#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yue n SER 2 N 0.00 -6.82 -3.65 1.61 7.64 -1.26 -4.89 113.62 106.26 2yue n SER 2 Ca 0.00 1.03 -0.14 0.00 1.01 0.00 0.00 58.87 60.77 2yue n SER 2 Cb 0.00 -2.89 -0.08 0.00 -1.01 0.00 0.00 64.21 60.23 2yue n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yue s SER 3 N -5.87 -0.66 0.39 6.43 0.01 -1.26 -5.04 113.70 107.70 2yue s SER 3 Ca 0.00 1.23 0.08 0.00 1.31 0.00 0.00 55.95 58.56 2yue s SER 3 Cb 0.00 1.23 -0.05 0.00 0.21 0.00 0.00 66.02 67.42 2yue s SER 3 CO 0.00 -0.26 0.19 -0.83 0.41 0.00 0.00 173.24 172.75 2yue s GLY 4 N 0.18 2.21 0.25 3.44 0.00 -1.26 -5.15 107.32 106.99 2yue s GLY 4 Ca -0.01 -2.01 0.02 0.00 0.00 0.00 0.00 44.72 42.72 2yue s GLY 4 CO 0.02 -1.85 0.09 1.44 0.00 0.00 0.00 173.10 172.80 2yue n SER 5 N -1.25 1.15 -1.28 1.64 7.64 -1.26 -5.11 113.62 115.15 2yue n SER 5 Ca -0.01 -2.32 0.17 0.00 1.01 0.00 0.00 58.87 57.72 2yue n SER 5 Cb 0.63 0.62 -0.04 0.00 -1.01 0.00 0.00 64.21 64.41 2yue n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yue n SER 6 N -1.72 -7.62 -3.24 6.43 7.64 -1.26 -4.66 113.62 109.19 2yue n SER 6 Ca -0.04 1.37 -0.25 0.00 1.01 0.00 0.00 58.87 60.97 2yue n SER 6 Cb 0.37 -3.92 -0.06 0.00 -1.01 0.00 0.00 64.21 59.59 2yue n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yue n GLY 7 N -3.80 4.12 0.35 0.23 0.00 -1.26 -5.10 105.19 99.73 2yue n GLY 7 Ca 0.01 -2.23 -0.03 0.00 0.00 0.00 0.00 46.02 43.77 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 0.79 -1.24 -2.73 1.61 -0.04 -1.26 -5.00 135.00 127.13 2yue n PRO 8 Ca 0.26 -0.17 -0.40 0.00 -0.04 0.00 0.00 63.50 63.16 2yue n PRO 8 Cb 0.48 -0.16 -0.06 0.00 -0.04 0.00 0.00 33.50 33.72 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 4.60 0.00 1.53 2.96 -1.26 -5.05 118.68 121.46 2yue s LEU 9 Ca 0.07 1.96 0.01 0.00 -0.22 0.00 0.00 54.13 55.95 2yue s LEU 9 Cb -0.01 -3.67 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 2yue s LEU 9 CO 0.05 0.11 0.05 0.00 -1.32 0.00 0.00 176.35 175.24 2yue n GLN 10 N 1.34 0.72 -3.04 1.98 6.02 -1.26 -4.80 117.38 118.35 2yue n GLN 10 Ca -0.01 -3.53 -0.39 0.00 -0.01 0.00 0.00 57.00 53.05 2yue n GLN 10 Cb 0.47 1.28 -0.06 0.00 1.02 0.00 0.00 30.24 32.96 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 -2.89 3.86 0.40 1.08 0.08 -1.26 -0.26 117.98 118.98 2yue s PHE 11 Ca 0.07 1.53 -0.16 0.00 0.12 0.00 0.00 56.93 58.50 2yue s PHE 11 Cb 0.00 -2.73 -0.09 0.00 -0.57 0.00 0.00 43.02 39.64 2yue s PHE 11 CO 0.05 0.48 0.84 -1.58 -0.10 0.00 0.00 175.22 174.91 2yue s HIS 12 N -0.92 3.38 0.29 0.36 2.46 -1.14 -4.46 115.29 115.26 2yue s HIS 12 Ca 0.35 1.33 0.04 0.00 0.47 0.00 0.00 55.06 57.25 2yue s HIS 12 Cb -0.22 -2.64 0.67 0.00 -0.13 0.00 0.00 32.58 30.26 2yue s HIS 12 CO 0.24 -0.07 1.79 0.77 -2.47 0.00 0.00 174.74 175.00 2yue h SER 13 N 1.78 0.79 -2.55 9.88 0.02 -1.92 -3.40 113.55 118.15 2yue h SER 13 Ca -0.48 0.08 -0.54 0.00 -0.84 0.00 0.00 61.79 60.02 2yue h SER 13 Cb 1.18 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.67 2yue h SER 13 CO 0.63 0.32 1.12 0.54 -1.14 0.00 0.00 176.83 178.30 2yue s VAL 14 N -5.90 3.30 0.22 2.27 0.11 -1.26 -4.96 120.40 114.19 2yue s VAL 14 Ca -0.12 0.45 -0.20 0.00 -2.93 0.00 0.00 61.98 59.18 2yue s VAL 14 Cb 0.24 -3.29 0.04 0.00 -1.53 0.00 0.00 36.38 31.84 2yue s VAL 14 CO 0.80 -0.03 0.62 -1.38 -3.33 0.00 0.00 175.10 171.78 2yue s HIS 15 N 3.92 -0.26 0.95 1.54 -0.00 -1.26 -4.01 115.29 116.17 2yue s HIS 15 Ca 0.78 -0.09 -0.13 0.00 -0.00 0.00 0.00 55.06 55.63 2yue s HIS 15 Cb -0.37 0.56 0.03 0.00 -0.00 0.00 0.00 32.58 32.80 2yue s HIS 15 CO 0.34 -1.02 0.39 0.41 -0.00 0.00 0.00 174.74 174.85 2yue n GLY 16 N -0.40 -2.04 0.27 -1.38 0.00 0.57 -4.81 105.19 97.40 2yue n GLY 16 Ca -0.10 -0.74 0.04 0.00 0.00 0.00 0.00 46.02 45.22 2yue n GLY 16 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2yue h ASP 17 N -1.52 0.25 -2.49 1.61 3.32 -1.88 -2.81 116.42 112.91 2yue h ASP 17 Ca -0.43 0.10 -0.74 0.00 0.02 0.00 0.00 57.03 55.98 2yue h ASP 17 Cb 1.28 0.08 -0.33 0.00 0.22 0.00 0.00 39.33 40.59 2yue h ASP 17 CO 0.34 0.11 0.37 0.59 -1.72 0.00 0.00 179.24 178.93 2yue n ASN 18 N -5.01 5.88 -3.56 6.45 4.13 -1.23 -4.92 115.26 117.00 2yue n ASN 18 Ca 0.13 -3.54 -0.29 0.00 1.68 0.00 0.00 54.58 52.56 2yue n ASN 18 Cb 0.38 -1.02 -0.15 0.00 -1.54 0.00 0.00 39.78 37.45 2yue n ASN 18 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2yue s ILE 19 N -3.43 0.06 -0.40 2.41 -1.09 -1.06 -3.43 121.20 114.26 2yue s ILE 19 Ca 0.38 -0.89 -0.23 0.00 -2.23 0.00 0.00 60.65 57.68 2yue s ILE 19 Cb 0.14 -1.08 0.02 0.00 -1.58 0.00 0.00 42.46 39.96 2yue s ILE 19 CO -0.02 -0.74 0.78 -0.60 -1.23 0.00 0.00 174.94 173.13 2yue s ARG 20 N 1.98 3.60 -0.36 2.79 6.06 0.24 -4.80 118.95 128.47 2yue s ARG 20 Ca 0.10 0.12 0.00 0.00 -2.50 0.00 0.00 55.73 53.45 2yue s ARG 20 Cb -0.17 -3.86 0.09 0.00 0.06 0.00 0.00 34.95 31.08 2yue s ARG 20 CO -0.34 -0.96 0.10 0.42 -2.50 0.00 0.00 175.30 172.02 2yue s ILE 21 N 3.17 2.82 -0.29 4.11 1.01 -1.26 -0.98 121.20 129.77 2yue s ILE 21 Ca 0.30 -2.03 -0.16 0.00 0.00 0.00 0.00 60.65 58.77 2yue s ILE 21 Cb -0.13 -2.91 0.13 0.00 0.01 0.00 0.00 42.46 39.56 2yue s ILE 21 CO 0.19 -0.53 0.89 -0.55 0.00 0.00 0.00 174.94 174.95 2yue s SER 22 N 1.37 -0.64 0.30 3.58 0.15 -0.99 -4.98 113.70 112.47 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 -0.21 1.28 0.02 0.00 -1.71 0.00 0.00 66.02 65.40 2yue s SER 22 CO -0.05 -0.16 0.68 -0.60 1.20 0.00 0.00 173.24 174.30 2yue s ARG 23 N 1.45 1.83 0.58 5.44 3.52 -1.26 -4.74 118.95 125.77 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 1.72 0.00 -1.56 0.00 0.00 34.95 35.65 2yue s ARG 23 CO -0.16 -0.83 2.21 -0.44 -0.81 0.00 0.00 175.30 175.27 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 5.19 -1.98 -3.38 116.42 116.19 2yue h ASP 24 Ca -0.23 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.18 2yue h ASP 24 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2yue h ASP 24 CO 0.29 0.00 -0.14 0.61 -3.12 0.00 0.00 179.24 176.88 2yue n GLY 25 N -1.37 -0.14 0.00 2.75 0.00 -1.26 -4.92 105.19 100.25 2yue n GLY 25 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.21 0.00 -3.56 2.61 5.66 -1.26 -5.04 114.28 109.48 2yue n THR 26 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 2yue n THR 26 Cb 0.07 0.00 -0.06 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 -0.60 -0.01 1.09 0.20 -1.26 -3.94 118.68 114.16 2yue s LEU 27 Ca 0.00 0.77 0.07 0.00 0.69 0.00 0.00 54.13 55.66 2yue s LEU 27 Cb 0.00 2.34 -0.02 0.00 -0.43 0.00 0.00 46.19 48.08 2yue s LEU 27 CO 0.00 -0.47 -0.22 0.00 -0.29 0.00 0.00 176.35 175.37 2yue s ALA 28 N -0.83 1.86 0.06 5.97 0.00 0.71 -2.36 121.76 127.16 2yue s ALA 28 Ca -0.06 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.83 2yue s ALA 28 Cb -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 2yue s ALA 28 CO 0.06 0.45 0.17 -0.98 0.00 0.00 0.00 175.76 175.45 2yue s ARG 29 N -0.63 0.73 0.10 0.00 1.70 -0.16 -0.17 118.95 120.52 2yue s ARG 29 Ca 0.09 -0.80 -0.07 0.00 -0.47 0.00 0.00 55.73 54.48 2yue s ARG 29 Cb -0.09 0.29 -0.05 0.00 -0.57 0.00 0.00 34.95 34.53 2yue s ARG 29 CO -0.00 -0.21 0.36 -0.98 -1.08 0.00 0.00 175.30 173.39 2yue s ARG 30 N -3.12 3.65 -0.61 3.89 1.70 -0.73 -0.59 118.95 123.14 2yue s ARG 30 Ca -0.01 -0.01 -0.00 0.00 -0.47 0.00 0.00 55.73 55.24 2yue s ARG 30 Cb 0.02 -2.94 0.49 0.00 -0.57 0.00 0.00 34.95 31.94 2yue s ARG 30 CO -0.07 0.53 1.96 0.34 -1.08 0.00 0.00 175.30 176.99 2yue n PHE 31 N 0.55 3.15 -2.37 5.89 -0.00 -1.22 -4.83 117.46 118.62 2yue n PHE 31 Ca -0.06 -2.77 -0.03 0.00 -0.00 0.00 0.00 57.45 54.59 2yue n PHE 31 Cb 0.52 -1.30 -0.03 0.00 -0.00 0.00 0.00 39.48 38.67 2yue n PHE 31 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2yue n GLU 32 N -0.95 -4.28 -3.98 -4.13 1.02 -1.26 -5.03 120.64 102.02 2yue n GLU 32 Ca 0.61 3.23 -0.11 0.00 -0.02 0.00 0.00 57.16 60.87 2yue n GLU 32 Cb 0.85 -4.49 -0.03 0.00 -0.02 0.00 0.00 31.44 27.76 2yue n GLU 32 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2yue s SER 33 N -0.57 0.39 -0.03 1.62 1.04 -1.26 -5.05 113.70 109.84 2yue s SER 33 Ca -0.17 -1.23 0.05 0.00 0.48 0.00 0.00 55.95 55.07 2yue s SER 33 Cb 0.01 0.70 -0.07 0.00 0.10 0.00 0.00 66.02 66.76 2yue s SER 33 CO 0.47 -1.37 0.05 0.49 0.98 0.00 0.00 173.24 173.86 2yue n PHE 34 N -0.51 0.00 -4.15 5.02 3.01 -1.26 -5.01 117.46 114.56 2yue n PHE 34 Ca -0.02 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.32 2yue n PHE 34 Cb 0.61 -0.19 -0.09 0.00 -0.01 0.00 0.00 39.48 39.81 2yue n PHE 34 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2yue n ARG 36 N -0.32 -3.48 -2.79 0.00 1.74 -0.14 -4.65 116.66 107.02 2yue n ARG 36 Ca 0.01 2.78 -0.10 0.00 -0.77 0.00 0.00 57.85 59.78 2yue n ARG 36 Cb 0.65 -5.28 0.07 0.00 -1.02 0.00 0.00 32.46 26.88 2yue n ARG 36 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yue n ALA 37 N 0.76 0.45 -2.61 7.54 0.00 -1.26 -3.52 120.51 121.86 2yue n ALA 37 Ca -0.01 -1.86 -0.31 0.00 0.00 0.00 0.00 53.44 51.26 2yue n ALA 37 Cb 0.03 -1.07 -0.10 0.00 0.00 0.00 0.00 19.45 18.32 2yue n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2yue s ILE 38 N -0.44 3.67 0.03 0.00 1.01 -1.26 -1.02 121.20 123.19 2yue s ILE 38 Ca 0.25 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.95 2yue s ILE 38 Cb 0.34 -2.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.12 2yue s ILE 38 CO -0.06 0.25 -0.05 0.42 0.00 0.00 0.00 174.94 175.50 2yue s THR 39 N -1.14 0.28 0.47 2.92 -4.23 0.83 -0.31 115.64 114.45 2yue s THR 39 Ca 0.20 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.84 2yue s THR 39 Cb -0.11 -0.38 -0.02 0.00 1.34 0.00 0.00 72.50 73.33 2yue s THR 39 CO 0.12 -0.41 0.05 -0.36 -0.54 0.00 0.00 174.62 173.48 2yue s PHE 40 N -1.30 1.86 0.22 3.99 0.40 -1.26 -0.24 117.98 121.65 2yue s PHE 40 Ca -0.12 -1.07 -0.25 0.00 -0.60 0.00 0.00 56.93 54.89 2yue s PHE 40 Cb -0.09 -1.44 -0.09 0.00 0.51 0.00 0.00 43.02 41.91 2yue s PHE 40 CO -0.00 0.04 0.83 -1.54 0.70 0.00 0.00 175.22 175.25 2yue s SER 41 N -3.77 7.36 0.29 1.36 1.04 -0.84 -2.88 113.70 116.26 2yue s SER 41 Ca 0.14 1.70 0.03 0.00 0.48 0.00 0.00 55.95 58.30 2yue s SER 41 Cb 0.02 -2.52 0.44 0.00 0.10 0.00 0.00 66.02 64.06 2yue s SER 41 CO 0.08 0.11 1.73 0.00 0.98 0.00 0.00 173.24 176.13 2yue h ALA 42 N 3.86 1.12 -2.45 5.32 0.00 -0.85 -3.39 119.26 122.88 2yue h ALA 42 Ca -0.47 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 53.90 2yue h ALA 42 Cb 1.20 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 18.71 2yue h ALA 42 CO 0.66 0.55 -0.70 -0.98 0.00 0.00 0.00 179.25 178.78 2yue s ARG 43 N -4.46 0.67 -0.11 0.00 1.70 -1.26 -4.83 118.95 110.65 2yue s ARG 43 Ca -0.06 -1.14 -0.29 0.00 -0.47 0.00 0.00 55.73 53.76 2yue s ARG 43 Cb 0.14 -0.06 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 2yue s ARG 43 CO 0.78 -0.04 1.53 -1.25 -1.08 0.00 0.00 175.30 175.25 2yue s PRO 44 N -3.28 4.13 0.37 3.89 0.04 -1.26 -4.80 135.00 134.09 2yue s PRO 44 Ca 0.04 1.95 -0.06 0.00 0.04 0.00 0.00 61.00 62.98 2yue s PRO 44 Cb 0.02 -3.93 -0.05 0.00 0.04 0.00 0.00 34.50 30.58 2yue s PRO 44 CO -0.05 -0.88 0.67 0.14 0.04 0.00 0.00 177.00 176.92 2yue s VAL 45 N 4.07 4.94 0.72 -0.36 -7.23 -0.90 -4.93 120.40 116.71 2yue s VAL 45 Ca 0.68 0.20 -0.04 0.00 -1.81 0.00 0.00 61.98 61.00 2yue s VAL 45 Cb -0.29 -3.78 0.10 0.00 0.56 0.00 0.00 36.38 32.98 2yue s VAL 45 CO 0.25 -0.53 1.01 -0.13 -0.31 0.00 0.00 175.10 175.39 2yue s ARG 46 N -4.00 1.82 0.02 4.82 0.52 -1.26 -4.29 118.95 116.57 2yue s ARG 46 Ca 0.46 -0.72 -0.11 0.00 -0.52 0.00 0.00 55.73 54.84 2yue s ARG 46 Cb -0.10 -2.24 -0.06 0.00 0.52 0.00 0.00 34.95 33.06 2yue s ARG 46 CO 0.35 -1.40 1.11 0.82 0.02 0.00 0.00 175.30 176.19 2yue h ILE 47 N -0.61 0.00 0.00 1.52 1.08 -1.95 -3.03 117.51 114.53 2yue h ILE 47 Ca -0.41 -0.02 -0.00 0.00 -0.39 0.00 0.00 64.86 64.04 2yue h ILE 47 Cb 1.28 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.03 2yue h ILE 47 CO 0.47 0.00 -0.02 0.78 -0.69 0.00 0.00 178.15 178.69 2yue h ASN 48 N -0.42 0.00 -1.05 1.72 -0.26 -1.91 -3.03 115.58 110.64 2yue h ASN 48 Ca -0.04 0.00 -0.55 0.00 -0.56 0.00 0.00 56.30 55.15 2yue h ASN 48 Cb 0.31 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 2yue h ASN 48 CO 0.07 0.02 1.59 1.21 -1.06 0.00 0.00 177.43 179.26 2yue n GLU 49 N -3.16 0.83 -2.51 0.81 2.13 -1.15 -4.82 120.64 112.77 2yue n GLU 49 Ca -0.01 0.12 -0.40 0.00 0.66 0.00 0.00 57.16 57.52 2yue n GLU 49 Cb 0.22 -2.63 -0.04 0.00 0.27 0.00 0.00 31.44 29.26 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 7.69 4.66 -0.24 5.31 6.06 -1.26 -4.67 118.95 136.50 2yue s ARG 50 Ca 1.11 1.76 0.02 0.00 -2.50 0.00 0.00 55.73 56.13 2yue s ARG 50 Cb -0.68 -3.21 0.05 0.00 0.06 0.00 0.00 34.95 31.17 2yue s ARG 50 CO 0.40 0.23 -0.13 0.42 -2.50 0.00 0.00 175.30 173.71 2yue s ILE 51 N -1.02 2.10 -0.04 4.11 1.01 -1.16 -4.58 121.20 121.62 2yue s ILE 51 Ca 0.45 -1.41 -0.03 0.00 0.00 0.00 0.00 60.65 59.65 2yue s ILE 51 Cb -0.31 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 2yue s ILE 51 CO 0.39 0.13 0.13 0.00 0.00 0.00 0.00 174.94 175.59 2yue s VAL 53 N -1.19 -0.34 0.23 0.00 1.01 0.69 -1.19 120.40 119.61 2yue s VAL 53 Ca 0.22 0.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.13 2yue s VAL 53 Cb -0.12 -0.55 -0.08 0.00 0.00 0.00 0.00 36.38 35.63 2yue s VAL 53 CO 0.13 -0.06 0.64 -0.75 0.00 0.00 0.00 175.10 175.06 2yue s LYS 54 N 2.35 4.00 -0.59 2.72 2.20 0.98 -0.22 119.74 131.17 2yue s LYS 54 Ca 0.05 0.57 -0.20 0.00 -0.36 0.00 0.00 55.97 56.03 2yue s LYS 54 Cb -0.14 -2.71 0.08 0.00 -1.51 0.00 0.00 37.83 33.55 2yue s LYS 54 CO -0.10 0.33 0.79 -0.06 -0.36 0.00 0.00 175.35 175.95 2yue s PHE 55 N -1.71 2.89 -0.10 4.03 0.08 -0.27 -1.31 117.98 121.59 2yue s PHE 55 Ca 0.46 -0.68 -0.27 0.00 0.12 0.00 0.00 56.93 56.57 2yue s PHE 55 Cb -0.13 -4.01 -0.27 0.00 -0.57 0.00 0.00 43.02 38.04 2yue s PHE 55 CO 0.19 -1.36 0.85 0.00 -0.10 0.00 0.00 175.22 174.81 2yue h ALA 56 N 9.28 -0.02 -4.22 5.36 0.00 -1.89 -0.98 119.26 126.78 2yue h ALA 56 Ca -0.29 -0.54 -0.69 0.00 0.00 0.00 0.00 54.91 53.39 2yue h ALA 56 Cb 1.08 0.03 -0.27 0.00 0.00 0.00 0.00 17.79 18.63 2yue h ALA 56 CO 1.10 0.10 -0.83 -1.21 0.00 0.00 0.00 179.25 178.41 2yue s GLU 57 N -2.44 2.40 -0.00 0.00 0.41 -1.19 -4.76 118.70 113.10 2yue s GLU 57 Ca -0.17 -0.82 -0.02 0.00 -0.41 0.00 0.00 54.97 53.55 2yue s GLU 57 Cb -0.01 -2.22 -0.00 0.00 -1.78 0.00 0.00 34.13 30.11 2yue s GLU 57 CO 0.73 0.54 0.04 0.42 -0.49 0.00 0.00 175.26 176.50 2yue s ILE 58 N -0.55 0.04 0.56 -1.63 -1.09 -1.26 -2.19 121.20 115.08 2yue s ILE 58 Ca 0.08 -0.34 0.08 0.00 -2.23 0.00 0.00 60.65 58.24 2yue s ILE 58 Cb -0.11 -0.17 0.07 0.00 -1.58 0.00 0.00 42.46 40.67 2yue s ILE 58 CO 0.01 -0.18 0.64 -0.55 -1.23 0.00 0.00 174.94 173.62 2yue s SER 59 N -0.56 4.93 0.00 3.58 0.15 0.55 -4.86 113.70 117.50 2yue s SER 59 Ca -0.06 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.60 2yue s SER 59 Cb -0.04 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2yue s SER 59 CO -0.00 -1.24 0.79 0.59 1.20 0.00 0.00 173.24 174.58 2yue n ASN 60 N -2.06 0.00 0.03 5.45 4.13 -1.26 -4.82 115.26 116.73 2yue n ASN 60 Ca 0.09 0.79 0.00 0.00 1.68 0.00 0.00 54.58 57.14 2yue n ASN 60 Cb 0.63 -0.29 0.00 0.00 -1.54 0.00 0.00 39.78 38.57 2yue n ASN 60 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2yue n ASN 61 N -1.69 -0.52 -1.22 6.41 5.15 -1.26 -4.97 115.26 117.16 2yue n ASN 61 Ca 0.00 0.12 0.13 0.00 -0.60 0.00 0.00 54.58 54.23 2yue n ASN 61 Cb 0.00 0.85 -0.03 0.00 -0.53 0.00 0.00 39.78 40.07 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 -2.56 -3.09 -3.05 1.20 5.03 -1.26 -3.00 117.44 110.70 2yue n TRP 62 Ca 0.00 1.22 -0.41 0.00 3.03 0.00 0.00 57.50 61.34 2yue n TRP 62 Cb 0.00 -2.18 -0.06 0.00 -1.03 0.00 0.00 31.31 28.04 2yue n TRP 62 CO 0.00 0.00 0.00 1.21 -0.03 0.00 0.00 177.69 178.87 2yue s ASN 63 N -5.95 6.62 0.07 -0.99 2.47 -1.26 -4.84 114.94 111.06 2yue s ASN 63 Ca 0.00 0.72 0.00 0.00 0.42 0.00 0.00 52.86 54.00 2yue s ASN 63 Cb 0.00 -2.36 0.00 0.00 -1.45 0.00 0.00 41.25 37.44 2yue s ASN 63 CO 0.00 -0.44 0.00 0.61 -3.72 0.00 0.00 177.10 173.55 2yue n GLY 64 N 4.13 -3.43 0.00 1.21 0.00 -1.26 -4.79 105.19 101.05 2yue n GLY 64 Ca 0.01 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.66 0.83 3.64 -0.02 0.00 -1.26 -4.13 105.19 103.59 2yue n GLY 65 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 0.49 2.38 -0.11 -0.61 -4.36 -1.26 -4.57 121.20 113.16 2yue s ILE 66 Ca 0.00 -1.95 -0.05 0.00 -0.26 0.00 0.00 60.65 58.39 2yue s ILE 66 Cb 0.00 -2.86 0.05 0.00 1.25 0.00 0.00 42.46 40.89 2yue s ILE 66 CO 0.00 -0.12 0.25 0.00 0.24 0.00 0.00 174.94 175.31 2yue s ARG 67 N -3.74 0.21 0.15 0.37 1.70 -1.23 -3.36 118.95 113.05 2yue s ARG 67 Ca 0.36 0.53 0.00 0.00 -0.47 0.00 0.00 55.73 56.16 2yue s ARG 67 Cb 0.03 -0.12 -0.04 0.00 -0.57 0.00 0.00 34.95 34.25 2yue s ARG 67 CO 0.19 -0.16 0.03 -0.59 -1.08 0.00 0.00 175.30 173.69 2yue s PHE 68 N 1.25 1.05 -0.72 5.89 -0.71 -0.99 -0.58 117.98 123.18 2yue s PHE 68 Ca -0.09 -1.12 0.00 0.00 -1.04 0.00 0.00 56.93 54.68 2yue s PHE 68 Cb -0.10 -0.60 0.00 0.00 -1.21 0.00 0.00 43.02 41.11 2yue s PHE 68 CO -0.09 -0.35 0.00 0.41 -1.34 0.00 0.00 175.22 173.85 2yue n GLY 69 N -0.17 -0.75 3.48 1.99 0.00 -0.19 -1.15 105.19 108.39 2yue n GLY 69 Ca -0.06 -0.36 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 -3.90 2.06 -0.05 1.61 0.40 -1.00 -0.36 117.98 116.74 2yue s PHE 70 Ca 0.00 -0.84 -0.13 0.00 -0.60 0.00 0.00 56.93 55.36 2yue s PHE 70 Cb 0.00 -1.33 0.02 0.00 0.51 0.00 0.00 43.02 42.22 2yue s PHE 70 CO 0.00 0.16 0.30 -0.08 0.70 0.00 0.00 175.22 176.30 2yue s THR 71 N -3.12 0.04 0.02 0.64 -1.32 0.31 -0.15 115.64 112.05 2yue s THR 71 Ca 0.34 -0.33 0.06 0.00 -1.21 0.00 0.00 61.69 60.55 2yue s THR 71 Cb 0.08 -0.55 -0.24 0.00 -1.51 0.00 0.00 72.50 70.29 2yue s THR 71 CO 0.15 -0.18 0.91 -1.28 -2.21 0.00 0.00 174.62 172.01 2yue h SER 72 N 4.49 0.12 -4.32 8.08 0.87 -0.83 -2.83 113.55 119.13 2yue h SER 72 Ca -0.29 -0.18 -0.51 0.00 -1.23 0.00 0.00 61.79 59.59 2yue h SER 72 Cb 1.18 -0.04 0.08 0.00 -0.44 0.00 0.00 62.40 63.18 2yue h SER 72 CO 0.37 1.15 0.38 0.20 -0.53 0.00 0.00 176.83 178.40 2yue s ASN 73 N -6.56 5.62 0.35 6.23 0.01 -1.26 -4.91 114.94 114.42 2yue s ASN 73 Ca -0.05 1.61 -0.20 0.00 -0.71 0.00 0.00 52.86 53.52 2yue s ASN 73 Cb 0.08 -2.50 -0.10 0.00 0.41 0.00 0.00 41.25 39.15 2yue s ASN 73 CO 0.83 -1.28 0.85 -1.81 -1.51 0.00 0.00 177.10 174.18 2yue s ASP 74 N -3.68 6.97 0.52 -1.22 1.01 -1.26 -4.78 116.67 114.22 2yue s ASP 74 Ca 0.58 1.55 0.31 0.00 0.71 0.00 0.00 52.55 55.70 2yue s ASP 74 Cb -0.14 -2.48 1.29 0.00 1.01 0.00 0.00 42.92 42.60 2yue s ASP 74 CO 0.51 -0.21 1.96 1.55 0.21 0.00 0.00 175.17 179.20 2yue h PRO 75 N 2.44 0.00 0.00 8.23 0.13 -1.96 -2.71 132.00 138.13 2yue h PRO 75 Ca -0.48 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.59 2yue h PRO 75 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2yue h PRO 75 CO 0.64 0.08 -0.30 -0.39 -0.23 0.00 0.00 178.00 177.79 2yue h VAL 76 N 0.00 0.60 -0.09 1.56 -1.51 -1.94 -2.91 116.25 111.96 2yue h VAL 76 Ca -0.00 -1.53 0.00 0.00 -1.23 0.00 0.00 66.70 63.94 2yue h VAL 76 Cb 0.55 2.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.75 2yue h VAL 76 CO 0.01 0.30 0.00 0.35 -1.23 0.00 0.00 177.57 177.00 2yue n THR 77 N -3.29 0.11 0.06 7.19 -2.24 -1.02 -3.35 114.28 111.75 2yue n THR 77 Ca 0.01 -0.18 0.01 0.00 -2.27 0.00 0.00 64.05 61.62 2yue n THR 77 Cb 0.56 0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 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 -0.20 0.06 -4.65 3.22 4.77 -1.11 -4.92 117.00 114.18 2yue n LEU 78 Ca 0.15 -0.42 -0.48 0.00 -0.03 0.00 0.00 56.01 55.22 2yue n LEU 78 Cb 0.20 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 2yue n LEU 78 CO 0.11 0.01 1.13 1.21 -1.33 0.00 0.00 177.39 178.53 2yue n GLU 79 N -1.12 1.80 -1.44 3.23 2.13 -1.16 -0.08 120.64 124.01 2yue n GLU 79 Ca 0.00 0.65 -0.15 0.00 0.66 0.00 0.00 57.16 58.32 2yue n GLU 79 Cb 0.03 -2.38 -0.06 0.00 0.27 0.00 0.00 31.44 29.29 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 3.24 1.44 2.49 8.31 0.00 -1.26 -4.83 105.19 114.59 2yue n GLY 80 Ca 0.18 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.31 -0.08 -4.37 2.61 -2.24 0.88 -5.13 114.28 103.64 2yue n THR 81 Ca -0.15 -2.85 -0.27 0.00 -2.27 0.00 0.00 64.05 58.50 2yue n THR 81 Cb 0.62 0.69 -0.11 0.00 -2.10 0.00 0.00 70.33 69.43 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 -2.28 2.57 0.00 3.22 1.43 -1.20 -4.71 118.68 117.71 2yue s LEU 82 Ca 0.30 -0.75 -0.00 0.00 -1.03 0.00 0.00 54.13 52.65 2yue s LEU 82 Cb 0.31 -1.33 0.00 0.00 0.03 0.00 0.00 46.19 45.20 2yue s LEU 82 CO -0.07 0.13 0.01 -0.81 0.23 0.00 0.00 176.35 175.84 2yue n PRO 83 N 0.37 -1.05 0.01 1.29 -0.04 -1.26 -4.98 135.00 129.35 2yue n PRO 83 Ca -0.13 -0.02 -0.08 0.00 -0.04 0.00 0.00 63.50 63.24 2yue n PRO 83 Cb 0.55 -0.01 -0.13 0.00 -0.04 0.00 0.00 33.50 33.87 2yue n PRO 83 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2yue h LYS 84 N 0.00 0.00 0.00 0.54 3.64 -1.98 -3.43 116.57 115.34 2yue h LYS 84 Ca -0.00 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.01 2yue h LYS 84 Cb 0.01 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.74 2yue h LYS 84 CO 0.00 0.69 -0.33 2.48 -2.27 0.00 0.00 179.45 180.03 2yue n TYR 85 N -3.17 -0.23 -0.40 1.91 0.18 -1.26 -0.97 117.16 113.23 2yue n TYR 85 Ca -0.10 -1.90 0.11 0.00 1.88 0.00 0.00 57.90 57.90 2yue n TYR 85 Cb 1.00 0.10 0.33 0.00 -0.38 0.00 0.00 39.34 40.39 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 -1.52 2.46 0.00 -3.48 0.00 -1.26 -4.46 120.51 112.25 2yue n ALA 86 Ca -0.10 -1.34 0.00 0.00 0.00 0.00 0.00 53.44 52.00 2yue n ALA 86 Cb 0.43 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.04 0.08 0.00 0.00 -0.04 -1.26 -4.82 135.00 128.93 2yue n PRO 88 Ca 0.00 0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 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 -1.41 0.00 -3.65 3.54 8.00 -1.26 -1.15 116.55 120.62 2yue n ASP 89 Ca 0.05 0.75 -0.42 0.00 0.71 0.00 0.00 54.79 55.88 2yue n ASP 89 Cb 0.15 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 40.97 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 -1.80 5.63 0.00 0.64 4.77 -1.19 -3.21 117.00 121.85 2yue n LEU 90 Ca 0.00 -3.55 0.00 0.00 -0.03 0.00 0.00 56.01 52.43 2yue n LEU 90 Cb 0.00 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 39.70 2yue n LEU 90 CO 0.00 0.47 0.00 0.35 -1.33 0.00 0.00 177.39 176.88 2yue n THR 91 N 5.42 0.00 -0.27 -5.08 -2.24 -1.09 -4.40 114.28 106.62 2yue n THR 91 Ca 0.52 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 62.24 2yue n THR 91 Cb 0.38 0.00 0.06 0.00 -2.10 0.00 0.00 70.33 68.67 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 0.90 -4.10 3.42 4.21 -1.10 -3.43 115.58 115.48 2yue h ASN 92 Ca 0.00 -0.08 -0.55 0.00 1.21 0.00 0.00 56.30 56.88 2yue h ASN 92 Cb 0.00 -0.23 0.17 0.00 -1.12 0.00 0.00 38.32 37.15 2yue h ASN 92 CO 0.00 0.72 0.37 0.54 -1.29 0.00 0.00 177.43 177.77 2yue n ARG 93 N -4.49 0.58 -2.24 0.81 1.74 -1.25 -4.94 116.66 106.87 2yue n ARG 93 Ca 0.06 0.26 -0.41 0.00 -0.77 0.00 0.00 57.85 57.00 2yue n ARG 93 Cb 0.08 -2.44 -0.03 0.00 -1.02 0.00 0.00 32.46 29.04 2yue n ARG 93 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2yue s PRO 94 N -3.72 4.42 0.00 5.56 0.04 -1.26 -2.78 135.00 137.25 2yue s PRO 94 Ca 0.77 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.85 2yue s PRO 94 Cb -0.33 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2yue s PRO 94 CO 0.47 -0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.74 2yue n GLY 95 N 1.95 2.11 3.71 0.56 0.00 -1.26 -4.77 105.19 107.48 2yue n GLY 95 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.36 3.42 0.05 1.61 0.08 -1.12 -0.13 117.98 119.54 2yue s PHE 96 Ca 0.00 0.55 0.04 0.00 0.12 0.00 0.00 56.93 57.64 2yue s PHE 96 Cb 0.00 -2.37 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 2yue s PHE 96 CO 0.00 0.16 -0.12 -1.58 -0.10 0.00 0.00 175.22 173.58 2yue s TRP 97 N 0.74 1.02 -0.21 0.36 0.51 0.79 -4.50 118.94 117.64 2yue s TRP 97 Ca 0.16 -0.44 -0.28 0.00 -2.12 0.00 0.00 56.10 53.43 2yue s TRP 97 Cb -0.13 -0.59 0.11 0.00 -0.81 0.00 0.00 33.47 32.05 2yue s TRP 97 CO 0.05 0.01 0.94 0.00 -0.51 0.00 0.00 176.95 177.44 2yue s ALA 98 N -1.18 -1.91 0.34 0.98 0.00 -1.26 -2.38 121.76 116.35 2yue s ALA 98 Ca -0.04 1.72 0.08 0.00 0.00 0.00 0.00 51.96 53.72 2yue s ALA 98 Cb -0.09 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 2yue s ALA 98 CO 0.01 -0.29 0.28 0.21 0.00 0.00 0.00 175.76 175.97 2yue s LYS 99 N -0.39 1.80 0.05 0.00 2.47 -0.30 -4.97 119.74 118.39 2yue s LYS 99 Ca -0.01 -2.05 0.08 0.00 -1.56 0.00 0.00 55.97 52.43 2yue s LYS 99 Cb -0.03 0.28 -0.03 0.00 -1.46 0.00 0.00 37.83 36.59 2yue s LYS 99 CO -0.01 -0.66 -0.22 0.00 0.16 0.00 0.00 175.35 174.63 2yue s ALA 100 N -3.39 2.45 -0.12 3.13 0.00 -1.26 -2.34 121.76 120.23 2yue s ALA 100 Ca 0.40 -1.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.08 2yue s ALA 100 Cb 0.02 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 2yue s ALA 100 CO 0.28 0.56 0.06 -1.17 0.00 0.00 0.00 175.76 175.49 2yue s LEU 101 N -1.38 3.90 0.95 0.00 0.20 -1.21 -5.02 118.68 116.12 2yue s LEU 101 Ca 0.13 0.24 -0.12 0.00 0.69 0.00 0.00 54.13 55.07 2yue s LEU 101 Cb -0.10 -1.93 0.06 0.00 -0.43 0.00 0.00 46.19 43.78 2yue s LEU 101 CO 0.04 0.35 0.53 1.57 -0.29 0.00 0.00 176.35 178.54 2yue n HIS 102 N 2.38 -1.06 0.08 5.38 -0.00 -1.26 -4.69 115.22 116.05 2yue n HIS 102 Ca -0.19 0.26 -0.05 0.00 -0.00 0.00 0.00 57.72 57.74 2yue n HIS 102 Cb 0.54 -1.81 -0.06 0.00 -0.00 0.00 0.00 29.99 28.65 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 -1.65 0.00 -0.22 1.57 4.11 -1.98 -3.21 114.58 113.20 2yue h GLU 103 Ca -0.44 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.06 2yue h GLU 103 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2yue h GLU 103 CO 0.36 0.90 0.22 -0.56 0.07 0.00 0.00 179.01 180.00 2yue h GLN 104 N 0.00 0.00 -0.55 1.06 3.07 -2.06 0.14 115.11 116.77 2yue h GLN 104 Ca -0.01 0.00 -0.23 0.00 0.09 0.00 0.00 58.65 58.51 2yue h GLN 104 Cb 1.63 0.00 -0.13 0.00 0.08 0.00 0.00 27.48 29.06 2yue h GLN 104 CO 0.12 0.00 0.17 0.66 0.09 0.00 0.00 178.83 179.86 2yue n TYR 105 N -3.89 1.78 -3.33 0.06 4.01 -1.21 -4.73 117.16 109.84 2yue n TYR 105 Ca 0.02 -1.43 -0.30 0.00 -0.16 0.00 0.00 57.90 56.04 2yue n TYR 105 Cb 0.36 -0.60 -0.06 0.00 -0.31 0.00 0.00 39.34 38.72 2yue n TYR 105 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2yue n GLU 107 N 0.86 0.72 -3.54 0.00 1.02 -1.26 -5.01 120.64 113.42 2yue n GLU 107 Ca 0.30 -3.55 -0.28 0.00 -0.02 0.00 0.00 57.16 53.60 2yue n GLU 107 Cb 0.40 1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 33.07 2yue n GLU 107 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2yue s LYS 108 N -3.70 3.56 -1.74 3.49 2.36 -1.26 -4.22 119.74 118.23 2yue s LYS 108 Ca 0.07 -0.20 0.00 0.00 -2.55 0.00 0.00 55.97 53.29 2yue s LYS 108 Cb 0.00 -2.75 0.00 0.00 -1.05 0.00 0.00 37.83 34.03 2yue s LYS 108 CO 0.05 0.31 0.00 -3.47 1.55 0.00 0.00 175.35 173.80 2yue n ASP 109 N -0.82 -5.34 -4.66 1.43 2.03 -0.37 -4.98 116.55 103.84 2yue n ASP 109 Ca -0.04 0.16 -0.32 0.00 0.52 0.00 0.00 54.79 55.11 2yue n ASP 109 Cb 0.54 -4.43 -0.09 0.00 -0.72 0.00 0.00 41.12 36.42 2yue n ASP 109 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2yue s ASN 110 N -2.40 4.96 -0.35 1.67 -0.87 -1.26 -4.90 114.94 111.80 2yue s ASN 110 Ca 0.00 -0.05 -0.14 0.00 -1.57 0.00 0.00 52.86 51.10 2yue s ASN 110 Cb 0.00 -1.25 -0.01 0.00 -0.02 0.00 0.00 41.25 39.96 2yue s ASN 110 CO 0.00 0.28 0.30 -0.63 -2.57 0.00 0.00 177.10 174.48 2yue s ILE 111 N -1.06 5.23 -0.41 0.60 1.09 -1.26 -1.11 121.20 124.28 2yue s ILE 111 Ca 0.19 -0.15 -0.10 0.00 -1.10 0.00 0.00 60.65 59.49 2yue s ILE 111 Cb -0.11 -3.79 0.06 0.00 -1.06 0.00 0.00 42.46 37.57 2yue s ILE 111 CO 0.09 -0.08 0.26 -0.22 -0.10 0.00 0.00 174.94 174.89 2yue s LEU 112 N 1.85 5.07 -0.06 2.97 2.96 0.69 -1.21 118.68 130.96 2yue s LEU 112 Ca 0.08 -1.36 0.02 0.00 -0.22 0.00 0.00 54.13 52.65 2yue s LEU 112 Cb -0.17 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.48 2yue s LEU 112 CO 0.11 -0.51 -0.09 -0.72 -1.32 0.00 0.00 176.35 173.82 2yue s TYR 113 N 1.48 2.87 -0.15 5.38 -0.85 -0.16 -0.22 117.35 125.70 2yue s TYR 113 Ca 0.03 -0.03 -0.09 0.00 -0.52 0.00 0.00 57.07 56.46 2yue s TYR 113 Cb -0.22 -1.68 0.05 0.00 0.38 0.00 0.00 41.96 40.49 2yue s TYR 113 CO 0.04 0.30 0.36 1.52 -1.52 0.00 0.00 175.55 176.24 2yue s TYR 114 N -0.80 -0.49 0.10 -3.49 1.13 -0.44 -0.11 117.35 113.25 2yue s TYR 114 Ca 0.12 1.09 0.02 0.00 -1.41 0.00 0.00 57.07 56.89 2yue s TYR 114 Cb -0.11 0.18 -0.01 0.00 -1.10 0.00 0.00 41.96 40.93 2yue s TYR 114 CO 0.01 -0.28 0.06 2.48 -2.51 0.00 0.00 175.55 175.32 2yue n TYR 115 N 3.93 -0.13 -3.99 -3.49 4.11 0.18 -2.98 117.16 114.80 2yue n TYR 115 Ca -0.21 -0.73 -0.13 0.00 -0.00 0.00 0.00 57.90 56.83 2yue n TYR 115 Cb 0.55 0.05 -0.13 0.00 -0.00 0.00 0.00 39.34 39.81 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 -2.22 0.19 0.60 -3.48 0.11 -1.14 -0.10 120.40 114.36 2yue s VAL 116 Ca 0.09 -0.34 0.02 0.00 -2.93 0.00 0.00 61.98 58.82 2yue s VAL 116 Cb 0.00 -0.21 0.12 0.00 -1.53 0.00 0.00 36.38 34.76 2yue s VAL 116 CO 0.06 -0.10 0.83 -0.46 -3.33 0.00 0.00 175.10 172.10 2yue n ASN 117 N 2.60 1.36 0.00 3.54 0.23 -0.41 -3.40 115.26 119.18 2yue n ASN 117 Ca -0.16 -2.09 0.07 0.00 -0.53 0.00 0.00 54.58 51.88 2yue n ASN 117 Cb 0.58 -0.51 0.34 0.00 -2.08 0.00 0.00 39.78 38.10 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 -1.57 -0.97 1.83 4.83 0.00 -1.26 -2.57 105.19 105.48 2yue n GLY 118 Ca 0.14 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.45 4.47 -2.20 4.61 0.00 -1.26 -4.87 120.51 119.81 2yue n ALA 119 Ca 0.04 -1.98 -0.13 0.00 0.00 0.00 0.00 53.44 51.37 2yue n ALA 119 Cb 0.16 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.33 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 -0.38 -0.11 3.38 0.00 0.00 -1.06 -4.93 105.19 102.09 2yue n GLY 120 Ca 0.38 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.04 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 4.87 -0.36 1.61 1.01 -1.26 -3.36 116.67 117.14 2yue s ASP 121 Ca 0.00 -0.40 -0.19 0.00 0.71 0.00 0.00 52.55 52.68 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 -0.07 0.54 -0.69 0.21 0.00 0.00 175.17 175.15 2yue s VAL 122 N 1.54 4.99 0.02 -1.27 1.01 0.88 -1.29 120.40 126.28 2yue s VAL 122 Ca 0.05 0.35 0.02 0.00 0.00 0.00 0.00 61.98 62.40 2yue s VAL 122 Cb -0.15 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2yue s VAL 122 CO 0.01 -0.25 0.01 -0.63 0.00 0.00 0.00 175.10 174.24 2yue s ILE 123 N 2.45 4.17 0.41 2.22 1.09 0.86 -0.66 121.20 131.74 2yue s ILE 123 Ca 0.20 -0.67 0.06 0.00 -1.10 0.00 0.00 60.65 59.14 2yue s ILE 123 Cb -0.15 -2.89 -0.07 0.00 -1.06 0.00 0.00 42.46 38.28 2yue s ILE 123 CO 0.14 0.32 0.02 -0.72 -0.10 0.00 0.00 174.94 174.59 2yue s TYR 124 N -1.14 2.40 -0.24 3.97 1.13 -1.25 -0.65 117.35 121.57 2yue s TYR 124 Ca 0.21 -0.73 -0.32 0.00 -1.41 0.00 0.00 57.07 54.82 2yue s TYR 124 Cb -0.12 -1.71 0.16 0.00 -1.10 0.00 0.00 41.96 39.20 2yue s TYR 124 CO 0.12 0.38 1.26 0.20 -2.51 0.00 0.00 175.55 175.01 2yue s GLY 125 N -3.70 -0.10 -0.10 5.49 0.00 0.85 -2.86 107.32 106.90 2yue s GLY 125 Ca 0.32 2.28 0.00 0.00 0.00 0.00 0.00 44.72 47.33 2yue s GLY 125 CO 0.16 0.89 -0.10 -0.42 0.00 0.00 0.00 173.10 173.64 2yue s ILE 126 N -1.52 3.38 0.00 0.90 -1.09 -1.26 -0.98 121.20 120.63 2yue s ILE 126 Ca 0.08 -0.57 0.00 0.00 -2.23 0.00 0.00 60.65 57.93 2yue s ILE 126 Cb -0.01 -2.40 0.00 0.00 -1.58 0.00 0.00 42.46 38.47 2yue s ILE 126 CO -0.05 0.55 0.00 0.59 -1.23 0.00 0.00 174.94 174.80 2yue n ASN 127 N 2.93 0.00 -2.67 3.58 3.02 -0.35 -2.90 115.26 118.87 2yue n ASN 127 Ca -0.18 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.33 2yue n ASN 127 Cb 0.53 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.72 2yue n ASN 127 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2yue n ASN 128 N 2.42 -1.27 -3.29 6.41 2.85 -1.26 -5.01 115.26 116.10 2yue n ASN 128 Ca 0.00 -1.83 -0.09 0.00 -0.11 0.00 0.00 54.58 52.55 2yue n ASN 128 Cb 0.00 1.06 -0.05 0.00 1.24 0.00 0.00 39.78 42.03 2yue n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2yue s GLU 129 N 0.06 0.72 0.75 1.20 2.02 -1.14 -5.15 118.70 117.16 2yue s GLU 129 Ca 0.09 -0.58 -0.15 0.00 0.02 0.00 0.00 54.97 54.34 2yue s GLU 129 Cb 0.15 -0.35 0.04 0.00 0.10 0.00 0.00 34.13 34.07 2yue s GLU 129 CO -0.06 -1.19 1.17 -0.85 0.02 0.00 0.00 175.26 174.36 2yue n GLU 130 N 4.33 0.50 -0.02 1.61 0.00 -1.26 -4.03 120.64 121.77 2yue n GLU 130 Ca 0.11 0.24 -0.00 0.00 0.00 0.00 0.00 57.16 57.51 2yue n GLU 130 Cb 0.51 -2.42 -0.05 0.00 0.00 0.00 0.00 31.44 29.48 2yue n GLU 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2yue n LYS 131 N -2.60 1.77 0.00 3.44 4.76 -1.13 -5.00 118.16 119.40 2yue n LYS 131 Ca 0.14 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 2yue n LYS 131 Cb 0.50 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 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 2.39 3.28 3.68 0.72 0.00 -1.26 -5.07 105.19 108.92 2yue n GLY 132 Ca -0.07 -1.79 -0.47 0.00 0.00 0.00 0.00 46.02 43.70 2yue n GLY 132 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2yue n VAL 133 N -1.76 0.32 -0.07 1.61 3.14 -1.26 -3.87 118.33 116.43 2yue n VAL 133 Ca 0.00 -0.06 -0.08 0.00 -2.96 0.00 0.00 64.34 61.24 2yue n VAL 133 Cb 0.00 -1.75 -0.09 0.00 -1.06 0.00 0.00 33.84 30.94 2yue n VAL 133 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2yue n ILE 134 N 4.36 0.90 -4.85 1.55 3.06 0.16 -4.96 119.36 119.59 2yue n ILE 134 Ca 0.20 -0.46 -0.25 0.00 -2.50 0.00 0.00 62.75 59.73 2yue n ILE 134 Cb 0.30 -0.83 -0.15 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 -5.36 2.03 0.35 9.51 2.96 -0.94 -4.98 118.68 122.24 2yue s LEU 135 Ca -0.13 -0.32 0.05 0.00 -0.22 0.00 0.00 54.13 53.51 2yue s LEU 135 Cb 0.05 -0.92 -0.03 0.00 0.50 0.00 0.00 46.19 45.79 2yue s LEU 135 CO 0.46 0.21 0.18 0.42 -1.32 0.00 0.00 176.35 176.31 2yue s THR 136 N -0.39 0.34 0.00 3.68 -4.23 -1.26 -0.08 115.64 113.70 2yue s THR 136 Ca 0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 2yue s THR 136 Cb -0.07 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.33 2yue s THR 136 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 2yue n GLY 137 N -0.72 0.76 3.77 3.99 0.00 -1.22 -5.00 105.19 106.77 2yue n GLY 137 Ca 0.00 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 4.78 -0.05 -0.61 1.09 -1.21 -4.98 121.20 118.21 2yue s ILE 138 Ca 0.00 1.34 -0.11 0.00 -1.10 0.00 0.00 60.65 60.78 2yue s ILE 138 Cb 0.00 -3.97 -0.05 0.00 -1.06 0.00 0.00 42.46 37.38 2yue s ILE 138 CO 0.00 0.46 0.29 -0.62 -0.10 0.00 0.00 174.94 174.97 2yue s ASP 139 N -0.52 6.63 -0.51 3.58 -1.08 -1.26 -4.30 116.67 119.20 2yue s ASP 139 Ca 0.32 0.75 0.03 0.00 -0.52 0.00 0.00 52.55 53.12 2yue s ASP 139 Cb -0.19 -2.17 0.43 0.00 -1.46 0.00 0.00 42.92 39.53 2yue s ASP 139 CO 0.19 0.36 1.55 0.35 0.52 0.00 0.00 175.17 178.14 2yue n THR 140 N 1.93 2.99 -0.06 1.71 -2.24 -1.26 -4.63 114.28 112.72 2yue n THR 140 Ca -0.16 -3.97 -0.12 0.00 -2.27 0.00 0.00 64.05 57.53 2yue n THR 140 Cb 0.53 -1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 67.54 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 -0.71 0.30 -3.56 -0.78 5.12 -1.26 -5.07 116.66 110.70 2yue n ARG 141 Ca 0.50 0.13 -0.24 0.00 -1.93 0.00 0.00 57.85 56.32 2yue n ARG 141 Cb 0.72 -1.02 0.02 0.00 -1.16 0.00 0.00 32.46 31.02 2yue n ARG 141 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2yue s SER 142 N -6.21 4.81 1.03 0.55 0.15 -1.26 -5.10 113.70 107.68 2yue s SER 142 Ca -0.19 -1.09 -0.16 0.00 0.70 0.00 0.00 55.95 55.21 2yue s SER 142 Cb 0.06 0.37 0.07 0.00 -1.71 0.00 0.00 66.02 64.80 2yue s SER 142 CO 0.25 -1.19 0.19 0.18 1.20 0.00 0.00 173.24 173.87 2yue n LEU 143 N -1.94 -1.32 -3.74 3.45 4.77 -1.26 -5.04 117.00 111.92 2yue n LEU 143 Ca 0.05 0.11 -0.13 0.00 -0.03 0.00 0.00 56.01 56.01 2yue n LEU 143 Cb 0.63 -1.08 -0.10 0.00 -2.33 0.00 0.00 43.42 40.54 2yue n LEU 143 CO 0.39 -3.40 0.06 -0.76 -1.33 0.00 0.00 177.39 172.35 2yue s LEU 144 N -1.05 0.53 0.13 2.23 1.43 -1.26 -4.90 118.68 115.79 2yue s LEU 144 Ca 0.56 0.77 0.09 0.00 -1.03 0.00 0.00 54.13 54.52 2yue s LEU 144 Cb -0.16 1.32 -0.04 0.00 0.03 0.00 0.00 46.19 47.34 2yue s LEU 144 CO 0.67 -0.14 -0.21 0.26 0.23 0.00 0.00 176.35 177.16 2yue s TRP 145 N 0.19 1.88 0.42 0.29 0.51 -1.07 -2.11 118.94 119.04 2yue s TRP 145 Ca -0.00 -0.42 0.00 0.00 -2.12 0.00 0.00 56.10 53.55 2yue s TRP 145 Cb -0.03 -1.00 -0.02 0.00 -0.81 0.00 0.00 33.47 31.62 2yue s TRP 145 CO 0.01 0.27 0.63 0.95 -0.51 0.00 0.00 176.95 178.30 2yue s THR 146 N -1.42 4.43 -0.02 2.01 -4.23 -1.26 -0.53 115.64 114.62 2yue s THR 146 Ca 0.10 -0.45 -0.05 0.00 -1.18 0.00 0.00 61.69 60.12 2yue s THR 146 Cb -0.09 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.12 2yue s THR 146 CO 0.05 -0.44 0.11 0.68 -0.54 0.00 0.00 174.62 174.48 2yue s VAL 147 N -2.48 0.04 -0.12 2.29 -7.23 0.51 -1.99 120.40 111.42 2yue s VAL 147 Ca 0.45 -0.34 -0.06 0.00 -1.81 0.00 0.00 61.98 60.23 2yue s VAL 147 Cb -0.10 -0.28 0.05 0.00 0.56 0.00 0.00 36.38 36.62 2yue s VAL 147 CO 0.38 -0.19 0.28 -0.63 -0.31 0.00 0.00 175.10 174.63 2yue s ILE 148 N -0.60 -0.10 -0.25 -0.62 1.01 0.66 -1.02 121.20 120.28 2yue s ILE 148 Ca -0.07 0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.68 2yue s ILE 148 Cb -0.04 -0.43 -0.01 0.00 0.01 0.00 0.00 42.46 41.99 2yue s ILE 148 CO 0.01 0.06 0.04 -0.62 0.00 0.00 0.00 174.94 174.43 2yue s ASP 149 N 1.45 4.89 -0.73 3.58 -1.08 0.25 -0.12 116.67 124.92 2yue s ASP 149 Ca -0.08 -0.42 -0.10 0.00 -0.52 0.00 0.00 52.55 51.44 2yue s ASP 149 Cb -0.10 -1.86 0.19 0.00 -1.46 0.00 0.00 42.92 39.69 2yue s ASP 149 CO -0.09 -0.08 0.62 0.27 0.52 0.00 0.00 175.17 176.40 2yue s ILE 150 N 1.54 4.82 -0.38 4.11 -0.00 -0.19 -3.52 121.20 127.58 2yue s ILE 150 Ca 0.05 -2.60 0.02 0.00 -0.00 0.00 0.00 60.65 58.12 2yue s ILE 150 Cb -0.15 -4.04 0.15 0.00 -0.00 0.00 0.00 42.46 38.42 2yue s ILE 150 CO 0.01 -0.96 0.31 -0.47 -0.00 0.00 0.00 174.94 173.84 2yue s TYR 151 N 0.17 0.42 0.00 1.37 5.04 -1.26 -4.75 117.35 118.34 2yue s TYR 151 Ca 0.17 -1.53 0.00 0.00 -2.44 0.00 0.00 57.07 53.27 2yue s TYR 151 Cb -0.15 -0.71 0.00 0.00 0.35 0.00 0.00 41.96 41.44 2yue s TYR 151 CO -0.06 -0.89 0.00 0.41 -1.34 0.00 0.00 175.55 173.67 2yue n GLY 152 N 3.75 0.42 0.00 8.97 0.00 -1.26 -4.77 105.19 112.30 2yue n GLY 152 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 -4.67 1.61 2.85 -1.16 -4.57 115.26 109.32 2yue n ASN 153 Ca 0.00 0.79 -0.50 0.00 -0.11 0.00 0.00 54.58 54.77 2yue n ASN 153 Cb 0.00 -0.29 -0.05 0.00 1.24 0.00 0.00 39.78 40.67 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 4.25 0.48 -3.84 0.00 -2.24 -1.03 -4.39 114.28 107.51 2yue n THR 155 Ca 0.21 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 2yue n THR 155 Cb 0.25 -0.49 -0.13 0.00 -2.10 0.00 0.00 70.33 67.85 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 -3.89 -0.06 -0.04 3.38 0.00 -0.93 -1.77 107.32 104.01 2yue s GLY 156 Ca -0.04 0.24 0.01 0.00 0.00 0.00 0.00 44.72 44.93 2yue s GLY 156 CO 0.39 0.21 -0.06 -0.26 0.00 0.00 0.00 173.10 173.38 2yue s ILE 157 N 0.05 0.59 -0.14 0.90 -4.36 0.76 -3.17 121.20 115.84 2yue s ILE 157 Ca -0.00 -0.20 0.02 0.00 -0.26 0.00 0.00 60.65 60.21 2yue s ILE 157 Cb -0.01 -0.58 0.02 0.00 1.25 0.00 0.00 42.46 43.14 2yue s ILE 157 CO 0.00 0.22 -0.18 -0.70 0.24 0.00 0.00 174.94 174.52 2yue s GLU 158 N 0.62 2.61 0.13 0.37 2.12 -0.43 -0.21 118.70 123.91 2yue s GLU 158 Ca -0.09 -0.69 -0.30 0.00 0.36 0.00 0.00 54.97 54.25 2yue s GLU 158 Cb -0.12 -2.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.99 2yue s GLU 158 CO 0.00 -0.11 1.05 -0.06 -0.54 0.00 0.00 175.26 175.61 2yue s PHE 159 N 1.09 3.66 0.35 5.30 0.40 -1.25 -0.02 117.98 127.52 2yue s PHE 159 Ca -0.02 1.64 0.08 0.00 -0.60 0.00 0.00 56.93 58.03 2yue s PHE 159 Cb -0.14 -3.20 -0.03 0.00 0.51 0.00 0.00 43.02 40.15 2yue s PHE 159 CO -0.06 -0.35 0.25 -0.51 0.70 0.00 0.00 175.22 175.25 2yue s LEU 160 N 0.04 3.43 -0.61 -0.37 1.43 -0.33 -4.90 118.68 117.36 2yue s LEU 160 Ca 0.50 -0.66 -0.26 0.00 -1.03 0.00 0.00 54.13 52.68 2yue s LEU 160 Cb -0.27 -1.98 0.04 0.00 0.03 0.00 0.00 46.19 44.01 2yue s LEU 160 CO 0.32 -0.38 1.10 -0.62 0.23 0.00 0.00 176.35 177.00 2yue s ASP 161 N -3.96 6.34 0.53 2.29 -1.08 -1.26 -4.26 116.67 115.27 2yue s ASP 161 Ca 0.41 -0.24 0.30 0.00 -0.52 0.00 0.00 52.55 52.49 2yue s ASP 161 Cb -0.04 -2.50 1.45 0.00 -1.46 0.00 0.00 42.92 40.37 2yue s ASP 161 CO 0.25 -1.46 1.92 0.77 0.52 0.00 0.00 175.17 177.17 2yue h SER 162 N 9.55 0.01 -0.54 -0.34 4.64 -1.91 0.18 113.55 125.14 2yue h SER 162 Ca -0.26 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.22 2yue h SER 162 Cb 1.06 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2yue h SER 162 CO 1.17 0.01 0.44 0.03 -0.87 0.00 0.00 176.83 177.61 2yue h ARG 163 N 0.01 0.00 -0.10 4.77 3.08 -1.90 0.66 114.38 120.90 2yue h ARG 163 Ca 0.38 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.21 2yue h ARG 163 Cb 1.51 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.58 2yue h ARG 163 CO -0.01 0.00 -0.82 0.82 -1.07 0.00 0.00 179.97 178.89 2yue h ILE 164 N 0.00 1.29 -0.99 2.04 2.04 -1.05 -3.21 117.51 117.63 2yue h ILE 164 Ca 0.26 -2.04 -0.52 0.00 1.00 0.00 0.00 64.86 63.56 2yue h ILE 164 Cb 1.13 2.14 -0.31 0.00 -0.74 0.00 0.00 36.82 39.05 2yue h ILE 164 CO -0.00 0.64 0.66 -1.22 0.00 0.00 0.00 178.15 178.22 2yue n TYR 165 N -3.96 3.06 -4.24 1.37 4.02 0.07 -4.94 117.16 112.54 2yue n TYR 165 Ca -0.09 -1.85 -0.18 0.00 -0.01 0.00 0.00 57.90 55.78 2yue n TYR 165 Cb 0.77 -0.95 -0.07 0.00 -0.02 0.00 0.00 39.34 39.07 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 -3.28 1.76 0.00 -0.72 -1.94 -0.29 -5.04 119.30 109.80 2yue s MET 166 Ca 0.57 -1.95 0.00 0.00 -1.71 0.00 0.00 55.69 52.60 2yue s MET 166 Cb 0.48 0.35 0.00 0.00 2.01 0.00 0.00 34.83 37.66 2yue s MET 166 CO 0.11 -0.67 0.00 0.66 -0.01 0.00 0.00 175.02 175.11 2yue n TYR 167 N -0.59 0.00 1.80 -0.03 4.02 -1.26 -4.91 117.16 116.18 2yue n TYR 167 Ca 0.06 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.10 2yue n TYR 167 Cb 0.62 0.09 0.78 0.00 -0.02 0.00 0.00 39.34 40.81 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79