51.57 2yue s ARG 20 Cb -0.10 -3.39 0.10 0.00 0.06 0.00 0.00 34.95 31.63 2yue s ARG 20 CO -0.00 -0.84 0.26 0.42 -2.50 0.00 0.00 175.30 172.64 2yue s ILE 21 N 1.20 3.81 -0.29 4.11 1.01 -1.26 -1.14 121.20 128.64 2yue s ILE 21 Ca 0.02 -1.79 -0.16 0.00 0.00 0.00 0.00 60.65 58.71 2yue s ILE 21 Cb -0.21 -3.50 0.13 0.00 0.01 0.00 0.00 42.46 38.89 2yue s ILE 21 CO -0.02 -0.66 0.89 -0.44 0.00 0.00 0.00 174.94 174.70 2yue s SER 22 N 2.19 -0.65 0.29 3.58 0.01 -0.86 -4.97 113.70 113.29 2yue s SER 22 Ca 0.06 1.03 -0.18 0.00 1.31 0.00 0.00 55.95 58.17 2yue s SER 22 Cb -0.24 1.28 0.02 0.00 0.21 0.00 0.00 66.02 67.29 2yue s SER 22 CO -0.02 -0.16 0.68 -0.60 0.41 0.00 0.00 173.24 173.55 2yue s ARG 23 N 1.45 1.83 0.58 12.44 3.52 -1.26 -4.72 118.95 132.79 2yue s ARG 23 Ca -0.09 -1.15 0.28 0.00 -0.13 0.00 0.00 55.73 54.64 2yue s ARG 23 Cb -0.04 0.58 1.70 0.00 -1.56 0.00 0.00 34.95 35.63 2yue s ARG 23 CO -0.16 -0.83 2.18 0.22 -0.81 0.00 0.00 175.30 175.90 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 3.58 -2.03 -3.38 116.42 114.53 2yue h ASP 24 Ca -0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2yue h ASP 24 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2yue h ASP 24 CO 0.29 0.00 -0.16 0.61 -2.88 0.00 0.00 179.24 177.10 2yue n GLY 25 N -1.38 -0.12 0.00 -0.78 0.00 -1.26 -5.12 105.19 96.53 2yue n GLY 25 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.10 0.00 -3.61 2.61 5.66 -1.26 -4.96 114.28 109.62 2yue n THR 26 Ca 0.00 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 2yue n THR 26 Cb 0.08 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.79 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 -0.64 -0.04 1.09 0.20 -1.26 -3.75 118.68 114.28 2yue s LEU 27 Ca 0.00 1.13 0.06 0.00 0.69 0.00 0.00 54.13 56.01 2yue s LEU 27 Cb 0.00 2.30 -0.02 0.00 -0.43 0.00 0.00 46.19 48.04 2yue s LEU 27 CO 0.00 -0.29 -0.23 0.00 -0.29 0.00 0.00 176.35 175.54 2yue s ALA 28 N -0.00 2.25 0.04 5.97 0.00 0.65 -2.03 121.76 128.65 2yue s ALA 28 Ca -0.01 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 50.88 2yue s ALA 28 Cb -0.04 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 2yue s ALA 28 CO 0.01 0.48 -0.04 -0.98 0.00 0.00 0.00 175.76 175.24 2yue s ARG 29 N -0.44 0.50 0.46 0.00 1.70 -0.30 -0.10 118.95 120.78 2yue s ARG 29 Ca 0.05 -0.95 -0.21 0.00 -0.47 0.00 0.00 55.73 54.15 2yue s ARG 29 Cb -0.12 0.10 -0.09 0.00 -0.57 0.00 0.00 34.95 34.27 2yue s ARG 29 CO 0.01 -0.07 1.02 -0.98 -1.08 0.00 0.00 175.30 174.20 2yue s ARG 30 N -2.73 3.96 -0.67 3.89 1.70 -0.41 -0.87 118.95 123.82 2yue s ARG 30 Ca -0.03 1.32 0.04 0.00 -0.47 0.00 0.00 55.73 56.59 2yue s ARG 30 Cb -0.01 -2.18 0.31 0.00 -0.57 0.00 0.00 34.95 32.50 2yue s ARG 30 CO -0.05 -0.29 0.99 0.34 -1.08 0.00 0.00 175.30 175.20 2yue n PHE 31 N -0.76 3.72 -3.80 5.89 7.35 -1.13 -4.68 117.46 124.06 2yue n PHE 31 Ca 0.08 -3.85 0.00 0.00 -0.76 0.00 0.00 57.45 52.92 2yue n PHE 31 Cb 0.52 -0.62 -0.00 0.00 0.35 0.00 0.00 39.48 39.74 2yue n PHE 31 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2yue n GLU 32 N 0.23 -0.02 -1.25 -4.13 -0.58 -1.26 -4.80 120.64 108.83 2yue n GLU 32 Ca 0.32 0.01 0.15 0.00 -0.42 0.00 0.00 57.16 57.22 2yue n GLU 32 Cb 0.38 -0.02 -0.07 0.00 -0.57 0.00 0.00 31.44 31.16 2yue n GLU 32 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2yue n SER 33 N -3.24 -7.08 -3.28 1.62 2.88 -1.26 -4.80 113.62 98.47 2yue n SER 33 Ca 0.00 1.12 -0.25 0.00 -1.33 0.00 0.00 58.87 58.41 2yue n SER 33 Cb 0.00 -4.20 -0.07 0.00 -0.75 0.00 0.00 64.21 59.19 2yue n SER 33 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2yue n PHE 34 N -4.05 2.02 -3.63 0.66 3.72 -1.26 -5.06 117.46 109.87 2yue n PHE 34 Ca -0.06 -3.91 -0.03 0.00 -0.05 0.00 0.00 57.45 53.40 2yue n PHE 34 Cb 0.59 -0.47 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.29 -2.85 -3.31 0.00 3.00 -1.25 -4.31 116.66 108.23 2yue n ARG 36 Ca 0.00 2.38 -0.19 0.00 -0.01 0.00 0.00 57.85 60.03 2yue n ARG 36 Cb 0.58 -4.35 -0.08 0.00 0.00 0.00 0.00 32.46 28.61 2yue n ARG 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2yue s ALA 37 N -1.42 -0.03 -0.00 7.54 0.00 -1.26 -3.33 121.76 123.27 2yue s ALA 37 Ca -0.02 -1.38 -0.03 0.00 0.00 0.00 0.00 51.96 50.53 2yue s ALA 37 Cb 0.00 -1.97 -0.00 0.00 0.00 0.00 0.00 23.12 21.15 2yue s ALA 37 CO 0.61 -2.12 0.05 0.42 0.00 0.00 0.00 175.76 174.72 2yue s ILE 38 N 0.98 0.06 0.02 0.00 1.01 -1.26 -3.09 121.20 118.91 2yue s ILE 38 Ca 0.23 -0.49 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 2yue s ILE 38 Cb -0.10 -0.24 -0.01 0.00 0.01 0.00 0.00 42.46 42.12 2yue s ILE 38 CO -0.06 -0.27 0.10 0.42 0.00 0.00 0.00 174.94 175.13 2yue s THR 39 N -0.85 0.10 0.38 2.92 -4.23 0.88 -0.98 115.64 113.87 2yue s THR 39 Ca -0.09 -0.86 0.02 0.00 -1.18 0.00 0.00 61.69 59.57 2yue s THR 39 Cb -0.06 -0.56 -0.01 0.00 1.34 0.00 0.00 72.50 73.21 2yue s THR 39 CO 0.00 -0.47 0.06 0.49 -0.54 0.00 0.00 174.62 174.16 2yue n PHE 40 N 1.24 0.53 -3.26 3.99 3.01 -1.26 -0.31 117.46 121.40 2yue n PHE 40 Ca -0.22 -2.11 -0.38 0.00 1.01 0.00 0.00 57.45 55.76 2yue n PHE 40 Cb 0.56 -0.14 -0.06 0.00 -0.01 0.00 0.00 39.48 39.84 2yue n PHE 40 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2yue s SER 41 N -3.18 7.04 0.39 4.37 0.15 -0.89 -3.15 113.70 118.45 2yue s SER 41 Ca 0.09 1.27 0.11 0.00 0.70 0.00 0.00 55.95 58.12 2yue s SER 41 Cb 0.00 -2.36 0.80 0.00 -1.71 0.00 0.00 66.02 62.76 2yue s SER 41 CO 0.06 0.22 1.90 0.00 1.20 0.00 0.00 173.24 176.62 2yue h ALA 42 N 4.25 1.50 -2.65 5.45 0.00 -1.34 -3.39 119.26 123.08 2yue h ALA 42 Ca -0.49 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.04 2yue h ALA 42 Cb 1.21 -0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.75 2yue h ALA 42 CO 0.64 0.36 -0.61 1.03 0.00 0.00 0.00 179.25 180.68 2yue s ARG 43 N -4.52 0.50 -0.05 0.00 0.52 -1.26 -4.83 118.95 109.31 2yue s ARG 43 Ca -0.04 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.09 2yue s ARG 43 Cb 0.15 0.19 -0.05 0.00 0.52 0.00 0.00 34.95 35.76 2yue s ARG 43 CO 0.72 -0.11 1.49 -1.25 0.02 0.00 0.00 175.30 176.17 2yue s PRO 44 N -2.45 4.23 0.30 3.54 0.04 -1.26 -4.79 135.00 134.60 2yue s PRO 44 Ca -0.06 2.01 -0.07 0.00 0.04 0.00 0.00 61.00 62.92 2yue s PRO 44 Cb -0.02 -3.78 -0.06 0.00 0.04 0.00 0.00 34.50 30.68 2yue s PRO 44 CO -0.04 -0.72 0.58 0.14 0.04 0.00 0.00 177.00 177.00 2yue s VAL 45 N 3.32 4.97 0.75 -0.36 -7.23 -0.92 -4.94 120.40 116.00 2yue s VAL 45 Ca 0.66 0.21 -0.07 0.00 -1.81 0.00 0.00 61.98 60.97 2yue s VAL 45 Cb -0.31 -3.71 0.10 0.00 0.56 0.00 0.00 36.38 33.02 2yue s VAL 45 CO 0.25 -0.31 1.07 -0.13 -0.31 0.00 0.00 175.10 175.68 2yue s ARG 46 N -3.46 1.83 0.02 4.82 0.52 -1.26 -4.23 118.95 117.18 2yue s ARG 46 Ca 0.46 -0.42 -0.11 0.00 -0.52 0.00 0.00 55.73 55.13 2yue s ARG 46 Cb -0.11 -2.14 -0.06 0.00 0.52 0.00 0.00 34.95 33.17 2yue s ARG 46 CO 0.29 -1.49 1.17 0.82 0.02 0.00 0.00 175.30 176.11 2yue h ILE 47 N -0.78 0.00 0.00 1.52 1.08 -1.94 -2.85 117.51 114.54 2yue h ILE 47 Ca -0.43 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2yue h ILE 47 Cb 1.29 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.04 2yue h ILE 47 CO 0.53 0.00 -0.02 0.78 -0.69 0.00 0.00 178.15 178.75 2yue h ASN 48 N -0.39 0.00 -1.29 1.72 -0.26 -1.89 -3.03 115.58 110.43 2yue h ASN 48 Ca -0.04 0.00 -0.66 0.00 -0.56 0.00 0.00 56.30 55.04 2yue h ASN 48 Cb 0.31 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 2yue h ASN 48 CO 0.05 0.02 1.38 1.21 -1.06 0.00 0.00 177.43 179.03 2yue n GLU 49 N -3.19 1.27 -2.91 0.81 2.13 -1.08 -4.81 120.64 112.86 2yue n GLU 49 Ca -0.01 0.37 -0.40 0.00 0.66 0.00 0.00 57.16 57.77 2yue n GLU 49 Cb 0.20 -2.55 -0.05 0.00 0.27 0.00 0.00 31.44 29.30 2yue n GLU 49 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2yue s ARG 50 N 5.93 4.61 -0.17 5.31 6.06 -1.26 -4.65 118.95 134.77 2yue s ARG 50 Ca 1.07 1.22 0.00 0.00 -2.50 0.00 0.00 55.73 55.53 2yue s ARG 50 Cb -0.79 -3.31 0.01 0.00 0.06 0.00 0.00 34.95 30.91 2yue s ARG 50 CO 0.48 0.42 -0.17 0.42 -2.50 0.00 0.00 175.30 173.95 2yue s ILE 51 N -0.63 2.35 -0.07 4.11 1.01 -1.01 -4.56 121.20 122.40 2yue s ILE 51 Ca 0.39 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 60.18 2yue s ILE 51 Cb -0.23 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 2yue s ILE 51 CO 0.27 0.52 -0.04 0.00 0.00 0.00 0.00 174.94 175.69 2yue s VAL 53 N -0.85 -0.16 0.08 0.00 1.01 0.86 -1.37 120.40 119.98 2yue s VAL 53 Ca 0.13 0.08 -0.26 0.00 0.00 0.00 0.00 61.98 61.94 2yue s VAL 53 Cb -0.11 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.77 2yue s VAL 53 CO 0.02 -0.08 0.79 -0.75 0.00 0.00 0.00 175.10 175.08 2yue s LYS 54 N 2.20 4.54 -1.07 2.72 2.20 0.78 -0.08 119.74 131.04 2yue s LYS 54 Ca 0.04 1.13 -0.22 0.00 -0.36 0.00 0.00 55.97 56.56 2yue s LYS 54 Cb -0.14 -3.34 0.04 0.00 -1.51 0.00 0.00 37.83 32.88 2yue s LYS 54 CO -0.07 0.35 1.57 -0.06 -0.36 0.00 0.00 175.35 176.78 2yue s PHE 55 N -0.34 2.49 0.05 4.03 0.08 -0.40 -1.36 117.98 122.53 2yue s PHE 55 Ca 0.39 -0.81 -0.28 0.00 0.12 0.00 0.00 56.93 56.34 2yue s PHE 55 Cb -0.22 -4.63 -0.15 0.00 -0.57 0.00 0.00 43.02 37.46 2yue s PHE 55 CO 0.25 -1.87 1.43 0.00 -0.10 0.00 0.00 175.22 174.92 2yue h ALA 56 N 9.52 -1.22 -3.80 5.36 0.00 -1.84 -3.06 119.26 124.22 2yue h ALA 56 Ca 0.24 -0.21 -0.68 0.00 0.00 0.00 0.00 54.91 54.26 2yue h ALA 56 Cb 0.98 0.47 -0.20 0.00 0.00 0.00 0.00 17.79 19.04 2yue h ALA 56 CO 1.41 -1.17 -0.82 -1.21 0.00 0.00 0.00 179.25 177.46 2yue s GLU 57 N -5.24 1.70 -0.00 0.00 0.41 -0.81 -4.71 118.70 110.05 2yue s GLU 57 Ca -0.15 -1.21 -0.01 0.00 -0.41 0.00 0.00 54.97 53.19 2yue s GLU 57 Cb 0.02 -2.06 -0.00 0.00 -1.78 0.00 0.00 34.13 30.31 2yue s GLU 57 CO 0.46 0.48 0.02 0.42 -0.49 0.00 0.00 175.26 176.15 2yue s ILE 58 N -1.10 0.04 -0.21 -1.63 -1.09 -1.26 -1.87 121.20 114.08 2yue s ILE 58 Ca 0.17 -0.35 -0.07 0.00 -2.23 0.00 0.00 60.65 58.17 2yue s ILE 58 Cb -0.10 -0.16 -0.03 0.00 -1.58 0.00 0.00 42.46 40.59 2yue s ILE 58 CO 0.09 -0.19 0.05 -0.94 -1.23 0.00 0.00 174.94 172.71 2yue s SER 59 N -0.58 5.28 -0.88 3.58 1.04 -1.26 -4.72 113.70 116.16 2yue s SER 59 Ca -0.06 -0.08 0.01 0.00 0.48 0.00 0.00 55.95 56.29 2yue s SER 59 Cb -0.04 -1.92 0.30 0.00 0.10 0.00 0.00 66.02 64.46 2yue s SER 59 CO -0.00 0.08 1.27 0.59 0.98 0.00 0.00 173.24 176.15 2yue n ASN 60 N 4.18 5.60 0.00 7.02 4.13 -1.26 -4.53 115.26 130.40 2yue n ASN 60 Ca -0.16 -3.51 0.00 0.00 1.68 0.00 0.00 54.58 52.59 2yue n ASN 60 Cb 0.52 -0.99 0.00 0.00 -1.54 0.00 0.00 39.78 37.77 2yue n ASN 60 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2yue n ASN 61 N 0.74 0.00 -4.75 6.41 4.13 -1.26 -5.13 115.26 115.39 2yue n ASN 61 Ca 0.31 0.00 -0.31 0.00 1.68 0.00 0.00 54.58 56.26 2yue n ASN 61 Cb 0.35 0.36 0.10 0.00 -1.54 0.00 0.00 39.78 39.05 2yue n ASN 61 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2yue s TRP 62 N -1.87 2.44 0.22 3.10 0.23 -1.26 -5.05 118.94 116.75 2yue s TRP 62 Ca 0.00 1.59 0.06 0.00 -2.03 0.00 0.00 56.10 55.72 2yue s TRP 62 Cb 0.00 -3.10 -0.04 0.00 0.03 0.00 0.00 33.47 30.37 2yue s TRP 62 CO 0.00 -1.94 0.22 1.21 0.96 0.00 0.00 176.95 177.40 2yue s ASN 63 N -3.26 5.72 0.00 2.95 3.84 -1.26 -4.82 114.94 118.12 2yue s ASN 63 Ca 0.62 -0.14 0.00 0.00 0.21 0.00 0.00 52.86 53.55 2yue s ASN 63 Cb -0.18 -1.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.99 2yue s ASN 63 CO 0.56 -0.01 0.00 0.61 -2.79 0.00 0.00 177.10 175.46 2yue n GLY 64 N -0.99 -0.66 0.00 1.21 0.00 -1.26 -4.77 105.19 98.72 2yue n GLY 64 Ca -0.08 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.57 1.69 3.97 -0.02 0.00 -1.26 -3.73 105.19 105.27 2yue n GLY 65 Ca 0.00 -2.07 -0.24 0.00 0.00 0.00 0.00 46.02 43.71 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 1.08 2.26 -0.04 -0.61 -4.36 -1.25 -4.30 121.20 113.98 2yue s ILE 66 Ca 0.00 -0.52 0.02 0.00 -0.26 0.00 0.00 60.65 59.89 2yue s ILE 66 Cb 0.00 -2.74 0.01 0.00 1.25 0.00 0.00 42.46 40.98 2yue s ILE 66 CO 0.00 0.00 -0.08 -0.13 0.24 0.00 0.00 174.94 174.97 2yue s ARG 67 N -5.13 1.08 0.19 0.37 3.00 -1.25 -2.58 118.95 114.63 2yue s ARG 67 Ca 0.64 -0.27 -0.22 0.00 0.00 0.00 0.00 55.73 55.88 2yue s ARG 67 Cb -0.07 -0.98 0.06 0.00 0.00 0.00 0.00 34.95 33.95 2yue s ARG 67 CO 0.44 0.04 0.62 -0.59 0.00 0.00 0.00 175.30 175.81 2yue s PHE 68 N 0.50 -0.45 -1.63 -0.53 -0.71 -1.02 -0.75 117.98 113.39 2yue s PHE 68 Ca -0.08 0.19 0.00 0.00 -1.04 0.00 0.00 56.93 55.99 2yue s PHE 68 Cb -0.12 0.59 0.00 0.00 -1.21 0.00 0.00 43.02 42.28 2yue s PHE 68 CO 0.01 -0.93 0.00 0.41 -1.34 0.00 0.00 175.22 173.37 2yue n GLY 69 N -0.40 -0.62 3.69 1.99 0.00 -0.23 -1.20 105.19 108.43 2yue n GLY 69 Ca -0.14 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.47 2.34 -0.05 1.61 0.08 -0.21 -0.48 117.98 117.80 2yue s PHE 70 Ca 0.00 -0.73 -0.31 0.00 0.12 0.00 0.00 56.93 56.01 2yue s PHE 70 Cb 0.00 -1.78 0.07 0.00 -0.57 0.00 0.00 43.02 40.75 2yue s PHE 70 CO 0.00 0.31 0.70 -0.08 -0.10 0.00 0.00 175.22 176.05 2yue s THR 71 N -2.73 0.00 -0.06 0.64 -1.32 0.82 -0.08 115.64 112.91 2yue s THR 71 Ca 0.29 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.70 2yue s THR 71 Cb 0.06 -1.00 -0.29 0.00 -1.51 0.00 0.00 72.50 69.77 2yue s THR 71 CO 0.15 0.00 0.61 0.77 -2.21 0.00 0.00 174.62 173.95 2yue h SER 72 N 2.91 0.50 -4.08 8.08 4.64 -0.89 -0.40 113.55 124.31 2yue h SER 72 Ca -0.27 -0.83 -0.54 0.00 -0.47 0.00 0.00 61.79 59.68 2yue h SER 72 Cb 1.15 -0.16 0.13 0.00 -0.31 0.00 0.00 62.40 63.21 2yue h SER 72 CO 0.38 1.72 0.54 0.20 -0.87 0.00 0.00 176.83 178.80 2yue s ASN 73 N -7.12 5.09 0.40 4.97 0.01 -1.24 -4.79 114.94 112.27 2yue s ASN 73 Ca -0.16 2.61 -0.23 0.00 -0.71 0.00 0.00 52.86 54.37 2yue s ASN 73 Cb 0.06 -2.62 -0.10 0.00 0.41 0.00 0.00 41.25 39.00 2yue s ASN 73 CO 0.83 -1.68 0.96 -1.81 -1.51 0.00 0.00 177.10 173.89 2yue s ASP 74 N -1.27 7.03 0.54 -1.22 1.11 -1.26 -4.75 116.67 116.84 2yue s ASP 74 Ca 0.76 1.77 0.32 0.00 0.18 0.00 0.00 52.55 55.58 2yue s ASP 74 Cb -0.36 -2.56 1.35 0.00 1.07 0.00 0.00 42.92 42.42 2yue s ASP 74 CO 0.41 -0.30 1.98 1.55 1.18 0.00 0.00 175.17 179.99 2yue h PRO 75 N 2.32 0.00 0.00 8.23 0.13 -1.94 -2.67 132.00 138.08 2yue h PRO 75 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2yue h PRO 75 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2yue h PRO 75 CO 0.62 0.04 -0.22 -0.39 -0.23 0.00 0.00 178.00 177.82 2yue h VAL 76 N 0.00 0.41 -0.11 1.56 -1.51 -1.94 -3.02 116.25 111.65 2yue h VAL 76 Ca -0.00 -1.44 0.00 0.00 -1.23 0.00 0.00 66.70 64.03 2yue h VAL 76 Cb 0.52 2.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.76 2yue h VAL 76 CO 0.01 0.22 0.00 0.35 -1.23 0.00 0.00 177.57 176.91 2yue n THR 77 N -3.19 0.14 -0.05 7.19 -2.24 -1.01 -3.33 114.28 111.79 2yue n THR 77 Ca 0.02 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2yue n THR 77 Cb 0.57 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 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 -0.14 0.49 -4.66 3.22 4.77 -1.15 -4.94 117.00 114.61 2yue n LEU 78 Ca 0.14 -0.70 -0.49 0.00 -0.03 0.00 0.00 56.01 54.93 2yue n LEU 78 Cb 0.21 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 2yue n LEU 78 CO 0.11 0.12 1.19 1.21 -1.33 0.00 0.00 177.39 178.69 2yue n GLU 79 N -0.41 1.78 -1.56 3.23 2.13 -1.19 -0.09 120.64 124.52 2yue n GLU 79 Ca 0.00 0.64 -0.19 0.00 0.66 0.00 0.00 57.16 58.27 2yue n GLU 79 Cb 0.01 -2.39 -0.08 0.00 0.27 0.00 0.00 31.44 29.25 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 3.46 1.84 2.50 8.31 0.00 -1.26 -4.83 105.19 115.22 2yue n GLY 80 Ca 0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 2yue n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2yue n THR 81 N -2.29 -0.12 -4.36 2.61 -2.24 0.87 -5.13 114.28 103.61 2yue n THR 81 Ca -0.19 -2.76 -0.29 0.00 -2.27 0.00 0.00 64.05 58.54 2yue n THR 81 Cb 0.64 0.59 -0.12 0.00 -2.10 0.00 0.00 70.33 69.34 2yue n THR 81 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2yue s LEU 82 N -2.02 2.49 0.00 3.22 1.43 -1.21 -4.70 118.68 117.88 2yue s LEU 82 Ca 0.30 -0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 52.68 2yue s LEU 82 Cb 0.29 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 45.20 2yue s LEU 82 CO -0.09 0.16 0.09 -0.81 0.23 0.00 0.00 176.35 175.93 2yue n PRO 83 N 0.71 -1.20 0.04 1.29 -0.04 -1.26 -4.98 135.00 129.57 2yue n PRO 83 Ca -0.16 -0.14 -0.05 0.00 -0.04 0.00 0.00 63.50 63.11 2yue n PRO 83 Cb 0.54 -0.13 -0.10 0.00 -0.04 0.00 0.00 33.50 33.76 2yue n PRO 83 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2yue h LYS 84 N 0.00 0.00 0.00 0.54 1.57 -2.00 -3.45 116.57 113.23 2yue h LYS 84 Ca -0.03 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.41 2yue h LYS 84 Cb 0.10 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.32 2yue h LYS 84 CO 0.02 0.66 -0.33 2.48 -0.57 0.00 0.00 179.45 181.71 2yue n TYR 85 N -3.17 -0.55 -0.41 -1.35 0.18 -1.26 -3.93 117.16 106.68 2yue n TYR 85 Ca -0.06 -1.97 0.11 0.00 1.88 0.00 0.00 57.90 57.86 2yue n TYR 85 Cb 0.93 0.20 0.32 0.00 -0.38 0.00 0.00 39.34 40.41 2yue n TYR 85 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2yue n ALA 86 N -1.40 2.49 0.00 -3.48 0.00 -1.26 -4.44 120.51 112.42 2yue n ALA 86 Ca -0.08 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.00 2yue n ALA 86 Cb 0.42 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.96 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 -0.02 0.10 0.00 0.00 -0.04 -1.26 -4.82 135.00 128.97 2yue n PRO 88 Ca 0.00 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2yue n PRO 88 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -3.42 3.54 8.00 -1.26 -1.26 116.55 120.76 2yue n ASP 89 Ca 0.05 0.73 -0.36 0.00 0.71 0.00 0.00 54.79 55.92 2yue n ASP 89 Cb 0.14 -0.23 -0.02 0.00 -0.02 0.00 0.00 41.12 40.99 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 -1.71 6.80 0.00 0.64 4.77 -1.18 -3.21 117.00 123.11 2yue n LEU 90 Ca 0.00 -3.77 0.00 0.00 -0.03 0.00 0.00 56.01 52.21 2yue n LEU 90 Cb 0.00 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 39.67 2yue n LEU 90 CO 0.00 1.18 0.00 0.35 -1.33 0.00 0.00 177.39 177.59 2yue n THR 91 N 4.40 0.00 -0.07 -5.08 -2.24 -1.03 -4.43 114.28 105.84 2yue n THR 91 Ca 0.60 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 62.28 2yue n THR 91 Cb 0.27 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.52 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 0.85 -4.18 3.42 4.21 -1.14 -3.44 115.58 115.29 2yue h ASN 92 Ca 0.00 -0.39 -0.53 0.00 1.21 0.00 0.00 56.30 56.60 2yue h ASN 92 Cb 0.00 -0.24 0.14 0.00 -1.12 0.00 0.00 38.32 37.10 2yue h ASN 92 CO 0.00 1.14 0.39 -0.13 -1.29 0.00 0.00 177.43 177.54 2yue s ARG 93 N -4.32 2.34 0.05 0.81 0.52 -1.25 -4.95 118.95 112.16 2yue s ARG 93 Ca -0.10 1.65 -0.31 0.00 -0.52 0.00 0.00 55.73 56.46 2yue s ARG 93 Cb 0.12 -1.87 -0.07 0.00 0.52 0.00 0.00 34.95 33.65 2yue s ARG 93 CO 0.86 -1.66 1.41 -1.25 0.02 0.00 0.00 175.30 174.68 2yue s PRO 94 N -3.95 4.30 0.00 3.54 0.04 -1.26 -3.70 135.00 133.96 2yue s PRO 94 Ca 0.72 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2yue s PRO 94 Cb -0.27 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.83 2yue s PRO 94 CO 0.44 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.36 2yue n GLY 95 N 3.60 0.67 3.42 0.56 0.00 -1.26 -4.85 105.19 107.32 2yue n GLY 95 Ca 0.13 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.24 -0.86 -0.03 1.61 0.08 -1.24 -0.20 117.98 115.10 2yue s PHE 96 Ca 0.00 1.69 0.01 0.00 0.12 0.00 0.00 56.93 58.76 2yue s PHE 96 Cb 0.00 0.44 0.01 0.00 -0.57 0.00 0.00 43.02 42.90 2yue s PHE 96 CO 0.00 -0.46 -0.05 -1.58 -0.10 0.00 0.00 175.22 173.03 2yue s TRP 97 N 1.90 0.62 -0.13 0.36 0.51 0.88 -4.58 118.94 118.50 2yue s TRP 97 Ca -0.08 -0.14 -0.18 0.00 -2.12 0.00 0.00 56.10 53.59 2yue s TRP 97 Cb -0.09 -0.50 0.04 0.00 -0.81 0.00 0.00 33.47 32.11 2yue s TRP 97 CO -0.15 -0.10 0.46 0.00 -0.51 0.00 0.00 176.95 176.65 2yue s ALA 98 N 0.46 -1.16 0.37 0.98 0.00 -1.26 -1.04 121.76 120.10 2yue s ALA 98 Ca -0.06 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.08 2yue s ALA 98 Cb -0.09 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 2yue s ALA 98 CO -0.00 -0.25 0.24 0.21 0.00 0.00 0.00 175.76 175.96 2yue s LYS 99 N -0.29 1.87 -0.08 0.00 2.47 -0.34 -4.97 119.74 118.40 2yue s LYS 99 Ca -0.04 -2.11 0.04 0.00 -1.56 0.00 0.00 55.97 52.29 2yue s LYS 99 Cb -0.03 0.04 -0.01 0.00 -1.46 0.00 0.00 37.83 36.36 2yue s LYS 99 CO 0.03 -0.63 -0.20 0.00 0.16 0.00 0.00 175.35 174.71 2yue s ALA 100 N -3.32 2.37 -0.03 3.13 0.00 -1.26 -2.44 121.76 120.21 2yue s ALA 100 Ca 0.35 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 51.23 2yue s ALA 100 Cb 0.02 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.20 2yue s ALA 100 CO 0.24 0.37 0.28 -1.17 0.00 0.00 0.00 175.76 175.49 2yue s LEU 101 N -0.03 4.41 1.00 0.00 0.20 -1.06 -5.00 118.68 118.19 2yue s LEU 101 Ca -0.06 0.68 -0.14 0.00 0.69 0.00 0.00 54.13 55.29 2yue s LEU 101 Cb -0.15 -2.47 0.05 0.00 -0.43 0.00 0.00 46.19 43.20 2yue s LEU 101 CO 0.05 0.32 0.27 1.57 -0.29 0.00 0.00 176.35 178.26 2yue n HIS 102 N 1.61 -1.54 0.07 5.38 -0.00 -1.26 -3.90 115.22 115.58 2yue n HIS 102 Ca -0.15 0.20 -0.10 0.00 -0.00 0.00 0.00 57.72 57.67 2yue n HIS 102 Cb 0.53 -1.72 -0.13 0.00 -0.00 0.00 0.00 29.99 28.68 2yue n HIS 102 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2yue h GLU 103 N -1.69 0.10 -0.24 1.57 4.11 -1.98 -3.25 114.58 113.20 2yue h GLU 103 Ca -0.46 -0.17 0.07 0.00 0.07 0.00 0.00 59.36 58.87 2yue h GLU 103 Cb 1.30 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2yue h GLU 103 CO 0.35 1.04 0.25 -0.56 0.07 0.00 0.00 179.01 180.17 2yue h GLN 104 N 0.03 0.00 -0.74 1.06 3.07 -2.01 0.16 115.11 116.67 2yue h GLN 104 Ca -0.08 0.00 -0.36 0.00 0.09 0.00 0.00 58.65 58.30 2yue h GLN 104 Cb 1.86 0.00 -0.21 0.00 0.08 0.00 0.00 27.48 29.21 2yue h GLN 104 CO 0.15 0.00 0.36 0.66 0.09 0.00 0.00 178.83 180.09 2yue n TYR 105 N -3.86 2.31 -1.64 0.06 4.01 -1.23 -4.40 117.16 112.42 2yue n TYR 105 Ca 0.03 -1.65 0.01 0.00 -0.16 0.00 0.00 57.90 56.12 2yue n TYR 105 Cb 0.39 -0.75 0.18 0.00 -0.31 0.00 0.00 39.34 38.85 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 -3.29 1.35 0.41 0.00 2.02 -1.26 -4.83 118.70 113.09 2yue s GLU 107 Ca 0.41 -1.07 -0.00 0.00 0.02 0.00 0.00 54.97 54.32 2yue s GLU 107 Cb 0.38 -2.23 -0.02 0.00 0.10 0.00 0.00 34.13 32.36 2yue s GLU 107 CO -0.05 -1.73 0.63 0.21 0.02 0.00 0.00 175.26 174.34 2yue s LYS 108 N -5.32 3.28 -1.46 1.61 2.36 -1.26 -4.34 119.74 114.62 2yue s LYS 108 Ca 0.69 -0.37 -0.08 0.00 -2.55 0.00 0.00 55.97 53.66 2yue s LYS 108 Cb -0.04 -2.59 0.03 0.00 -1.05 0.00 0.00 37.83 34.18 2yue s LYS 108 CO 0.47 -0.08 0.90 -3.47 1.55 0.00 0.00 175.35 174.71 2yue n ASP 109 N -1.97 -5.87 -4.09 1.43 -0.08 -1.16 -4.99 116.55 99.83 2yue n ASP 109 Ca -0.01 -0.47 -0.25 0.00 -1.51 0.00 0.00 54.79 52.55 2yue n ASP 109 Cb 0.57 -4.68 -0.16 0.00 2.34 0.00 0.00 41.12 39.18 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 -3.05 1.90 -0.36 1.67 0.01 -1.26 -4.98 114.94 108.87 2yue s ASN 110 Ca 0.48 -0.31 -0.20 0.00 -0.71 0.00 0.00 52.86 52.12 2yue s ASN 110 Cb -0.22 -0.60 0.00 0.00 0.41 0.00 0.00 41.25 40.84 2yue s ASN 110 CO 0.60 0.11 0.62 -0.63 -1.51 0.00 0.00 177.10 176.29 2yue s ILE 111 N 0.21 4.90 -0.47 0.60 1.01 -1.26 -1.28 121.20 124.91 2yue s ILE 111 Ca -0.06 0.51 -0.16 0.00 0.00 0.00 0.00 60.65 60.93 2yue s ILE 111 Cb -0.12 -4.07 0.06 0.00 0.01 0.00 0.00 42.46 38.34 2yue s ILE 111 CO 0.02 -0.33 0.45 -0.22 0.00 0.00 0.00 174.94 174.86 2yue s LEU 112 N 2.67 5.33 -0.08 2.97 2.96 0.88 -3.36 118.68 130.07 2yue s LEU 112 Ca 0.23 -1.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.03 2yue s LEU 112 Cb -0.15 -2.27 -0.03 0.00 0.50 0.00 0.00 46.19 44.25 2yue s LEU 112 CO 0.15 -0.68 -0.07 -0.72 -1.32 0.00 0.00 176.35 173.72 2yue s TYR 113 N 1.94 2.95 -0.14 5.38 -0.85 -0.85 -0.10 117.35 125.69 2yue s TYR 113 Ca 0.08 -0.01 -0.15 0.00 -0.52 0.00 0.00 57.07 56.47 2yue s TYR 113 Cb -0.22 -1.73 0.04 0.00 0.38 0.00 0.00 41.96 40.43 2yue s TYR 113 CO 0.09 0.30 0.41 1.52 -1.52 0.00 0.00 175.55 176.35 2yue s TYR 114 N -0.71 -0.43 0.11 -3.49 1.13 -0.36 -0.54 117.35 113.05 2yue s TYR 114 Ca 0.11 1.01 0.00 0.00 -1.41 0.00 0.00 57.07 56.78 2yue s TYR 114 Cb -0.11 0.16 -0.00 0.00 -1.10 0.00 0.00 41.96 40.90 2yue s TYR 114 CO 0.02 -0.25 0.13 2.48 -2.51 0.00 0.00 175.55 175.41 2yue n TYR 115 N 2.61 -0.57 -3.89 -3.49 4.11 -0.28 -2.39 117.16 113.27 2yue n TYR 115 Ca -0.14 -0.77 -0.11 0.00 -0.00 0.00 0.00 57.90 56.88 2yue n TYR 115 Cb 0.57 0.14 -0.13 0.00 -0.00 0.00 0.00 39.34 39.92 2yue n TYR 115 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2yue s VAL 116 N -2.50 0.02 0.41 -3.48 0.11 -1.14 -0.37 120.40 113.45 2yue s VAL 116 Ca 0.10 -0.18 -0.00 0.00 -2.93 0.00 0.00 61.98 58.97 2yue s VAL 116 Cb 0.00 -0.07 0.08 0.00 -1.53 0.00 0.00 36.38 34.86 2yue s VAL 116 CO 0.07 -0.10 0.56 -0.46 -3.33 0.00 0.00 175.10 171.84 2yue n ASN 117 N 2.78 0.75 0.00 3.54 0.23 -0.47 -3.33 115.26 118.76 2yue n ASN 117 Ca -0.14 -1.64 0.09 0.00 -0.53 0.00 0.00 54.58 52.36 2yue n ASN 117 Cb 0.59 -0.36 0.41 0.00 -2.08 0.00 0.00 39.78 38.34 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 0.71 -1.12 1.85 4.83 0.00 -1.26 -2.80 105.19 107.39 2yue n GLY 118 Ca 0.09 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.48 4.55 -2.23 4.61 0.00 -1.26 -4.86 120.51 119.84 2yue n ALA 119 Ca 0.05 -2.04 -0.13 0.00 0.00 0.00 0.00 53.44 51.33 2yue n ALA 119 Cb 0.21 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 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 -0.44 -0.17 3.40 0.00 0.00 -1.12 -4.86 105.19 102.00 2yue n GLY 120 Ca 0.40 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.04 4.94 -0.29 1.61 1.11 -1.26 -2.66 116.67 118.08 2yue s ASP 121 Ca 0.00 -0.34 -0.17 0.00 0.18 0.00 0.00 52.55 52.22 2yue s ASP 121 Cb 0.00 -1.87 -0.02 0.00 1.07 0.00 0.00 42.92 42.09 2yue s ASP 121 CO 0.00 -0.06 0.47 -0.69 1.18 0.00 0.00 175.17 176.07 2yue s VAL 122 N 1.57 5.08 -0.08 -1.27 1.01 0.77 -1.36 120.40 126.12 2yue s VAL 122 Ca 0.06 0.60 0.02 0.00 0.00 0.00 0.00 61.98 62.67 2yue s VAL 122 Cb -0.15 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2yue s VAL 122 CO 0.02 0.01 -0.15 -0.63 0.00 0.00 0.00 175.10 174.34 2yue s ILE 123 N 2.26 2.94 0.43 2.22 1.09 0.50 -1.49 121.20 129.16 2yue s ILE 123 Ca 0.18 -0.74 0.07 0.00 -1.10 0.00 0.00 60.65 59.06 2yue s ILE 123 Cb -0.16 -2.18 -0.05 0.00 -1.06 0.00 0.00 42.46 39.01 2yue s ILE 123 CO 0.11 0.56 0.11 -0.72 -0.10 0.00 0.00 174.94 174.90 2yue s TYR 124 N -0.25 2.46 -0.12 3.97 1.13 -1.23 -1.12 117.35 122.19 2yue s TYR 124 Ca 0.01 -0.66 -0.32 0.00 -1.41 0.00 0.00 57.07 54.69 2yue s TYR 124 Cb -0.13 -1.86 0.13 0.00 -1.10 0.00 0.00 41.96 38.99 2yue s TYR 124 CO 0.03 0.25 1.08 0.20 -2.51 0.00 0.00 175.55 174.60 2yue s GLY 125 N -3.85 -0.33 -0.07 5.49 0.00 0.30 -0.11 107.32 108.74 2yue s GLY 125 Ca 0.35 1.50 0.03 0.00 0.00 0.00 0.00 44.72 46.60 2yue s GLY 125 CO 0.19 0.55 -0.16 -0.42 0.00 0.00 0.00 173.10 173.26 2yue s ILE 126 N -2.45 1.42 -1.28 0.90 -1.09 -0.92 -2.00 121.20 115.78 2yue s ILE 126 Ca 0.06 -0.66 -0.02 0.00 -2.23 0.00 0.00 60.65 57.80 2yue s ILE 126 Cb -0.01 -1.26 0.01 0.00 -1.58 0.00 0.00 42.46 39.62 2yue s ILE 126 CO -0.06 0.42 0.93 0.59 -1.23 0.00 0.00 174.94 175.59 2yue n ASN 127 N 3.63 -2.57 -3.32 3.58 3.02 -1.21 -2.79 115.26 115.60 2yue n ASN 127 Ca -0.21 -0.69 -0.16 0.00 -0.03 0.00 0.00 54.58 53.49 2yue n ASN 127 Cb 0.52 -4.68 0.08 0.00 -0.61 0.00 0.00 39.78 35.10 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 -3.07 -3.85 -3.31 6.41 3.02 -1.26 -5.01 115.26 108.20 2yue n ASN 128 Ca -0.23 -0.64 -0.10 0.00 -0.03 0.00 0.00 54.58 53.58 2yue n ASN 128 Cb 0.65 -5.08 -0.06 0.00 -0.61 0.00 0.00 39.78 34.68 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 -4.95 0.61 0.81 3.52 2.02 -1.12 -5.15 118.70 114.44 2yue s GLU 129 Ca 0.18 -0.41 -0.13 0.00 0.02 0.00 0.00 54.97 54.63 2yue s GLU 129 Cb -0.02 -0.40 0.08 0.00 0.10 0.00 0.00 34.13 33.89 2yue s GLU 129 CO 0.72 -1.14 1.20 -1.83 0.02 0.00 0.00 175.26 174.23 2yue s GLU 130 N 1.88 1.65 -0.02 1.61 1.03 -1.26 -2.16 118.70 121.43 2yue s GLU 130 Ca 0.14 1.75 0.03 0.00 0.03 0.00 0.00 54.97 56.93 2yue s GLU 130 Cb -0.12 -1.78 -0.05 0.00 -0.80 0.00 0.00 34.13 31.39 2yue s GLU 130 CO -0.13 -2.21 0.04 1.63 -1.33 0.00 0.00 175.26 173.26 2yue n LYS 131 N -3.30 2.19 0.00 -4.83 4.76 0.85 -4.89 118.16 112.94 2yue n LYS 131 Ca 0.13 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2yue n LYS 131 Cb 0.51 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.61 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 2.61 0.93 3.57 0.72 0.00 -1.26 -4.96 105.19 106.80 2yue n GLY 132 Ca -0.04 -2.15 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 2yue n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yue s VAL 133 N -1.00 3.60 0.18 1.61 1.01 -1.26 -3.49 120.40 121.05 2yue s VAL 133 Ca 0.00 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 2yue s VAL 133 Cb 0.00 -4.39 -0.09 0.00 0.00 0.00 0.00 36.38 31.90 2yue s VAL 133 CO 0.00 -1.20 1.46 -0.29 0.00 0.00 0.00 175.10 175.07 2yue h ILE 134 N 6.82 1.36 -4.10 2.22 2.10 -1.63 -3.45 117.51 120.83 2yue h ILE 134 Ca 0.17 -2.04 -0.52 0.00 1.08 0.00 0.00 64.86 63.55 2yue h ILE 134 Cb 0.98 2.02 -0.25 0.00 -1.09 0.00 0.00 36.82 38.48 2yue h ILE 134 CO 1.27 0.62 -0.82 -0.22 -1.08 0.00 0.00 178.15 177.92 2yue s LEU 135 N -8.05 2.18 0.30 2.19 2.96 -1.14 -4.98 118.68 112.14 2yue s LEU 135 Ca -0.06 -0.50 0.05 0.00 -0.22 0.00 0.00 54.13 53.40 2yue s LEU 135 Cb 0.11 -0.81 -0.03 0.00 0.50 0.00 0.00 46.19 45.96 2yue s LEU 135 CO 0.84 0.10 0.24 0.42 -1.32 0.00 0.00 176.35 176.63 2yue s THR 136 N -0.84 0.00 0.00 3.68 -4.23 -1.26 -0.16 115.64 112.82 2yue s THR 136 Ca 0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2yue s THR 136 Cb -0.08 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2yue s THR 136 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 2yue n GLY 137 N -0.53 0.69 3.48 3.99 0.00 -1.09 -4.99 105.19 106.75 2yue n GLY 137 Ca 0.06 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 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 4.61 0.30 -0.61 1.09 -1.14 -5.03 121.20 118.42 2yue s ILE 138 Ca 0.00 -0.14 -0.29 0.00 -1.10 0.00 0.00 60.65 59.12 2yue s ILE 138 Cb 0.00 -4.44 -0.10 0.00 -1.06 0.00 0.00 42.46 36.86 2yue s ILE 138 CO 0.00 -1.00 1.30 -0.62 -0.10 0.00 0.00 174.94 174.51 2yue s ASP 139 N 2.86 6.83 -0.59 3.58 -1.08 -1.26 -3.81 116.67 123.20 2yue s ASP 139 Ca 0.23 2.60 0.01 0.00 -0.52 0.00 0.00 52.55 54.87 2yue s ASP 139 Cb -0.16 -2.64 0.43 0.00 -1.46 0.00 0.00 42.92 39.09 2yue s ASP 139 CO 0.15 -0.51 1.72 0.35 0.52 0.00 0.00 175.17 177.40 2yue n THR 140 N 1.25 3.21 -0.06 1.71 -2.24 -1.26 -4.57 114.28 112.32 2yue n THR 140 Ca 0.01 -3.77 -0.13 0.00 -2.27 0.00 0.00 64.05 57.90 2yue n THR 140 Cb 0.42 -1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 67.42 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 -0.74 0.30 -2.45 -0.78 5.12 -1.26 -5.07 116.66 111.79 2yue n ARG 141 Ca 0.54 0.13 -0.13 0.00 -1.93 0.00 0.00 57.85 56.45 2yue n ARG 141 Cb 0.65 -1.02 0.03 0.00 -1.16 0.00 0.00 32.46 30.96 2yue n ARG 141 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2yue n SER 142 N -3.76 1.55 -4.52 0.55 3.41 -1.26 -5.10 113.62 104.48 2yue n SER 142 Ca -0.23 -2.01 -0.29 0.00 -0.26 0.00 0.00 58.87 56.08 2yue n SER 142 Cb 0.58 -0.18 0.24 0.00 -0.26 0.00 0.00 64.21 64.59 2yue n SER 142 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2yue s LEU 143 N 0.00 1.22 -0.17 1.04 1.43 -1.26 -5.05 118.68 115.90 2yue s LEU 143 Ca 0.31 1.66 -0.09 0.00 -1.03 0.00 0.00 54.13 54.98 2yue s LEU 143 Cb -0.02 -3.66 0.06 0.00 0.03 0.00 0.00 46.19 42.60 2yue s LEU 143 CO 0.20 -4.01 0.40 -0.76 0.23 0.00 0.00 176.35 172.40 2yue s LEU 144 N -7.11 -0.05 0.18 1.79 1.43 -1.26 -4.80 118.68 108.86 2yue s LEU 144 Ca 0.68 0.87 0.08 0.00 -1.03 0.00 0.00 54.13 54.73 2yue s LEU 144 Cb -0.25 1.31 -0.04 0.00 0.03 0.00 0.00 46.19 47.25 2yue s LEU 144 CO 0.63 -0.19 -0.06 0.26 0.23 0.00 0.00 176.35 177.22 2yue s TRP 145 N 1.35 2.70 0.26 0.29 0.51 -0.16 -2.17 118.94 121.73 2yue s TRP 145 Ca -0.09 -0.19 0.01 0.00 -2.12 0.00 0.00 56.10 53.71 2yue s TRP 145 Cb -0.08 -1.31 -0.04 0.00 -0.81 0.00 0.00 33.47 31.23 2yue s TRP 145 CO -0.12 0.52 0.44 0.95 -0.51 0.00 0.00 176.95 178.23 2yue s THR 146 N -1.74 5.18 -0.03 2.01 -4.23 -1.26 -0.12 115.64 115.45 2yue s THR 146 Ca 0.26 -0.57 -0.03 0.00 -1.18 0.00 0.00 61.69 60.16 2yue s THR 146 Cb -0.09 -3.81 0.01 0.00 1.34 0.00 0.00 72.50 69.94 2yue s THR 146 CO 0.16 -0.35 0.09 0.68 -0.54 0.00 0.00 174.62 174.66 2yue s VAL 147 N -2.06 0.02 -0.12 2.29 -7.23 0.37 -2.08 120.40 111.58 2yue s VAL 147 Ca 0.38 -0.14 -0.06 0.00 -1.81 0.00 0.00 61.98 60.35 2yue s VAL 147 Cb -0.10 -0.18 0.05 0.00 0.56 0.00 0.00 36.38 36.71 2yue s VAL 147 CO 0.31 -0.07 0.28 -0.63 -0.31 0.00 0.00 175.10 174.68 2yue s ILE 148 N -0.20 -0.04 -0.15 -0.62 1.01 0.57 -1.06 121.20 120.71 2yue s ILE 148 Ca -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.74 2yue s ILE 148 Cb -0.02 -0.43 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 2yue s ILE 148 CO 0.00 0.05 -0.09 -1.81 0.00 0.00 0.00 174.94 173.10 2yue s ASP 149 N 1.27 4.31 -0.73 3.58 1.01 0.07 -0.08 116.67 126.09 2yue s ASP 149 Ca -0.09 -0.27 -0.10 0.00 0.71 0.00 0.00 52.55 52.80 2yue s ASP 149 Cb -0.10 -1.69 0.19 0.00 1.01 0.00 0.00 42.92 42.34 2yue s ASP 149 CO -0.09 0.14 0.62 0.27 0.21 0.00 0.00 175.17 176.31 2yue s ILE 150 N 0.53 4.82 0.00 0.77 -0.00 -1.18 -3.80 121.20 122.35 2yue s ILE 150 Ca -0.06 -2.61 0.05 0.00 -0.00 0.00 0.00 60.65 58.03 2yue s ILE 150 Cb -0.15 -4.04 0.09 0.00 -0.00 0.00 0.00 42.46 38.36 2yue s ILE 150 CO 0.03 -0.96 0.91 0.00 -0.00 0.00 0.00 174.94 174.92 2yue n TYR 151 N 3.85 0.00 0.00 1.37 9.36 -1.26 -4.76 117.16 125.72 2yue n TYR 151 Ca 0.10 -0.31 0.00 0.00 3.32 0.00 0.00 57.90 61.01 2yue n TYR 151 Cb 0.43 0.23 0.00 0.00 -0.63 0.00 0.00 39.34 39.37 2yue n TYR 151 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2yue n GLY 152 N 0.10 3.77 2.37 2.98 0.00 -1.26 -4.99 105.19 108.16 2yue n GLY 152 Ca -0.10 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.20 2yue n GLY 152 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2yue n ASN 153 N 0.00 6.46 -3.57 1.61 2.85 -1.24 -4.71 115.26 116.65 2yue n ASN 153 Ca 0.00 -3.17 -0.01 0.00 -0.11 0.00 0.00 54.58 51.29 2yue n ASN 153 Cb 0.00 -1.20 -0.04 0.00 1.24 0.00 0.00 39.78 39.77 2yue n ASN 153 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2yue n THR 155 N 5.12 0.58 -3.79 0.00 -2.24 -1.02 -4.33 114.28 108.59 2yue n THR 155 Ca -0.12 -0.56 -0.13 0.00 -2.27 0.00 0.00 64.05 60.97 2yue n THR 155 Cb 0.51 -0.24 -0.12 0.00 -2.10 0.00 0.00 70.33 68.38 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 -4.58 -0.13 -0.06 3.38 0.00 -0.78 -1.29 107.32 103.87 2yue s GLY 156 Ca -0.07 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.28 2yue s GLY 156 CO 0.72 0.63 -0.08 -0.26 0.00 0.00 0.00 173.10 174.11 2yue s ILE 157 N 0.37 0.79 -0.18 0.90 -4.36 0.86 -1.92 121.20 117.66 2yue s ILE 157 Ca -0.02 -0.27 0.01 0.00 -0.26 0.00 0.00 60.65 60.11 2yue s ILE 157 Cb -0.04 -0.77 0.02 0.00 1.25 0.00 0.00 42.46 42.92 2yue s ILE 157 CO -0.02 0.28 -0.19 -0.70 0.24 0.00 0.00 174.94 174.56 2yue s GLU 158 N 0.85 2.87 0.33 0.37 2.12 -0.46 -0.25 118.70 124.54 2yue s GLU 158 Ca -0.12 -0.81 -0.26 0.00 0.36 0.00 0.00 54.97 54.14 2yue s GLU 158 Cb -0.15 -2.52 -0.09 0.00 0.26 0.00 0.00 34.13 31.63 2yue s GLU 158 CO 0.01 -0.23 1.01 -0.06 -0.54 0.00 0.00 175.26 175.46 2yue s PHE 159 N 1.31 3.55 0.35 5.30 0.40 -1.25 -0.15 117.98 127.49 2yue s PHE 159 Ca 0.05 1.73 0.09 0.00 -0.60 0.00 0.00 56.93 58.19 2yue s PHE 159 Cb -0.13 -3.07 -0.07 0.00 0.51 0.00 0.00 43.02 40.26 2yue s PHE 159 CO -0.12 -0.20 -0.07 -0.51 0.70 0.00 0.00 175.22 175.01 2yue s LEU 160 N -2.07 2.73 -0.60 -0.37 1.43 -0.47 -4.87 118.68 114.45 2yue s LEU 160 Ca 0.51 -1.23 -0.23 0.00 -1.03 0.00 0.00 54.13 52.15 2yue s LEU 160 Cb -0.23 -0.95 0.05 0.00 0.03 0.00 0.00 46.19 45.10 2yue s LEU 160 CO 0.29 -0.26 0.95 -1.81 0.23 0.00 0.00 176.35 175.75 2yue s ASP 161 N -3.61 6.26 0.50 2.29 1.11 -1.26 -4.31 116.67 117.65 2yue s ASP 161 Ca 0.33 -0.62 0.26 0.00 0.18 0.00 0.00 52.55 52.69 2yue s ASP 161 Cb 0.04 -2.43 1.33 0.00 1.07 0.00 0.00 42.92 42.93 2yue s ASP 161 CO 0.16 -1.32 1.91 0.77 1.18 0.00 0.00 175.17 177.87 2yue h SER 162 N 9.43 0.13 -0.60 0.27 4.64 -1.90 0.17 113.55 125.70 2yue h SER 162 Ca -0.27 0.01 0.17 0.00 -0.47 0.00 0.00 61.79 61.23 2yue h SER 162 Cb 1.07 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2yue h SER 162 CO 1.13 0.05 0.45 0.03 -0.87 0.00 0.00 176.83 177.62 2yue h ARG 163 N 0.13 0.00 -0.03 4.77 3.08 -1.89 0.31 114.38 120.74 2yue h ARG 163 Ca 0.39 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.24 2yue h ARG 163 Cb 1.36 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.41 2yue h ARG 163 CO -0.06 0.00 -0.85 0.82 -1.07 0.00 0.00 179.97 178.82 2yue h ILE 164 N 0.00 1.40 -0.54 2.04 2.04 -1.07 -3.22 117.51 118.16 2yue h ILE 164 Ca 0.28 -2.33 -0.24 0.00 1.00 0.00 0.00 64.86 63.57 2yue h ILE 164 Cb 1.18 2.29 -0.14 0.00 -0.74 0.00 0.00 36.82 39.41 2yue h ILE 164 CO -0.00 0.70 0.15 -1.22 0.00 0.00 0.00 178.15 177.78 2yue n TYR 165 N -3.78 1.72 -4.12 1.37 4.02 0.45 -4.99 117.16 111.84 2yue n TYR 165 Ca -0.05 -1.51 -0.12 0.00 -0.01 0.00 0.00 57.90 56.21 2yue n TYR 165 Cb 0.78 -0.60 -0.04 0.00 -0.02 0.00 0.00 39.34 39.45 2yue n TYR 165 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 2yue n MET 166 N -0.92 0.31 0.03 -0.72 2.81 0.79 -5.03 117.12 114.40 2yue n MET 166 Ca 0.39 -2.10 0.00 0.00 -1.81 0.00 0.00 57.70 54.18 2yue n MET 166 Cb 1.22 1.78 0.00 0.00 -0.71 0.00 0.00 33.22 35.51 2yue n MET 166 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2yue n TYR 167 N -0.41 -1.09 -0.14 2.03 4.02 -1.26 -4.88 117.16 115.43 2yue n TYR 167 Ca 0.04 0.15 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 2yue n TYR 167 Cb 0.39 0.68 0.00 0.00 -0.02 0.00 0.00 39.34 40.40 2yue n TYR 167 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85