#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 6.25 -0.29 1.61 1.04 -1.26 -4.99 113.70 116.06 2yue s SER 2 Ca 0.00 -1.22 -0.28 0.00 0.48 0.00 0.00 55.95 54.93 2yue s SER 2 Cb 0.00 -2.40 -0.04 0.00 0.10 0.00 0.00 66.02 63.68 2yue s SER 2 CO 0.00 -1.34 2.11 -0.44 0.98 0.00 0.00 173.24 174.55 2yue s SER 3 N 3.68 5.45 0.00 7.02 0.01 -1.26 -4.93 113.70 123.67 2yue s SER 3 Ca 0.23 1.59 0.00 0.00 1.31 0.00 0.00 55.95 59.08 2yue s SER 3 Cb -0.16 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2yue s SER 3 CO 0.06 -2.01 0.00 0.61 0.41 0.00 0.00 173.24 172.31 2yue n GLY 4 N 5.70 1.59 3.54 3.44 0.00 -1.26 -4.93 105.19 113.28 2yue n GLY 4 Ca 0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.06 2yue n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yue n SER 5 N 0.00 -5.82 -1.23 1.61 7.64 -1.26 -4.68 113.62 109.88 2yue n SER 5 Ca 0.00 -0.85 0.16 0.00 1.01 0.00 0.00 58.87 59.19 2yue n SER 5 Cb 0.00 -3.79 -0.04 0.00 -1.01 0.00 0.00 64.21 59.37 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 -2.67 -7.30 0.00 6.43 7.64 -1.26 -4.98 113.62 111.48 2yue n SER 6 Ca -0.09 1.30 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2yue n SER 6 Cb 0.59 -3.66 0.00 0.00 -1.01 0.00 0.00 64.21 60.13 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 -3.70 1.92 3.66 0.23 0.00 -1.26 -5.04 105.19 101.00 2yue n GLY 7 Ca 0.01 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 2yue n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yue s PRO 8 N 0.00 0.08 -0.14 1.61 0.04 -1.26 -5.04 135.00 130.29 2yue s PRO 8 Ca 0.00 0.40 -0.08 0.00 0.04 0.00 0.00 61.00 61.36 2yue s PRO 8 Cb 0.00 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 2yue s PRO 8 CO 0.00 -2.94 0.14 -1.17 0.04 0.00 0.00 177.00 173.06 2yue s LEU 9 N -6.56 4.34 0.37 -3.56 2.96 -1.26 -5.04 118.68 109.92 2yue s LEU 9 Ca 0.66 0.41 0.07 0.00 -0.22 0.00 0.00 54.13 55.06 2yue s LEU 9 Cb -0.17 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 2yue s LEU 9 CO 0.57 0.36 0.25 -1.10 -1.32 0.00 0.00 176.35 175.12 2yue s GLN 10 N -0.73 1.86 0.34 1.98 -0.21 -1.26 -4.81 119.66 116.83 2yue s GLN 10 Ca 0.13 -2.11 -0.12 0.00 0.02 0.00 0.00 55.36 53.29 2yue s GLN 10 Cb -0.12 0.08 -0.08 0.00 1.00 0.00 0.00 33.01 33.90 2yue s GLN 10 CO 0.03 -0.64 0.71 -0.06 -2.12 0.00 0.00 175.29 173.21 2yue s PHE 11 N -3.33 3.42 0.42 0.91 0.08 -1.26 -1.95 117.98 116.28 2yue s PHE 11 Ca 0.35 1.07 -0.10 0.00 0.12 0.00 0.00 56.93 58.38 2yue s PHE 11 Cb 0.02 -2.44 -0.06 0.00 -0.57 0.00 0.00 43.02 39.97 2yue s PHE 11 CO 0.25 0.05 0.78 -1.58 -0.10 0.00 0.00 175.22 174.62 2yue s HIS 12 N -2.11 3.49 0.46 0.36 2.46 -1.07 -4.40 115.29 114.48 2yue s HIS 12 Ca 0.52 1.03 0.12 0.00 0.47 0.00 0.00 55.06 57.20 2yue s HIS 12 Cb -0.10 -2.44 1.05 0.00 -0.13 0.00 0.00 32.58 30.95 2yue s HIS 12 CO 0.24 -0.15 2.08 0.66 -2.47 0.00 0.00 174.74 175.09 2yue h SER 13 N 1.08 0.27 -2.98 9.88 4.64 -1.92 -3.41 113.55 121.11 2yue h SER 13 Ca -0.47 -0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.29 2yue h SER 13 Cb 1.19 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 2yue h SER 13 CO 0.63 0.19 0.81 0.54 -0.87 0.00 0.00 176.83 178.14 2yue s VAL 14 N -5.31 4.22 -0.05 0.95 0.11 -1.26 -4.97 120.40 114.09 2yue s VAL 14 Ca -0.07 1.51 -0.31 0.00 -2.93 0.00 0.00 61.98 60.18 2yue s VAL 14 Cb 0.18 -3.97 0.13 0.00 -1.53 0.00 0.00 36.38 31.18 2yue s VAL 14 CO 0.71 -0.07 1.30 -1.38 -3.33 0.00 0.00 175.10 172.34 2yue s HIS 15 N 2.87 -0.05 0.15 1.54 -0.00 -1.26 -3.77 115.29 114.77 2yue s HIS 15 Ca 0.56 -0.04 -0.34 0.00 -0.00 0.00 0.00 55.06 55.24 2yue s HIS 15 Cb -0.24 0.54 -0.15 0.00 -0.00 0.00 0.00 32.58 32.73 2yue s HIS 15 CO 0.19 -0.23 1.43 0.41 -0.00 0.00 0.00 174.74 176.54 2yue n GLY 16 N -0.44 0.74 0.33 -1.38 0.00 0.08 -4.82 105.19 99.70 2yue n GLY 16 Ca -0.08 0.64 0.18 0.00 0.00 0.00 0.00 46.02 46.76 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 4.95 0.00 -0.62 1.61 1.82 -1.93 0.15 116.42 122.41 2yue h ASP 17 Ca -0.46 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 55.97 2yue h ASP 17 Cb 1.29 0.00 -0.13 0.00 0.68 0.00 0.00 39.33 41.18 2yue h ASP 17 CO 0.81 0.00 0.27 0.59 -1.61 0.00 0.00 179.24 179.30 2yue n ASN 18 N -3.56 4.14 -3.94 2.28 3.02 -1.26 -4.81 115.26 111.13 2yue n ASN 18 Ca -0.00 -3.00 -0.30 0.00 -0.03 0.00 0.00 54.58 51.24 2yue n ASN 18 Cb 0.26 -0.71 -0.16 0.00 -0.61 0.00 0.00 39.78 38.56 2yue n ASN 18 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2yue s ILE 19 N -2.48 1.49 -0.39 2.41 -1.09 0.53 -1.08 121.20 120.58 2yue s ILE 19 Ca 0.44 -1.12 -0.23 0.00 -2.23 0.00 0.00 60.65 57.51 2yue s ILE 19 Cb 0.35 -1.72 0.01 0.00 -1.58 0.00 0.00 42.46 39.52 2yue s ILE 19 CO 0.10 -0.04 0.78 -0.13 -1.23 0.00 0.00 174.94 174.42 2yue s ARG 20 N 1.43 3.65 -0.41 2.79 3.00 0.84 -4.82 118.95 125.43 2yue s ARG 20 Ca -0.04 0.18 -0.05 0.00 0.00 0.00 0.00 55.73 55.82 2yue s ARG 20 Cb -0.18 -3.84 0.10 0.00 0.00 0.00 0.00 34.95 31.02 2yue s ARG 20 CO -0.07 -0.92 0.22 0.42 0.00 0.00 0.00 175.30 174.95 2yue s ILE 21 N 3.14 3.60 -0.29 1.52 1.01 -1.26 -1.08 121.20 127.84 2yue s ILE 21 Ca 0.31 -1.80 -0.16 0.00 0.00 0.00 0.00 60.65 58.99 2yue s ILE 21 Cb -0.13 -3.35 0.13 0.00 0.01 0.00 0.00 42.46 39.12 2yue s ILE 21 CO 0.18 -0.60 0.89 -0.55 0.00 0.00 0.00 174.94 174.86 2yue s SER 22 N 1.96 -0.65 0.30 3.58 0.15 -0.89 -4.96 113.70 113.20 2yue s SER 22 Ca 0.05 1.03 -0.18 0.00 0.70 0.00 0.00 55.95 57.55 2yue s SER 22 Cb -0.23 1.28 0.02 0.00 -1.71 0.00 0.00 66.02 65.38 2yue s SER 22 CO -0.02 -0.16 0.68 -0.60 1.20 0.00 0.00 173.24 174.34 2yue s ARG 23 N 1.46 1.83 0.59 5.44 3.52 -1.26 -4.74 118.95 125.79 2yue s ARG 23 Ca -0.09 -1.15 0.29 0.00 -0.13 0.00 0.00 55.73 54.64 2yue s ARG 23 Cb -0.04 0.58 1.66 0.00 -1.56 0.00 0.00 34.95 35.59 2yue s ARG 23 CO -0.16 -0.83 2.11 0.22 -0.81 0.00 0.00 175.30 175.82 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 1.82 -2.03 -3.37 116.42 112.77 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 -0.13 0.61 -1.61 0.00 0.00 179.24 178.40 2yue n GLY 25 N -1.40 -0.14 0.00 -0.78 0.00 -1.26 -4.99 105.19 96.61 2yue n GLY 25 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.20 0.00 -3.60 2.61 5.66 -1.26 -5.04 114.28 109.45 2yue n THR 26 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 2yue n THR 26 Cb 0.06 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.78 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 -0.63 -0.21 1.09 0.20 -1.26 -4.04 118.68 113.83 2yue s LEU 27 Ca 0.00 1.04 -0.00 0.00 0.69 0.00 0.00 54.13 55.86 2yue s LEU 27 Cb 0.00 2.31 0.02 0.00 -0.43 0.00 0.00 46.19 48.09 2yue s LEU 27 CO 0.00 -0.33 -0.14 0.00 -0.29 0.00 0.00 176.35 175.59 2yue s ALA 28 N -0.21 2.50 -0.04 5.97 0.00 0.59 -2.09 121.76 128.48 2yue s ALA 28 Ca -0.02 -1.30 0.05 0.00 0.00 0.00 0.00 51.96 50.68 2yue s ALA 28 Cb -0.03 -1.40 -0.01 0.00 0.00 0.00 0.00 23.12 21.68 2yue s ALA 28 CO 0.02 -0.52 -0.19 -0.98 0.00 0.00 0.00 175.76 174.09 2yue s ARG 29 N 1.31 1.85 0.36 0.00 1.70 -0.24 -0.25 118.95 123.69 2yue s ARG 29 Ca 0.03 -0.68 -0.25 0.00 -0.47 0.00 0.00 55.73 54.36 2yue s ARG 29 Cb -0.14 -1.64 -0.09 0.00 -0.57 0.00 0.00 34.95 32.50 2yue s ARG 29 CO -0.09 0.31 1.03 -0.98 -1.08 0.00 0.00 175.30 174.49 2yue s ARG 30 N -0.12 4.34 -0.47 3.89 1.70 -0.34 -0.11 118.95 127.84 2yue s ARG 30 Ca -0.01 1.51 0.03 0.00 -0.47 0.00 0.00 55.73 56.80 2yue s ARG 30 Cb -0.11 -2.70 0.57 0.00 -0.57 0.00 0.00 34.95 32.14 2yue s ARG 30 CO 0.02 0.01 1.83 0.34 -1.08 0.00 0.00 175.30 176.41 2yue n PHE 31 N 0.27 2.73 -1.18 5.89 7.35 -0.24 -4.75 117.46 127.53 2yue n PHE 31 Ca 0.03 -2.15 0.00 0.00 -0.76 0.00 0.00 57.45 54.58 2yue n PHE 31 Cb 0.49 -0.97 0.00 0.00 0.35 0.00 0.00 39.48 39.35 2yue n PHE 31 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2yue n GLU 32 N -1.06 -3.21 -3.02 -4.13 -0.00 -1.26 -4.97 120.64 102.98 2yue n GLU 32 Ca 0.55 2.45 0.00 0.00 -0.00 0.00 0.00 57.16 60.16 2yue n GLU 32 Cb 1.25 -2.94 0.00 0.00 -0.00 0.00 0.00 31.44 29.74 2yue n GLU 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2yue n SER 33 N -1.78 0.00 -0.02 -1.84 2.88 -1.26 -4.92 113.62 106.68 2yue n SER 33 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2yue n SER 33 Cb 0.22 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.62 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 0.22 0.00 -3.98 0.66 3.72 -1.26 -5.10 117.46 111.72 2yue n PHE 34 Ca 0.00 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.42 2yue n PHE 34 Cb 0.00 -0.26 0.01 0.00 -0.94 0.00 0.00 39.48 38.29 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 -0.85 -2.80 -3.24 0.00 3.00 -0.45 -4.93 116.66 107.39 2yue n ARG 36 Ca 0.03 2.34 -0.07 0.00 -0.01 0.00 0.00 57.85 60.15 2yue n ARG 36 Cb 0.56 -4.72 -0.04 0.00 0.00 0.00 0.00 32.46 28.26 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 -1.51 -1.54 0.07 7.54 0.00 -1.26 -4.50 121.76 120.56 2yue s ALA 37 Ca 0.03 -0.34 0.05 0.00 0.00 0.00 0.00 51.96 51.70 2yue s ALA 37 Cb -0.01 -2.46 -0.03 0.00 0.00 0.00 0.00 23.12 20.62 2yue s ALA 37 CO 0.65 -2.19 -0.15 0.42 0.00 0.00 0.00 175.76 174.50 2yue s ILE 38 N 1.57 1.15 0.05 0.00 1.01 -1.26 -2.86 121.20 120.86 2yue s ILE 38 Ca 0.18 -1.32 0.03 0.00 0.00 0.00 0.00 60.65 59.54 2yue s ILE 38 Cb -0.08 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.27 2yue s ILE 38 CO -0.05 -0.21 -0.10 0.42 0.00 0.00 0.00 174.94 174.99 2yue s THR 39 N -1.26 0.75 0.39 2.92 -4.23 0.80 -0.74 115.64 114.28 2yue s THR 39 Ca -0.01 -1.12 0.04 0.00 -1.18 0.00 0.00 61.69 59.42 2yue s THR 39 Cb -0.10 -0.77 -0.05 0.00 1.34 0.00 0.00 72.50 72.91 2yue s THR 39 CO 0.02 -0.30 0.05 -0.36 -0.54 0.00 0.00 174.62 173.50 2yue s PHE 40 N -1.28 2.08 0.25 3.99 0.40 -1.25 -0.18 117.98 121.99 2yue s PHE 40 Ca -0.06 -0.93 -0.25 0.00 -0.60 0.00 0.00 56.93 55.08 2yue s PHE 40 Cb -0.10 -1.45 -0.09 0.00 0.51 0.00 0.00 43.02 41.90 2yue s PHE 40 CO 0.01 0.12 0.85 -1.54 0.70 0.00 0.00 175.22 175.36 2yue s SER 41 N -3.62 7.35 0.13 1.36 1.04 -0.95 -2.60 113.70 116.40 2yue s SER 41 Ca 0.30 1.72 -0.13 0.00 0.48 0.00 0.00 55.95 58.32 2yue s SER 41 Cb 0.07 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.63 2yue s SER 41 CO 0.14 0.07 1.52 0.00 0.98 0.00 0.00 173.24 175.95 2yue h ALA 42 N 3.70 0.57 -2.92 5.32 0.00 -1.60 -3.38 119.26 120.94 2yue h ALA 42 Ca -0.47 -0.34 -0.46 0.00 0.00 0.00 0.00 54.91 53.64 2yue h ALA 42 Cb 1.20 -0.14 -0.18 0.00 0.00 0.00 0.00 17.79 18.66 2yue h ALA 42 CO 0.66 0.48 -0.77 -0.98 0.00 0.00 0.00 179.25 178.64 2yue s ARG 43 N -4.72 1.11 -0.14 0.00 1.70 -1.26 -4.84 118.95 110.81 2yue s ARG 43 Ca -0.12 -1.29 -0.29 0.00 -0.47 0.00 0.00 55.73 53.55 2yue s ARG 43 Cb 0.10 -1.06 -0.04 0.00 -0.57 0.00 0.00 34.95 33.39 2yue s ARG 43 CO 0.83 0.21 1.55 -1.25 -1.08 0.00 0.00 175.30 175.56 2yue s PRO 44 N -2.69 4.06 0.20 3.89 0.04 -1.26 -4.83 135.00 134.42 2yue s PRO 44 Ca 0.11 1.89 -0.13 0.00 0.04 0.00 0.00 61.00 62.91 2yue s PRO 44 Cb -0.05 -3.95 -0.07 0.00 0.04 0.00 0.00 34.50 30.46 2yue s PRO 44 CO 0.04 -0.96 0.59 0.14 0.04 0.00 0.00 177.00 176.85 2yue s VAL 45 N 4.30 4.83 0.86 -0.36 -7.23 -0.99 -4.92 120.40 116.89 2yue s VAL 45 Ca 0.68 0.76 -0.13 0.00 -1.81 0.00 0.00 61.98 61.48 2yue s VAL 45 Cb -0.28 -3.69 0.12 0.00 0.56 0.00 0.00 36.38 33.10 2yue s VAL 45 CO 0.26 0.08 1.23 -0.13 -0.31 0.00 0.00 175.10 176.23 2yue s ARG 46 N -2.39 1.47 0.02 4.82 0.52 -1.26 -4.29 118.95 117.84 2yue s ARG 46 Ca 0.44 -0.10 -0.11 0.00 -0.52 0.00 0.00 55.73 55.44 2yue s ARG 46 Cb -0.13 -1.92 -0.06 0.00 0.52 0.00 0.00 34.95 33.36 2yue s ARG 46 CO 0.20 -1.90 1.17 0.82 0.02 0.00 0.00 175.30 175.62 2yue h ILE 47 N -1.27 0.00 0.00 1.52 1.08 -1.95 -2.72 117.51 114.17 2yue h ILE 47 Ca -0.45 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 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 0.55 0.00 0.00 0.78 -0.69 0.00 0.00 178.15 178.79 2yue h ASN 48 N -0.37 0.00 -1.03 1.72 -0.26 -1.90 -3.03 115.58 110.70 2yue h ASN 48 Ca -0.03 0.00 -0.54 0.00 -0.56 0.00 0.00 56.30 55.17 2yue h ASN 48 Cb 0.30 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.54 2yue h ASN 48 CO 0.03 0.00 1.60 1.21 -1.06 0.00 0.00 177.43 179.21 2yue n GLU 49 N -2.87 0.81 -2.36 0.81 2.13 -1.03 -4.84 120.64 113.29 2yue n GLU 49 Ca -0.00 0.10 -0.41 0.00 0.66 0.00 0.00 57.16 57.51 2yue n GLU 49 Cb 0.20 -2.62 -0.03 0.00 0.27 0.00 0.00 31.44 29.25 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 7.77 4.51 -0.25 5.31 6.06 -1.26 -4.68 118.95 136.42 2yue s ARG 50 Ca 1.12 1.91 0.03 0.00 -2.50 0.00 0.00 55.73 56.29 2yue s ARG 50 Cb -0.68 -3.20 0.05 0.00 0.06 0.00 0.00 34.95 31.19 2yue s ARG 50 CO 0.40 -0.02 -0.12 0.42 -2.50 0.00 0.00 175.30 173.48 2yue s ILE 51 N -0.56 2.14 -0.02 4.11 1.01 -1.18 -4.56 121.20 122.14 2yue s ILE 51 Ca 0.50 -1.51 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 2yue s ILE 51 Cb -0.34 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2yue s ILE 51 CO 0.40 0.07 0.07 0.00 0.00 0.00 0.00 174.94 175.48 2yue s VAL 53 N -1.14 -0.32 0.11 0.00 1.01 0.78 -0.98 120.40 119.86 2yue s VAL 53 Ca 0.21 0.07 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 2yue s VAL 53 Cb -0.12 -0.54 -0.07 0.00 0.00 0.00 0.00 36.38 35.65 2yue s VAL 53 CO 0.12 -0.06 0.72 -0.75 0.00 0.00 0.00 175.10 175.12 2yue s LYS 54 N 2.33 4.46 -0.72 2.72 2.20 0.96 -0.15 119.74 131.54 2yue s LYS 54 Ca 0.05 1.02 -0.24 0.00 -0.36 0.00 0.00 55.97 56.43 2yue s LYS 54 Cb -0.14 -3.28 0.05 0.00 -1.51 0.00 0.00 37.83 32.95 2yue s LYS 54 CO -0.10 0.52 1.13 -0.06 -0.36 0.00 0.00 175.35 176.48 2yue s PHE 55 N -0.86 2.50 0.16 4.03 0.08 -0.31 -1.31 117.98 122.26 2yue s PHE 55 Ca 0.34 -0.36 -0.04 0.00 0.12 0.00 0.00 56.93 57.00 2yue s PHE 55 Cb -0.21 -4.46 0.00 0.00 -0.57 0.00 0.00 43.02 37.77 2yue s PHE 55 CO 0.23 -1.85 1.39 0.00 -0.10 0.00 0.00 175.22 174.90 2yue h ALA 56 N 9.77 0.51 -2.96 5.36 0.00 -1.84 0.11 119.26 130.21 2yue h ALA 56 Ca -0.25 -0.62 -0.20 0.00 0.00 0.00 0.00 54.91 53.84 2yue h ALA 56 Cb 1.06 -0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.60 2yue h ALA 56 CO 1.23 0.75 -0.71 -1.21 0.00 0.00 0.00 179.25 179.32 2yue s GLU 57 N -3.60 0.41 0.00 0.00 2.02 -1.03 -4.78 118.70 111.72 2yue s GLU 57 Ca -0.06 -0.72 -0.01 0.00 0.02 0.00 0.00 54.97 54.20 2yue s GLU 57 Cb 0.10 -0.00 -0.01 0.00 0.10 0.00 0.00 34.13 34.32 2yue s GLU 57 CO 0.85 -0.03 0.01 0.42 0.02 0.00 0.00 175.26 176.54 2yue s ILE 58 N -1.67 0.04 -0.11 -1.63 -1.09 -1.26 -2.59 121.20 112.90 2yue s ILE 58 Ca -0.12 -0.36 0.01 0.00 -2.23 0.00 0.00 60.65 57.96 2yue s ILE 58 Cb -0.08 -0.14 -0.01 0.00 -1.58 0.00 0.00 42.46 40.64 2yue s ILE 58 CO -0.01 -0.20 -0.15 -0.94 -1.23 0.00 0.00 174.94 172.41 2yue s SER 59 N -0.58 3.85 -0.19 3.58 1.04 -1.26 -4.73 113.70 115.40 2yue s SER 59 Ca -0.06 -0.34 0.12 0.00 0.48 0.00 0.00 55.95 56.15 2yue s SER 59 Cb -0.04 -1.40 0.43 0.00 0.10 0.00 0.00 66.02 65.10 2yue s SER 59 CO -0.00 0.20 1.21 0.59 0.98 0.00 0.00 173.24 176.22 2yue n ASN 60 N 3.27 1.93 -0.05 7.02 4.13 -1.26 -3.80 115.26 126.51 2yue n ASN 60 Ca -0.18 -3.66 -0.06 0.00 1.68 0.00 0.00 54.58 52.36 2yue n ASN 60 Cb 0.53 -0.49 -0.06 0.00 -1.54 0.00 0.00 39.78 38.22 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 -0.90 2.90 -3.51 6.41 5.15 -1.26 -5.04 115.26 119.02 2yue n ASN 61 Ca 0.20 -0.02 -0.23 0.00 -0.60 0.00 0.00 54.58 53.93 2yue n ASN 61 Cb 0.77 0.40 0.16 0.00 -0.53 0.00 0.00 39.78 40.57 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 -2.51 -3.96 -4.95 1.20 5.03 -1.26 -5.08 117.44 105.90 2yue n TRP 62 Ca -0.17 -0.94 -0.32 0.00 3.03 0.00 0.00 57.50 59.10 2yue n TRP 62 Cb 0.77 -0.80 -0.14 0.00 -1.03 0.00 0.00 31.31 30.11 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 -4.78 3.78 0.00 -0.99 0.02 -1.26 -4.86 114.94 106.84 2yue s ASN 63 Ca 0.59 -0.32 0.00 0.00 -1.02 0.00 0.00 52.86 52.11 2yue s ASN 63 Cb -0.02 -1.09 0.00 0.00 0.02 0.00 0.00 41.25 40.16 2yue s ASN 63 CO 0.41 0.26 0.00 0.61 0.02 0.00 0.00 177.10 178.40 2yue n GLY 64 N 2.86 1.78 0.00 0.66 0.00 -1.26 -4.66 105.19 104.58 2yue n GLY 64 Ca -0.18 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.10 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 1.69 0.92 3.24 -0.02 0.00 -1.26 -0.52 105.19 109.23 2yue n GLY 65 Ca 0.00 -0.69 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 2yue n GLY 65 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2yue n ILE 66 N 0.00 0.00 -3.78 -0.61 -5.35 -1.26 -2.05 119.36 106.30 2yue n ILE 66 Ca 0.00 -2.00 -0.13 0.00 -0.27 0.00 0.00 62.75 60.35 2yue n ILE 66 Cb 0.00 0.18 -0.11 0.00 -1.74 0.00 0.00 39.64 37.97 2yue n ILE 66 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2yue s ARG 67 N -3.77 0.31 0.16 6.28 0.52 -1.15 -2.87 118.95 118.45 2yue s ARG 67 Ca 0.13 0.33 -0.23 0.00 -0.52 0.00 0.00 55.73 55.44 2yue s ARG 67 Cb -0.01 0.15 0.07 0.00 0.52 0.00 0.00 34.95 35.68 2yue s ARG 67 CO 0.08 -0.04 0.60 -0.59 0.02 0.00 0.00 175.30 175.37 2yue s PHE 68 N 0.08 -0.51 -0.83 -0.53 -0.71 -0.59 -0.16 117.98 114.73 2yue s PHE 68 Ca -0.01 0.28 0.00 0.00 -1.04 0.00 0.00 56.93 56.17 2yue s PHE 68 Cb -0.02 0.56 0.00 0.00 -1.21 0.00 0.00 43.02 42.35 2yue s PHE 68 CO 0.00 -0.86 0.00 0.41 -1.34 0.00 0.00 175.22 173.43 2yue n GLY 69 N -0.38 -0.64 3.53 1.99 0.00 -0.24 -0.13 105.19 109.33 2yue n GLY 69 Ca -0.16 -0.53 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 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 -3.43 2.00 -0.02 1.61 0.08 0.72 -0.26 117.98 118.67 2yue s PHE 70 Ca 0.00 -0.99 -0.20 0.00 0.12 0.00 0.00 56.93 55.86 2yue s PHE 70 Cb 0.00 -1.38 0.04 0.00 -0.57 0.00 0.00 43.02 41.11 2yue s PHE 70 CO 0.00 0.04 0.42 -0.08 -0.10 0.00 0.00 175.22 175.50 2yue s THR 71 N -3.13 0.04 -0.04 0.64 -1.32 0.55 -0.11 115.64 112.27 2yue s THR 71 Ca 0.29 -0.34 0.03 0.00 -1.21 0.00 0.00 61.69 60.47 2yue s THR 71 Cb 0.07 -0.73 -0.25 0.00 -1.51 0.00 0.00 72.50 70.07 2yue s THR 71 CO 0.14 -0.18 0.68 -1.28 -2.21 0.00 0.00 174.62 171.76 2yue h SER 72 N 3.60 0.21 -4.08 8.08 0.87 -0.94 -2.60 113.55 118.68 2yue h SER 72 Ca -0.29 -0.39 -0.47 0.00 -1.23 0.00 0.00 61.79 59.42 2yue h SER 72 Cb 1.17 -0.07 0.14 0.00 -0.44 0.00 0.00 62.40 63.20 2yue h SER 72 CO 0.40 1.34 0.26 0.20 -0.53 0.00 0.00 176.83 178.49 2yue s ASN 73 N -6.60 3.37 0.28 6.23 0.01 -1.24 -4.87 114.94 112.11 2yue s ASN 73 Ca -0.10 1.23 -0.14 0.00 -0.71 0.00 0.00 52.86 53.14 2yue s ASN 73 Cb 0.07 -1.90 -0.08 0.00 0.41 0.00 0.00 41.25 39.76 2yue s ASN 73 CO 0.82 -2.67 0.68 -1.81 -1.51 0.00 0.00 177.10 172.61 2yue s ASP 74 N -3.66 6.78 0.48 -1.22 1.01 -1.26 -4.71 116.67 114.09 2yue s ASP 74 Ca 0.64 1.20 0.27 0.00 0.71 0.00 0.00 52.55 55.36 2yue s ASP 74 Cb -0.17 -2.34 1.12 0.00 1.01 0.00 0.00 42.92 42.55 2yue s ASP 74 CO 0.56 -0.13 1.91 1.55 0.21 0.00 0.00 175.17 179.27 2yue h PRO 75 N 2.54 0.00 0.00 8.23 0.13 -1.96 -2.90 132.00 138.05 2yue h PRO 75 Ca -0.48 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.47 2yue h PRO 75 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2yue h PRO 75 CO 0.66 0.17 -0.85 -0.39 -0.23 0.00 0.00 178.00 177.36 2yue h VAL 76 N 0.00 1.55 0.00 1.56 -1.51 -1.95 -2.97 116.25 112.92 2yue h VAL 76 Ca -0.00 -2.74 0.00 0.00 -1.23 0.00 0.00 66.70 62.73 2yue h VAL 76 Cb 0.62 2.50 0.00 0.00 -2.13 0.00 0.00 31.29 32.28 2yue h VAL 76 CO 0.02 0.79 0.00 0.35 -1.23 0.00 0.00 177.57 177.50 2yue n THR 77 N -3.60 0.84 0.73 7.19 -2.24 -1.09 -1.92 114.28 114.19 2yue n THR 77 Ca -0.02 0.25 0.08 0.00 -2.27 0.00 0.00 64.05 62.10 2yue n THR 77 Cb 0.80 -1.19 -0.00 0.00 -2.10 0.00 0.00 70.33 67.84 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 -2.25 1.64 -4.68 3.22 4.77 -1.16 -4.89 117.00 113.65 2yue n LEU 78 Ca 0.02 -0.76 -0.52 0.00 -0.03 0.00 0.00 56.01 54.72 2yue n LEU 78 Cb 0.22 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 2yue n LEU 78 CO 0.19 0.31 1.30 1.21 -1.33 0.00 0.00 177.39 179.08 2yue n GLU 79 N -0.12 1.64 -2.22 3.23 2.13 -0.81 -0.12 120.64 124.37 2yue n GLU 79 Ca 0.07 0.60 -0.20 0.00 0.66 0.00 0.00 57.16 58.29 2yue n GLU 79 Cb 0.34 -2.34 -0.03 0.00 0.27 0.00 0.00 31.44 29.69 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 3.91 0.03 2.69 8.31 0.00 -1.26 -4.86 105.19 114.02 2yue n GLY 80 Ca 0.23 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 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 -3.69 0.24 -3.99 2.61 -2.24 0.83 -5.13 114.28 102.91 2yue n THR 81 Ca -0.23 -1.88 -0.29 0.00 -2.27 0.00 0.00 64.05 59.38 2yue n THR 81 Cb 0.68 0.92 -0.05 0.00 -2.10 0.00 0.00 70.33 69.78 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 -3.18 4.12 0.00 3.22 1.43 -1.22 -4.81 118.68 118.23 2yue s LEU 82 Ca 0.23 0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.42 2yue s LEU 82 Cb 0.41 -2.73 0.03 0.00 0.03 0.00 0.00 46.19 43.93 2yue s LEU 82 CO -0.06 0.13 0.11 -0.81 0.23 0.00 0.00 176.35 175.94 2yue n PRO 83 N 0.03 -1.23 0.04 1.29 -0.04 -1.26 -4.98 135.00 128.84 2yue n PRO 83 Ca -0.07 -0.17 -0.04 0.00 -0.04 0.00 0.00 63.50 63.18 2yue n PRO 83 Cb 0.52 -0.16 -0.09 0.00 -0.04 0.00 0.00 33.50 33.73 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 -1.98 -3.44 116.57 113.26 2yue h LYS 84 Ca -0.04 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.41 2yue h LYS 84 Cb 0.12 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.35 2yue h LYS 84 CO 0.03 0.54 -0.32 2.48 -0.57 0.00 0.00 179.45 181.61 2yue n TYR 85 N -3.09 -0.45 -0.32 -1.35 0.18 -1.26 -1.34 117.16 109.53 2yue n TYR 85 Ca -0.08 -1.88 0.12 0.00 1.88 0.00 0.00 57.90 57.94 2yue n TYR 85 Cb 0.91 0.17 0.32 0.00 -0.38 0.00 0.00 39.34 40.35 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 -1.49 2.38 0.00 -3.48 0.00 -1.26 -4.46 120.51 112.20 2yue n ALA 86 Ca -0.08 -1.28 0.00 0.00 0.00 0.00 0.00 53.44 52.08 2yue n ALA 86 Cb 0.41 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 -0.03 0.07 0.00 0.00 -0.04 -1.26 -4.82 135.00 128.92 2yue n PRO 88 Ca 0.00 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 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 -1.43 0.00 -3.66 3.54 9.92 -1.26 -1.31 116.55 122.35 2yue n ASP 89 Ca 0.05 0.76 -0.42 0.00 -0.53 0.00 0.00 54.79 54.65 2yue n ASP 89 Cb 0.15 -0.26 -0.03 0.00 -0.64 0.00 0.00 41.12 40.34 2yue n ASP 89 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2yue n LEU 90 N -1.87 5.51 0.00 0.64 4.77 -1.19 -3.19 117.00 121.67 2yue n LEU 90 Ca 0.00 -3.52 0.00 0.00 -0.03 0.00 0.00 56.01 52.46 2yue n LEU 90 Cb 0.00 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 39.71 2yue n LEU 90 CO 0.00 0.40 0.00 0.35 -1.33 0.00 0.00 177.39 176.81 2yue n THR 91 N 5.51 0.00 0.08 -5.08 -2.24 -1.09 -4.25 114.28 107.21 2yue n THR 91 Ca 0.51 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 62.19 2yue n THR 91 Cb 0.39 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.58 2yue n THR 91 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yue h ASN 92 N 0.00 0.27 -4.05 3.42 7.08 -1.16 -3.43 115.58 117.70 2yue h ASN 92 Ca 0.00 -0.23 -0.54 0.00 -3.08 0.00 0.00 56.30 52.44 2yue h ASN 92 Cb 0.00 -0.08 0.18 0.00 -2.08 0.00 0.00 38.32 36.34 2yue h ASN 92 CO 0.00 1.08 0.28 0.54 -2.08 0.00 0.00 177.43 177.24 2yue n ARG 93 N -3.61 0.39 -2.11 4.14 1.74 -1.22 -4.89 116.66 111.11 2yue n ARG 93 Ca -0.04 0.20 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 2yue n ARG 93 Cb 0.86 -2.38 -0.03 0.00 -1.02 0.00 0.00 32.46 29.89 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 -3.79 3.70 0.00 5.56 0.04 -1.26 -3.34 135.00 135.91 2yue s PRO 94 Ca 0.74 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.35 2yue s PRO 94 Cb -0.32 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.16 2yue s PRO 94 CO 0.49 -1.41 0.00 0.41 0.04 0.00 0.00 177.00 176.53 2yue n GLY 95 N 4.83 0.66 3.36 0.56 0.00 -1.26 -4.86 105.19 108.48 2yue n GLY 95 Ca 0.19 -0.25 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.10 -0.92 -0.07 1.61 0.08 -1.21 -0.27 117.98 115.10 2yue s PHE 96 Ca 0.00 1.71 0.03 0.00 0.12 0.00 0.00 56.93 58.79 2yue s PHE 96 Cb 0.00 0.42 0.01 0.00 -0.57 0.00 0.00 43.02 42.88 2yue s PHE 96 CO 0.00 -0.52 -0.15 -1.58 -0.10 0.00 0.00 175.22 172.87 2yue s TRP 97 N 2.61 1.71 -0.01 0.36 0.51 0.84 -4.11 118.94 120.85 2yue s TRP 97 Ca -0.03 -0.64 -0.07 0.00 -2.12 0.00 0.00 56.10 53.24 2yue s TRP 97 Cb -0.12 -1.21 0.00 0.00 -0.81 0.00 0.00 33.47 31.34 2yue s TRP 97 CO -0.14 -0.30 0.14 0.00 -0.51 0.00 0.00 176.95 176.14 2yue s ALA 98 N 0.54 -0.33 0.34 0.98 0.00 -1.26 -0.20 121.76 121.82 2yue s ALA 98 Ca -0.15 -0.03 0.08 0.00 0.00 0.00 0.00 51.96 51.86 2yue s ALA 98 Cb -0.16 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 2yue s ALA 98 CO 0.05 -0.18 0.29 1.17 0.00 0.00 0.00 175.76 177.08 2yue n LYS 99 N 1.74 0.42 -4.71 0.00 3.00 0.81 -4.95 118.16 114.47 2yue n LYS 99 Ca -0.21 -3.41 -0.26 0.00 -0.00 0.00 0.00 58.31 54.43 2yue n LYS 99 Cb 0.56 2.78 -0.16 0.00 0.00 0.00 0.00 35.03 38.21 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 -3.38 1.41 0.65 3.14 0.00 -1.26 -1.55 121.76 120.77 2yue s ALA 100 Ca 0.40 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 2yue s ALA 100 Cb 0.02 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2yue s ALA 100 CO 0.29 0.18 1.05 -1.17 0.00 0.00 0.00 175.76 176.10 2yue s LEU 101 N 0.44 3.14 0.70 0.00 0.20 -1.14 -5.01 118.68 117.01 2yue s LEU 101 Ca -0.12 1.39 -0.11 0.00 0.69 0.00 0.00 54.13 55.98 2yue s LEU 101 Cb -0.15 -4.36 0.01 0.00 -0.43 0.00 0.00 46.19 41.26 2yue s LEU 101 CO 0.04 -1.05 1.09 -2.28 -0.29 0.00 0.00 176.35 173.85 2yue s HIS 102 N -3.20 3.35 -1.22 5.38 5.65 -1.26 -4.45 115.29 119.55 2yue s HIS 102 Ca 0.56 1.08 0.30 0.00 0.25 0.00 0.00 55.06 57.25 2yue s HIS 102 Cb -0.11 -3.03 1.38 0.00 -1.18 0.00 0.00 32.58 29.64 2yue s HIS 102 CO 0.54 -1.13 1.99 -0.85 -0.65 0.00 0.00 174.74 174.64 2yue n GLU 103 N -2.98 0.22 0.10 2.88 0.28 -1.26 -3.00 120.64 116.88 2yue n GLU 103 Ca 0.07 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.19 2yue n GLU 103 Cb 0.57 -1.50 0.28 0.00 1.43 0.00 0.00 31.44 32.21 2yue n GLU 103 CO 0.00 0.00 0.00 -0.56 -0.16 0.00 0.00 177.13 176.41 2yue h GLN 104 N 0.00 0.00 0.00 3.44 3.07 -2.04 -3.29 115.11 116.29 2yue h GLN 104 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 2yue h GLN 104 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.92 2yue h GLN 104 CO 0.00 0.00 -0.38 0.66 0.09 0.00 0.00 178.83 179.20 2yue n TYR 105 N -2.30 0.00 -1.12 0.06 4.01 -1.16 -4.68 117.16 111.97 2yue n TYR 105 Ca 0.04 -1.19 -0.01 0.00 -0.16 0.00 0.00 57.90 56.58 2yue n TYR 105 Cb 0.45 -0.20 0.27 0.00 -0.31 0.00 0.00 39.34 39.55 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 -3.00 1.34 0.45 0.00 8.01 -1.26 -4.91 118.70 119.32 2yue s GLU 107 Ca 0.49 -0.04 0.01 0.00 0.01 0.00 0.00 54.97 55.45 2yue s GLU 107 Cb 0.41 -1.89 0.00 0.00 -4.31 0.00 0.00 34.13 28.33 2yue s GLU 107 CO 0.09 -2.00 0.66 0.21 0.01 0.00 0.00 175.26 174.24 2yue s LYS 108 N -5.64 3.00 -1.60 1.61 2.20 -1.26 -4.25 119.74 113.81 2yue s LYS 108 Ca 0.66 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 2yue s LYS 108 Cb -0.09 -2.58 0.00 0.00 -1.51 0.00 0.00 37.83 33.65 2yue s LYS 108 CO 0.51 -0.29 0.00 -3.47 -0.36 0.00 0.00 175.35 171.74 2yue n ASP 109 N -2.07 -4.77 -4.59 1.43 2.03 0.02 -4.95 116.55 103.65 2yue n ASP 109 Ca 0.02 0.22 -0.34 0.00 0.52 0.00 0.00 54.79 55.21 2yue n ASP 109 Cb 0.58 -4.13 -0.11 0.00 -0.72 0.00 0.00 41.12 36.74 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 -2.20 4.81 -0.50 1.67 -0.87 -1.26 -4.87 114.94 111.72 2yue s ASN 110 Ca 0.00 0.00 -0.21 0.00 -1.57 0.00 0.00 52.86 51.08 2yue s ASN 110 Cb 0.00 -1.33 0.04 0.00 -0.02 0.00 0.00 41.25 39.94 2yue s ASN 110 CO 0.00 0.34 0.72 -0.63 -2.57 0.00 0.00 177.10 174.96 2yue s ILE 111 N -0.66 4.72 -0.49 0.60 1.01 -1.26 -1.16 121.20 123.95 2yue s ILE 111 Ca 0.10 -0.07 -0.19 0.00 0.00 0.00 0.00 60.65 60.50 2yue s ILE 111 Cb -0.12 -4.34 0.05 0.00 0.01 0.00 0.00 42.46 38.07 2yue s ILE 111 CO 0.02 -0.82 0.59 -0.22 0.00 0.00 0.00 174.94 174.50 2yue s LEU 112 N 3.07 4.97 -0.09 2.97 2.96 0.79 -3.15 118.68 130.19 2yue s LEU 112 Ca 0.22 -0.87 0.01 0.00 -0.22 0.00 0.00 54.13 53.26 2yue s LEU 112 Cb -0.16 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.07 2yue s LEU 112 CO 0.16 -0.83 -0.11 -0.72 -1.32 0.00 0.00 176.35 173.53 2yue s TYR 113 N 2.51 2.83 -0.15 5.38 -0.85 -0.80 -0.16 117.35 126.12 2yue s TYR 113 Ca 0.14 -0.28 -0.10 0.00 -0.52 0.00 0.00 57.07 56.31 2yue s TYR 113 Cb -0.19 -1.76 0.05 0.00 0.38 0.00 0.00 41.96 40.44 2yue s TYR 113 CO 0.12 0.07 0.37 1.52 -1.52 0.00 0.00 175.55 176.11 2yue s TYR 114 N -0.27 -0.48 0.13 -3.49 1.13 -0.42 -0.43 117.35 113.53 2yue s TYR 114 Ca 0.03 1.09 0.03 0.00 -1.41 0.00 0.00 57.07 56.80 2yue s TYR 114 Cb -0.13 0.18 -0.01 0.00 -1.10 0.00 0.00 41.96 40.90 2yue s TYR 114 CO 0.03 -0.27 0.10 2.48 -2.51 0.00 0.00 175.55 175.38 2yue n TYR 115 N 3.72 -0.23 -4.15 -3.49 4.11 0.02 -3.09 117.16 114.05 2yue n TYR 115 Ca -0.20 -1.05 -0.15 0.00 -0.00 0.00 0.00 57.90 56.50 2yue n TYR 115 Cb 0.56 0.09 -0.13 0.00 -0.00 0.00 0.00 39.34 39.85 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 -2.44 0.51 0.58 -3.48 0.11 -1.15 -0.10 120.40 114.44 2yue s VAL 116 Ca 0.14 -0.59 0.04 0.00 -2.93 0.00 0.00 61.98 58.63 2yue s VAL 116 Cb 0.01 -0.50 0.11 0.00 -1.53 0.00 0.00 36.38 34.47 2yue s VAL 116 CO 0.10 -0.07 0.79 -0.46 -3.33 0.00 0.00 175.10 172.13 2yue n ASN 117 N 2.34 1.47 0.00 3.54 0.23 -0.42 -3.33 115.26 119.08 2yue n ASN 117 Ca -0.17 -2.14 0.07 0.00 -0.53 0.00 0.00 54.58 51.81 2yue n ASN 117 Cb 0.57 -0.48 0.32 0.00 -2.08 0.00 0.00 39.78 38.11 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 -1.43 -0.97 1.82 4.83 0.00 -1.26 -2.51 105.19 105.67 2yue n GLY 118 Ca 0.14 -0.05 -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 -1.47 4.46 -2.21 4.61 0.00 -1.26 -4.87 120.51 119.76 2yue n ALA 119 Ca 0.04 -1.98 -0.13 0.00 0.00 0.00 0.00 53.44 51.38 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 -0.36 -0.14 3.38 0.00 0.00 -1.04 -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 4.85 -0.37 1.61 1.01 -1.26 -3.36 116.67 117.12 2yue s ASP 121 Ca 0.00 -0.39 -0.18 0.00 0.71 0.00 0.00 52.55 52.69 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 0.52 -0.69 0.21 0.00 0.00 175.17 175.14 2yue s VAL 122 N 1.54 5.00 0.01 -1.27 1.01 0.86 -1.30 120.40 126.24 2yue s VAL 122 Ca 0.05 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.28 2yue s VAL 122 Cb -0.15 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2yue s VAL 122 CO 0.01 -0.29 0.02 -0.63 0.00 0.00 0.00 175.10 174.21 2yue s ILE 123 N 2.42 4.26 0.34 2.22 1.09 0.86 -0.32 121.20 132.06 2yue s ILE 123 Ca 0.18 -0.60 0.07 0.00 -1.10 0.00 0.00 60.65 59.20 2yue s ILE 123 Cb -0.15 -2.92 -0.07 0.00 -1.06 0.00 0.00 42.46 38.26 2yue s ILE 123 CO 0.14 0.35 -0.02 -0.72 -0.10 0.00 0.00 174.94 174.59 2yue s TYR 124 N -1.13 2.20 -0.04 3.97 1.13 -1.23 -0.80 117.35 121.45 2yue s TYR 124 Ca 0.21 -0.72 -0.30 0.00 -1.41 0.00 0.00 57.07 54.85 2yue s TYR 124 Cb -0.12 -1.39 0.11 0.00 -1.10 0.00 0.00 41.96 39.46 2yue s TYR 124 CO 0.12 0.32 1.03 0.20 -2.51 0.00 0.00 175.55 174.71 2yue s GLY 125 N -3.56 -0.38 -0.05 5.49 0.00 0.43 -1.43 107.32 107.83 2yue s GLY 125 Ca 0.33 1.02 0.03 0.00 0.00 0.00 0.00 44.72 46.10 2yue s GLY 125 CO 0.15 0.32 -0.13 -0.42 0.00 0.00 0.00 173.10 173.03 2yue s ILE 126 N -2.88 1.13 -1.30 0.90 -1.09 -1.05 -1.91 121.20 115.00 2yue s ILE 126 Ca 0.08 -0.52 -0.03 0.00 -2.23 0.00 0.00 60.65 57.95 2yue s ILE 126 Cb -0.00 -1.00 -0.00 0.00 -1.58 0.00 0.00 42.46 39.87 2yue s ILE 126 CO -0.06 0.34 0.64 0.59 -1.23 0.00 0.00 174.94 175.23 2yue n ASN 127 N 3.46 -1.73 -3.63 3.58 3.02 -1.19 -1.72 115.26 117.05 2yue n ASN 127 Ca -0.20 -0.90 -0.22 0.00 -0.03 0.00 0.00 54.58 53.23 2yue n ASN 127 Cb 0.53 -3.72 0.06 0.00 -0.61 0.00 0.00 39.78 36.03 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 -2.99 -3.19 -3.35 6.41 5.15 -1.26 -4.97 115.26 111.06 2yue n ASN 128 Ca -0.27 -0.69 -0.25 0.00 -0.60 0.00 0.00 54.58 52.77 2yue n ASN 128 Cb 0.67 -4.58 -0.09 0.00 -0.53 0.00 0.00 39.78 35.24 2yue n ASN 128 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2yue s GLU 129 N -5.97 0.86 0.72 1.20 2.02 -0.70 -5.13 118.70 111.70 2yue s GLU 129 Ca 0.24 -1.90 -0.16 0.00 0.02 0.00 0.00 54.97 53.18 2yue s GLU 129 Cb -0.11 -1.27 0.03 0.00 0.10 0.00 0.00 34.13 32.88 2yue s GLU 129 CO 0.77 -1.36 1.23 -1.83 0.02 0.00 0.00 175.26 174.09 2yue s GLU 130 N 0.29 2.16 -0.02 1.61 1.03 -1.26 -2.54 118.70 119.97 2yue s GLU 130 Ca 0.30 1.84 0.04 0.00 0.03 0.00 0.00 54.97 57.19 2yue s GLU 130 Cb -0.00 -1.83 -0.06 0.00 -0.80 0.00 0.00 34.13 31.45 2yue s GLU 130 CO -0.16 -1.84 0.06 1.63 -1.33 0.00 0.00 175.26 173.62 2yue n LYS 131 N -2.60 1.47 0.00 -4.83 4.76 -0.52 -4.93 118.16 111.52 2yue n LYS 131 Ca 0.14 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 2yue n LYS 131 Cb 0.50 -1.10 0.00 0.00 -1.84 0.00 0.00 35.03 32.59 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 2.48 2.08 3.68 0.72 0.00 -1.26 -5.04 105.19 107.85 2yue n GLY 132 Ca -0.03 -2.07 -0.44 0.00 0.00 0.00 0.00 46.02 43.48 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 -1.37 0.47 -0.05 1.61 3.14 -1.26 -3.52 118.33 117.36 2yue n VAL 133 Ca 0.00 -0.08 -0.05 0.00 -2.96 0.00 0.00 64.34 61.25 2yue n VAL 133 Cb 0.00 -2.06 -0.08 0.00 -1.06 0.00 0.00 33.84 30.64 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 4.87 0.66 -4.42 1.55 3.06 0.56 -4.95 119.36 120.69 2yue n ILE 134 Ca 0.19 -0.41 -0.20 0.00 -2.50 0.00 0.00 62.75 59.83 2yue n ILE 134 Cb 0.36 -0.74 -0.14 0.00 0.54 0.00 0.00 39.64 39.66 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 -4.71 2.12 0.00 9.51 2.96 -1.04 -5.02 118.68 122.50 2yue s LEU 135 Ca -0.05 -0.37 0.05 0.00 -0.22 0.00 0.00 54.13 53.55 2yue s LEU 135 Cb 0.03 -0.60 -0.02 0.00 0.50 0.00 0.00 46.19 46.10 2yue s LEU 135 CO 0.40 0.07 0.19 0.35 -1.32 0.00 0.00 176.35 176.04 2yue n THR 136 N 2.23 0.00 -0.68 3.68 -2.24 -1.26 -0.10 114.28 115.91 2yue n THR 136 Ca -0.17 -2.11 0.00 0.00 -2.27 0.00 0.00 64.05 59.50 2yue n THR 136 Cb 0.55 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 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 -0.50 0.65 3.61 3.38 0.00 -1.21 -4.99 105.19 106.12 2yue n GLY 137 Ca 0.01 -0.11 -0.41 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 4.90 0.35 -0.61 1.09 -1.23 -5.04 121.20 118.66 2yue s ILE 138 Ca 0.00 1.04 -0.25 0.00 -1.10 0.00 0.00 60.65 60.34 2yue s ILE 138 Cb 0.00 -4.04 -0.10 0.00 -1.06 0.00 0.00 42.46 37.27 2yue s ILE 138 CO 0.00 -0.14 0.99 -0.62 -0.10 0.00 0.00 174.94 175.07 2yue s ASP 139 N 1.59 7.11 -0.43 3.58 -1.08 -1.26 -4.15 116.67 122.03 2yue s ASP 139 Ca 0.28 1.93 0.04 0.00 -0.52 0.00 0.00 52.55 54.29 2yue s ASP 139 Cb -0.15 -2.58 0.44 0.00 -1.46 0.00 0.00 42.92 39.17 2yue s ASP 139 CO 0.11 -0.24 1.34 0.35 0.52 0.00 0.00 175.17 177.26 2yue n THR 140 N 0.33 2.71 -0.06 1.71 -2.24 -1.26 -4.69 114.28 110.78 2yue n THR 140 Ca 0.03 -4.29 -0.12 0.00 -2.27 0.00 0.00 64.05 57.39 2yue n THR 140 Cb 0.50 -1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 67.49 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 -0.65 0.30 -1.71 -0.78 5.12 -1.26 -5.08 116.66 112.61 2yue n ARG 141 Ca 0.46 0.13 -0.04 0.00 -1.93 0.00 0.00 57.85 56.46 2yue n ARG 141 Cb 0.77 -1.01 0.01 0.00 -1.16 0.00 0.00 32.46 31.06 2yue n ARG 141 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2yue n SER 142 N -3.77 0.95 -4.58 0.55 2.88 -1.26 -5.11 113.62 103.28 2yue n SER 142 Ca -0.22 -1.33 -0.29 0.00 -1.33 0.00 0.00 58.87 55.69 2yue n SER 142 Cb 0.57 -0.04 0.21 0.00 -0.75 0.00 0.00 64.21 64.20 2yue n SER 142 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2yue s LEU 143 N 0.00 1.71 -0.16 2.46 1.43 -1.26 -5.06 118.68 117.81 2yue s LEU 143 Ca 0.08 1.76 -0.10 0.00 -1.03 0.00 0.00 54.13 54.84 2yue s LEU 143 Cb -0.01 -3.89 0.05 0.00 0.03 0.00 0.00 46.19 42.37 2yue s LEU 143 CO 0.05 -3.64 0.39 -0.76 0.23 0.00 0.00 176.35 172.62 2yue s LEU 144 N -6.89 0.12 0.11 1.79 1.43 -1.26 -4.87 118.68 109.12 2yue s LEU 144 Ca 0.67 0.83 0.08 0.00 -1.03 0.00 0.00 54.13 54.68 2yue s LEU 144 Cb -0.23 1.29 -0.04 0.00 0.03 0.00 0.00 46.19 47.24 2yue s LEU 144 CO 0.61 -0.17 -0.15 0.26 0.23 0.00 0.00 176.35 177.13 2yue s TRP 145 N 1.05 2.61 0.52 0.29 0.51 -0.98 -2.35 118.94 120.58 2yue s TRP 145 Ca -0.07 -0.23 0.01 0.00 -2.12 0.00 0.00 56.10 53.70 2yue s TRP 145 Cb -0.07 -1.37 0.02 0.00 -0.81 0.00 0.00 33.47 31.24 2yue s TRP 145 CO -0.09 0.40 0.74 0.95 -0.51 0.00 0.00 176.95 178.45 2yue s THR 146 N -1.19 3.05 -0.06 2.01 -4.23 -1.26 -0.33 115.64 113.63 2yue s THR 146 Ca 0.19 -0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 59.95 2yue s THR 146 Cb -0.11 -3.14 0.03 0.00 1.34 0.00 0.00 72.50 70.62 2yue s THR 146 CO 0.11 -0.10 0.32 0.68 -0.54 0.00 0.00 174.62 175.10 2yue s VAL 147 N -2.70 0.03 -0.12 2.29 -7.23 0.64 -2.25 120.40 111.06 2yue s VAL 147 Ca 0.55 -0.27 -0.05 0.00 -1.81 0.00 0.00 61.98 60.40 2yue s VAL 147 Cb -0.10 -0.55 0.06 0.00 0.56 0.00 0.00 36.38 36.34 2yue s VAL 147 CO 0.38 -0.15 0.25 -0.63 -0.31 0.00 0.00 175.10 174.64 2yue s ILE 148 N -0.66 -0.28 -0.22 -0.62 1.01 0.75 -1.07 121.20 120.10 2yue s ILE 148 Ca -0.08 0.25 -0.06 0.00 0.00 0.00 0.00 60.65 60.77 2yue s ILE 148 Cb -0.04 -0.41 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 2yue s ILE 148 CO 0.03 0.10 0.02 -0.62 0.00 0.00 0.00 174.94 174.47 2yue s ASP 149 N 2.05 4.85 -0.73 3.58 -1.08 0.78 -0.14 116.67 125.98 2yue s ASP 149 Ca -0.02 -0.23 -0.10 0.00 -0.52 0.00 0.00 52.55 51.68 2yue s ASP 149 Cb -0.12 -1.85 0.19 0.00 -1.46 0.00 0.00 42.92 39.69 2yue s ASP 149 CO -0.08 0.02 0.62 0.27 0.52 0.00 0.00 175.17 176.51 2yue s ILE 150 N 1.29 4.81 -0.42 4.11 -0.00 -1.13 -2.92 121.20 126.94 2yue s ILE 150 Ca 0.04 -2.60 0.08 0.00 -0.00 0.00 0.00 60.65 58.17 2yue s ILE 150 Cb -0.15 -4.03 0.30 0.00 -0.00 0.00 0.00 42.46 38.58 2yue s ILE 150 CO 0.01 -0.96 0.84 0.00 -0.00 0.00 0.00 174.94 174.84 2yue n TYR 151 N 3.86 -1.52 0.00 1.37 9.36 -1.26 -4.84 117.16 124.14 2yue n TYR 151 Ca 0.10 -2.87 0.00 0.00 3.32 0.00 0.00 57.90 58.45 2yue n TYR 151 Cb 0.43 0.59 0.00 0.00 -0.63 0.00 0.00 39.34 39.73 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 0.76 -1.59 2.83 2.98 0.00 -1.25 -4.90 105.19 104.02 2yue n GLY 152 Ca 0.15 0.70 -0.42 0.00 0.00 0.00 0.00 46.02 46.46 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 6.83 -3.64 1.61 2.85 0.32 -4.35 115.26 118.88 2yue n ASN 153 Ca 0.00 -3.51 -0.02 0.00 -0.11 0.00 0.00 54.58 50.94 2yue n ASN 153 Cb 0.00 -1.24 -0.03 0.00 1.24 0.00 0.00 39.78 39.75 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 0.14 0.00 -4.22 0.00 -2.24 -1.12 -4.18 114.28 102.66 2yue n THR 155 Ca 0.04 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.64 2yue n THR 155 Cb 0.57 -0.08 -0.15 0.00 -2.10 0.00 0.00 70.33 68.57 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 -3.25 0.35 -0.05 3.38 0.00 -1.07 -1.19 107.32 105.49 2yue s GLY 156 Ca 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 44.72 44.50 2yue s GLY 156 CO 0.00 -0.08 -0.04 -0.26 0.00 0.00 0.00 173.10 172.71 2yue s ILE 157 N 0.09 0.58 -0.15 0.90 -4.36 0.65 -2.46 121.20 116.46 2yue s ILE 157 Ca -0.01 -0.12 0.02 0.00 -0.26 0.00 0.00 60.65 60.29 2yue s ILE 157 Cb -0.05 -0.62 0.01 0.00 1.25 0.00 0.00 42.46 43.04 2yue s ILE 157 CO -0.00 0.25 -0.20 -0.70 0.24 0.00 0.00 174.94 174.52 2yue s GLU 158 N 1.13 3.05 0.16 0.37 2.12 -0.43 -0.30 118.70 124.80 2yue s GLU 158 Ca -0.07 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.12 2yue s GLU 158 Cb -0.14 -2.49 -0.07 0.00 0.26 0.00 0.00 34.13 31.69 2yue s GLU 158 CO -0.01 -0.04 1.05 -0.06 -0.54 0.00 0.00 175.26 175.65 2yue s PHE 159 N 0.90 3.69 0.35 5.30 0.40 -1.26 -0.03 117.98 127.33 2yue s PHE 159 Ca -0.05 1.68 0.08 0.00 -0.60 0.00 0.00 56.93 58.04 2yue s PHE 159 Cb -0.15 -3.19 -0.03 0.00 0.51 0.00 0.00 43.02 40.16 2yue s PHE 159 CO -0.03 -0.29 0.24 -0.51 0.70 0.00 0.00 175.22 175.33 2yue s LEU 160 N -0.26 3.41 -0.57 -0.37 1.43 -0.15 -4.89 118.68 117.28 2yue s LEU 160 Ca 0.48 -0.67 -0.21 0.00 -1.03 0.00 0.00 54.13 52.70 2yue s LEU 160 Cb -0.27 -1.96 0.06 0.00 0.03 0.00 0.00 46.19 44.05 2yue s LEU 160 CO 0.33 -0.38 0.81 -1.81 0.23 0.00 0.00 176.35 175.53 2yue s ASP 161 N -3.95 6.23 0.51 2.29 1.01 -1.26 -4.27 116.67 117.23 2yue s ASP 161 Ca 0.41 -0.86 0.27 0.00 0.71 0.00 0.00 52.55 53.07 2yue s ASP 161 Cb -0.04 -2.37 1.37 0.00 1.01 0.00 0.00 42.92 42.89 2yue s ASP 161 CO 0.25 -1.17 1.91 0.77 0.21 0.00 0.00 175.17 177.14 2yue h SER 162 N 9.26 0.10 -0.38 0.27 4.64 -1.91 0.23 113.55 125.76 2yue h SER 162 Ca -0.28 0.01 0.11 0.00 -0.47 0.00 0.00 61.79 61.16 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 1.08 0.04 0.31 -0.09 -0.87 0.00 0.00 176.83 177.29 2yue h ARG 163 N 0.10 0.00 0.11 4.77 1.12 -1.90 -0.11 114.38 118.46 2yue h ARG 163 Ca 0.39 0.00 -0.29 0.00 -1.11 0.00 0.00 59.98 58.98 2yue h ARG 163 Cb 1.40 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 31.38 2yue h ARG 163 CO -0.04 0.00 -1.21 0.82 -3.11 0.00 0.00 179.97 176.43 2yue h ILE 164 N 0.00 1.34 -0.80 1.20 2.04 -0.95 -3.25 117.51 117.09 2yue h ILE 164 Ca 0.18 -2.58 -0.36 0.00 1.00 0.00 0.00 64.86 63.10 2yue h ILE 164 Cb 0.79 2.71 -0.21 0.00 -0.74 0.00 0.00 36.82 39.37 2yue h ILE 164 CO -0.00 0.78 0.46 -1.22 0.00 0.00 0.00 178.15 178.16 2yue n TYR 165 N -3.73 2.53 -4.26 1.37 4.02 -0.22 -4.93 117.16 111.94 2yue n TYR 165 Ca -0.12 -1.46 -0.17 0.00 -0.01 0.00 0.00 57.90 56.14 2yue n TYR 165 Cb 0.98 -0.78 -0.09 0.00 -0.02 0.00 0.00 39.34 39.42 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 -2.84 1.53 0.00 -0.72 -1.94 -0.26 -5.02 119.30 110.05 2yue s MET 166 Ca 0.50 -1.86 0.00 0.00 -1.71 0.00 0.00 55.69 52.62 2yue s MET 166 Cb 0.41 0.22 0.00 0.00 2.01 0.00 0.00 34.83 37.48 2yue s MET 166 CO 0.11 -0.52 0.00 2.48 -0.01 0.00 0.00 175.02 177.08 2yue n TYR 167 N -0.49 -0.25 0.38 -0.03 4.11 -1.26 -4.92 117.16 114.69 2yue n TYR 167 Ca 0.04 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 57.97 2yue n TYR 167 Cb 0.64 0.24 0.18 0.00 -0.00 0.00 0.00 39.34 40.40 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.86 177.80