#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 -7.52 -3.29 1.61 7.64 -1.26 -5.04 113.62 105.77 2yue n SER 2 Ca 0.00 0.33 -0.05 0.00 1.01 0.00 0.00 58.87 60.16 2yue n SER 2 Cb 0.00 -4.76 -0.06 0.00 -1.01 0.00 0.00 64.21 58.38 2yue n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yue s SER 3 N -2.49 -0.21 0.26 6.43 0.15 -1.26 -5.16 113.70 111.41 2yue s SER 3 Ca 0.24 0.28 -0.10 0.00 0.70 0.00 0.00 55.95 57.07 2yue s SER 3 Cb -0.06 1.41 -0.01 0.00 -1.71 0.00 0.00 66.02 65.66 2yue s SER 3 CO 0.79 -0.30 0.45 -0.83 1.20 0.00 0.00 173.24 174.54 2yue s GLY 4 N 2.63 0.78 -0.03 9.45 0.00 -1.26 -5.10 107.32 113.80 2yue s GLY 4 Ca 0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 44.72 43.75 2yue s GLY 4 CO -0.20 -0.76 0.31 0.23 0.00 0.00 0.00 173.10 172.68 2yue h SER 5 N 2.27 -0.13 -2.22 1.64 0.87 -2.04 -3.47 113.55 110.46 2yue h SER 5 Ca -0.28 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 59.75 2yue h SER 5 Cb 1.25 0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 63.16 2yue h SER 5 CO 0.38 0.08 -0.61 -0.44 -0.53 0.00 0.00 176.83 175.71 2yue s SER 6 N -3.83 4.88 0.00 6.23 0.01 -1.26 -4.87 113.70 114.86 2yue s SER 6 Ca -0.02 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.73 2yue s SER 6 Cb 0.00 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.19 2yue s SER 6 CO 0.07 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.32 2yue n GLY 7 N -0.97 2.09 3.63 3.44 0.00 -1.26 -5.13 105.19 106.99 2yue n GLY 7 Ca -0.07 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.41 -0.18 1.61 0.04 -1.26 -5.03 135.00 129.77 2yue s PRO 8 Ca 0.00 0.23 -0.11 0.00 0.04 0.00 0.00 61.00 61.16 2yue s PRO 8 Cb 0.00 -1.66 -0.05 0.00 0.04 0.00 0.00 34.50 32.83 2yue s PRO 8 CO 0.00 -3.23 0.18 -1.17 0.04 0.00 0.00 177.00 172.82 2yue s LEU 9 N -6.71 4.23 0.00 -3.56 2.96 -1.26 -4.94 118.68 109.40 2yue s LEU 9 Ca 0.68 0.32 0.02 0.00 -0.22 0.00 0.00 54.13 54.93 2yue s LEU 9 Cb -0.15 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.37 2yue s LEU 9 CO 0.57 0.17 0.15 0.00 -1.32 0.00 0.00 176.35 175.91 2yue n GLN 10 N 3.45 0.21 -3.27 1.98 6.02 -1.26 -4.58 117.38 119.93 2yue n GLN 10 Ca -0.15 -1.25 -0.36 0.00 -0.01 0.00 0.00 57.00 55.23 2yue n GLN 10 Cb 0.52 1.09 -0.06 0.00 1.02 0.00 0.00 30.24 32.81 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 -3.17 3.66 0.64 1.08 0.40 -1.26 -1.65 117.98 117.68 2yue s PHE 11 Ca 0.14 1.19 -0.12 0.00 -0.60 0.00 0.00 56.93 57.54 2yue s PHE 11 Cb 0.00 -2.46 -0.02 0.00 0.51 0.00 0.00 43.02 41.05 2yue s PHE 11 CO 0.10 0.44 1.04 -1.58 0.70 0.00 0.00 175.22 175.93 2yue s HIS 12 N -1.40 3.24 0.45 0.36 2.46 -0.65 -4.44 115.29 115.30 2yue s HIS 12 Ca 0.37 1.42 0.13 0.00 0.47 0.00 0.00 55.06 57.44 2yue s HIS 12 Cb -0.16 -2.86 1.01 0.00 -0.13 0.00 0.00 32.58 30.43 2yue s HIS 12 CO 0.20 -1.00 2.03 1.03 -2.47 0.00 0.00 174.74 174.53 2yue h SER 13 N -0.21 0.13 -0.83 9.88 0.87 -1.92 -3.37 113.55 118.10 2yue h SER 13 Ca -0.45 -0.01 -0.48 0.00 -1.23 0.00 0.00 61.79 59.62 2yue h SER 13 Cb 1.20 -0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 63.06 2yue h SER 13 CO 0.59 0.20 1.33 0.54 -0.53 0.00 0.00 176.83 178.96 2yue s VAL 14 N -4.92 3.75 0.20 2.23 0.11 -1.26 -4.91 120.40 115.59 2yue s VAL 14 Ca -0.05 -0.90 0.01 0.00 -2.93 0.00 0.00 61.98 58.11 2yue s VAL 14 Cb 0.16 -4.69 -0.05 0.00 -1.53 0.00 0.00 36.38 30.28 2yue s VAL 14 CO 0.70 -1.49 0.05 -1.38 -3.33 0.00 0.00 175.10 169.65 2yue s HIS 15 N 7.44 1.26 0.23 1.54 -0.00 -1.26 -4.09 115.29 120.41 2yue s HIS 15 Ca 0.59 -1.13 -0.31 0.00 -0.00 0.00 0.00 55.06 54.20 2yue s HIS 15 Cb -0.01 -0.71 -0.14 0.00 -0.00 0.00 0.00 32.58 31.71 2yue s HIS 15 CO 0.00 -0.33 1.25 0.41 -0.00 0.00 0.00 174.74 176.07 2yue n GLY 16 N -0.29 0.34 0.34 -1.38 0.00 0.82 -4.82 105.19 100.20 2yue n GLY 16 Ca -0.04 0.47 0.23 0.00 0.00 0.00 0.00 46.02 46.68 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 3.44 0.00 -0.98 1.61 1.82 -1.91 -0.39 116.42 120.01 2yue h ASP 17 Ca -0.44 0.00 -0.50 0.00 -0.39 0.00 0.00 57.03 55.71 2yue h ASP 17 Cb 1.31 0.00 -0.30 0.00 0.68 0.00 0.00 39.33 41.02 2yue h ASP 17 CO 0.70 0.00 0.63 0.59 -1.61 0.00 0.00 179.24 179.55 2yue n ASN 18 N -3.10 3.81 -3.63 2.28 3.02 -1.23 -4.82 115.26 111.58 2yue n ASN 18 Ca -0.03 -3.59 -0.27 0.00 -0.03 0.00 0.00 54.58 50.67 2yue n ASN 18 Cb 0.08 -0.83 -0.17 0.00 -0.61 0.00 0.00 39.78 38.25 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 -3.28 0.02 -0.42 2.41 -1.09 -0.16 -3.99 121.20 114.70 2yue s ILE 19 Ca 0.57 -0.29 -0.23 0.00 -2.23 0.00 0.00 60.65 58.47 2yue s ILE 19 Cb 0.48 -0.69 0.02 0.00 -1.58 0.00 0.00 42.46 40.68 2yue s ILE 19 CO 0.11 -0.31 0.79 -0.60 -1.23 0.00 0.00 174.94 173.70 2yue s ARG 20 N 2.09 3.55 -0.79 2.79 3.52 -0.79 -4.74 118.95 124.57 2yue s ARG 20 Ca 0.02 0.07 -0.02 0.00 -0.13 0.00 0.00 55.73 55.67 2yue s ARG 20 Cb -0.16 -3.89 0.20 0.00 -1.56 0.00 0.00 34.95 29.54 2yue s ARG 20 CO -0.11 -1.01 0.66 0.42 -0.81 0.00 0.00 175.30 174.44 2yue s ILE 21 N 3.23 4.15 -0.10 4.11 1.01 -1.26 -1.37 121.20 130.98 2yue s ILE 21 Ca 0.31 -3.51 -0.05 0.00 0.00 0.00 0.00 60.65 57.40 2yue s ILE 21 Cb -0.12 -3.62 0.05 0.00 0.01 0.00 0.00 42.46 38.77 2yue s ILE 21 CO 0.21 -1.01 0.23 -0.44 0.00 0.00 0.00 174.94 173.93 2yue s SER 22 N 0.20 -0.15 0.30 3.58 0.01 -0.97 -4.85 113.70 111.83 2yue s SER 22 Ca 0.23 0.50 -0.19 0.00 1.31 0.00 0.00 55.95 57.81 2yue s SER 22 Cb -0.12 0.41 0.03 0.00 0.21 0.00 0.00 66.02 66.55 2yue s SER 22 CO -0.09 -0.17 0.71 -0.60 0.41 0.00 0.00 173.24 173.49 2yue s ARG 23 N 1.41 1.87 0.60 12.44 6.06 -1.26 -4.73 118.95 135.33 2yue s ARG 23 Ca -0.08 -1.13 0.29 0.00 -2.50 0.00 0.00 55.73 52.31 2yue s ARG 23 Cb -0.11 0.60 1.64 0.00 0.06 0.00 0.00 34.95 37.14 2yue s ARG 23 CO -0.08 -0.86 2.05 0.22 -2.50 0.00 0.00 175.30 174.14 2yue h ASP 24 N 2.03 0.00 0.00 -2.12 1.82 -2.01 -3.37 116.42 112.76 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 0.28 0.00 -0.08 0.61 -1.61 0.00 0.00 179.24 178.44 2yue n GLY 25 N -1.41 -0.17 0.00 -0.78 0.00 -1.26 -5.12 105.19 96.45 2yue n GLY 25 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.54 2.61 5.66 -1.26 -5.03 114.28 109.51 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 0.04 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.76 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 -0.57 -0.05 1.09 0.20 -1.26 -4.04 118.68 114.04 2yue s LEU 27 Ca 0.00 0.66 0.05 0.00 0.69 0.00 0.00 54.13 55.53 2yue s LEU 27 Cb 0.00 2.33 -0.01 0.00 -0.43 0.00 0.00 46.19 48.08 2yue s LEU 27 CO 0.00 -0.51 -0.22 0.00 -0.29 0.00 0.00 176.35 175.33 2yue s ALA 28 N -1.07 1.93 0.05 5.97 0.00 0.41 -2.29 121.76 126.75 2yue s ALA 28 Ca -0.08 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 2yue s ALA 28 Cb -0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 2yue s ALA 28 CO 0.07 0.36 -0.01 -0.98 0.00 0.00 0.00 175.76 175.20 2yue s ARG 29 N -0.07 0.63 0.02 0.00 1.70 -0.47 -0.33 118.95 120.44 2yue s ARG 29 Ca -0.04 -1.19 -0.28 0.00 -0.47 0.00 0.00 55.73 53.75 2yue s ARG 29 Cb -0.13 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.43 2yue s ARG 29 CO 0.03 -0.13 0.89 1.03 -1.08 0.00 0.00 175.30 176.05 2yue s ARG 30 N -3.91 4.56 0.00 3.89 1.81 -0.84 -1.89 118.95 122.56 2yue s ARG 30 Ca 0.07 1.27 0.00 0.00 -1.72 0.00 0.00 55.73 55.35 2yue s ARG 30 Cb 0.08 -3.43 0.00 0.00 -0.45 0.00 0.00 34.95 31.15 2yue s ARG 30 CO -0.10 0.07 0.43 1.97 -0.68 0.00 0.00 175.30 176.99 2yue n PHE 31 N 3.49 0.00 -4.16 -0.53 -1.74 -1.26 -4.90 117.46 108.37 2yue n PHE 31 Ca 0.03 -0.09 -0.08 0.00 -0.56 0.00 0.00 57.45 56.74 2yue n PHE 31 Cb 0.51 -0.01 -0.03 0.00 1.52 0.00 0.00 39.48 41.47 2yue n PHE 31 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 2yue n GLU 32 N -0.09 0.65 0.00 3.97 -0.58 -1.26 -5.02 120.64 118.32 2yue n GLU 32 Ca 0.00 -1.19 0.00 0.00 -0.42 0.00 0.00 57.16 55.55 2yue n GLU 32 Cb 0.24 0.72 0.00 0.00 -0.57 0.00 0.00 31.44 31.83 2yue n GLU 32 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2yue n SER 33 N -2.03 0.00 0.00 1.62 7.64 -1.26 -4.94 113.62 114.65 2yue n SER 33 Ca -0.01 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.61 2yue n SER 33 Cb 0.21 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 2yue n SER 33 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2yue n PHE 34 N -1.54 0.00 -1.60 1.43 1.16 -1.26 -5.14 117.46 110.52 2yue n PHE 34 Ca 0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.16 2yue n PHE 34 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2yue n PHE 34 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2yue n ARG 36 N 0.37 -2.88 -3.34 0.00 1.74 -1.25 -4.44 116.66 106.86 2yue n ARG 36 Ca 0.09 2.39 -0.26 0.00 -0.77 0.00 0.00 57.85 59.30 2yue n ARG 36 Cb 0.37 -4.74 -0.09 0.00 -1.02 0.00 0.00 32.46 26.98 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 0.50 2.75 -2.62 7.54 0.00 -1.26 -3.56 120.51 123.87 2yue n ALA 37 Ca 0.01 -3.27 -0.21 0.00 0.00 0.00 0.00 53.44 49.97 2yue n ALA 37 Cb 0.04 -0.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.58 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 1.23 0.02 0.00 1.01 -1.26 -2.94 121.20 118.82 2yue s ILE 38 Ca 0.34 -1.09 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 2yue s ILE 38 Cb 0.08 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.42 2yue s ILE 38 CO -0.17 0.01 -0.01 0.42 0.00 0.00 0.00 174.94 175.20 2yue s THR 39 N -0.90 0.12 0.30 2.92 -4.23 0.90 -0.12 115.64 114.63 2yue s THR 39 Ca 0.02 -1.02 0.01 0.00 -1.18 0.00 0.00 61.69 59.53 2yue s THR 39 Cb -0.08 -0.48 -0.01 0.00 1.34 0.00 0.00 72.50 73.27 2yue s THR 39 CO 0.02 -0.56 0.05 0.49 -0.54 0.00 0.00 174.62 174.08 2yue n PHE 40 N 1.34 0.39 -3.58 3.99 3.01 -1.26 -0.70 117.46 120.65 2yue n PHE 40 Ca -0.22 -1.68 -0.37 0.00 1.01 0.00 0.00 57.45 56.19 2yue n PHE 40 Cb 0.56 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.87 2yue n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2yue s SER 41 N -2.72 6.71 0.07 4.37 1.04 -0.76 -1.63 113.70 120.77 2yue s SER 41 Ca 0.08 0.85 -0.20 0.00 0.48 0.00 0.00 55.95 57.15 2yue s SER 41 Cb 0.00 -2.20 -0.11 0.00 0.10 0.00 0.00 66.02 63.81 2yue s SER 41 CO 0.05 0.30 1.52 0.00 0.98 0.00 0.00 173.24 176.10 2yue h ALA 42 N 4.50 0.24 -3.08 5.32 0.00 -1.53 -3.37 119.26 121.34 2yue h ALA 42 Ca -0.51 -0.18 -0.53 0.00 0.00 0.00 0.00 54.91 53.68 2yue h ALA 42 Cb 1.21 -0.07 -0.19 0.00 0.00 0.00 0.00 17.79 18.75 2yue h ALA 42 CO 0.62 -0.07 -0.79 1.03 0.00 0.00 0.00 179.25 180.04 2yue s ARG 43 N -5.10 1.25 -0.12 0.00 0.52 -1.26 -4.89 118.95 109.36 2yue s ARG 43 Ca -0.14 -1.36 -0.29 0.00 -0.52 0.00 0.00 55.73 53.42 2yue s ARG 43 Cb 0.06 -1.36 -0.04 0.00 0.52 0.00 0.00 34.95 34.14 2yue s ARG 43 CO 0.72 0.28 1.54 -1.25 0.02 0.00 0.00 175.30 176.61 2yue s PRO 44 N -2.61 4.12 0.37 3.54 0.04 -1.26 -4.82 135.00 134.38 2yue s PRO 44 Ca 0.14 1.94 -0.06 0.00 0.04 0.00 0.00 61.00 63.06 2yue s PRO 44 Cb -0.07 -3.93 -0.05 0.00 0.04 0.00 0.00 34.50 30.49 2yue s PRO 44 CO 0.06 -0.89 0.67 0.14 0.04 0.00 0.00 177.00 177.02 2yue s VAL 45 N 4.10 4.93 0.72 -0.36 -7.23 -1.04 -4.93 120.40 116.60 2yue s VAL 45 Ca 0.68 0.22 -0.06 0.00 -1.81 0.00 0.00 61.98 61.00 2yue s VAL 45 Cb -0.28 -3.77 0.09 0.00 0.56 0.00 0.00 36.38 32.97 2yue s VAL 45 CO 0.25 -0.52 1.03 -0.13 -0.31 0.00 0.00 175.10 175.42 2yue s ARG 46 N -3.97 1.94 0.02 4.82 0.52 -1.26 -4.30 118.95 116.72 2yue s ARG 46 Ca 0.47 -0.49 -0.11 0.00 -0.52 0.00 0.00 55.73 55.08 2yue s ARG 46 Cb -0.10 -2.19 -0.06 0.00 0.52 0.00 0.00 34.95 33.12 2yue s ARG 46 CO 0.34 -1.37 1.17 0.82 0.02 0.00 0.00 175.30 176.27 2yue h ILE 47 N -0.65 0.00 0.00 1.52 1.08 -1.95 -2.57 117.51 114.94 2yue h ILE 47 Ca -0.43 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.04 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 -0.01 0.78 -0.69 0.00 0.00 178.15 178.76 2yue h ASN 48 N -0.35 0.00 -1.36 1.72 -0.26 -1.89 -3.10 115.58 110.35 2yue h ASN 48 Ca -0.03 0.00 -0.67 0.00 -0.56 0.00 0.00 56.30 55.04 2yue h ASN 48 Cb 0.29 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.54 2yue h ASN 48 CO 0.02 0.01 1.31 1.21 -1.06 0.00 0.00 177.43 178.92 2yue n GLU 49 N -3.18 1.32 -3.00 0.81 2.13 -0.97 -4.79 120.64 112.96 2yue n GLU 49 Ca -0.02 0.40 -0.39 0.00 0.66 0.00 0.00 57.16 57.81 2yue n GLU 49 Cb 0.12 -2.50 -0.06 0.00 0.27 0.00 0.00 31.44 29.28 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 5.54 4.54 -0.23 5.31 3.52 -1.26 -4.60 118.95 131.77 2yue s ARG 50 Ca 1.05 1.12 0.00 0.00 -0.13 0.00 0.00 55.73 57.77 2yue s ARG 50 Cb -0.83 -3.28 0.03 0.00 -1.56 0.00 0.00 34.95 29.32 2yue s ARG 50 CO 0.51 0.52 -0.11 0.42 -0.81 0.00 0.00 175.30 175.83 2yue s ILE 51 N -0.95 2.49 -0.01 4.11 1.01 -0.97 -4.44 121.20 122.44 2yue s ILE 51 Ca 0.36 -1.14 -0.01 0.00 0.00 0.00 0.00 60.65 59.86 2yue s ILE 51 Cb -0.22 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 2yue s ILE 51 CO 0.25 0.25 0.13 0.00 0.00 0.00 0.00 174.94 175.57 2yue s VAL 53 N -1.25 -0.27 -0.18 0.00 1.01 0.73 -1.55 120.40 118.89 2yue s VAL 53 Ca 0.25 0.07 -0.20 0.00 0.00 0.00 0.00 61.98 62.10 2yue s VAL 53 Cb -0.12 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 2yue s VAL 53 CO 0.16 -0.07 0.59 -0.75 0.00 0.00 0.00 175.10 175.03 2yue s LYS 54 N 2.29 4.23 -0.94 2.72 2.20 0.86 -0.11 119.74 130.99 2yue s LYS 54 Ca 0.04 0.57 -0.24 0.00 -0.36 0.00 0.00 55.97 55.98 2yue s LYS 54 Cb -0.14 -3.55 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 2yue s LYS 54 CO -0.09 -0.16 1.87 -0.06 -0.36 0.00 0.00 175.35 176.55 2yue s PHE 55 N 1.65 1.93 0.05 4.03 0.08 -0.45 -1.21 117.98 124.07 2yue s PHE 55 Ca 0.28 0.37 -0.17 0.00 0.12 0.00 0.00 56.93 57.53 2yue s PHE 55 Cb -0.16 -4.15 -0.07 0.00 -0.57 0.00 0.00 43.02 38.07 2yue s PHE 55 CO 0.11 -1.75 1.27 0.00 -0.10 0.00 0.00 175.22 174.75 2yue h ALA 56 N 10.95 -0.79 -3.84 5.36 0.00 -1.47 -2.79 119.26 126.67 2yue h ALA 56 Ca 0.12 -0.06 -0.63 0.00 0.00 0.00 0.00 54.91 54.34 2yue h ALA 56 Cb 1.00 0.65 -0.22 0.00 0.00 0.00 0.00 17.79 19.21 2yue h ALA 56 CO 1.25 -0.85 -0.85 -1.21 0.00 0.00 0.00 179.25 177.58 2yue s GLU 57 N -4.35 1.31 0.01 0.00 0.41 0.94 -4.56 118.70 112.46 2yue s GLU 57 Ca -0.08 -1.24 0.02 0.00 -0.41 0.00 0.00 54.97 53.26 2yue s GLU 57 Cb 0.03 -1.67 -0.01 0.00 -1.78 0.00 0.00 34.13 30.70 2yue s GLU 57 CO 0.29 0.40 -0.06 0.42 -0.49 0.00 0.00 175.26 175.82 2yue s ILE 58 N -1.07 0.45 -0.25 -1.63 -1.09 -1.26 -2.20 121.20 114.15 2yue s ILE 58 Ca 0.10 -0.50 -0.06 0.00 -2.23 0.00 0.00 60.65 57.97 2yue s ILE 58 Cb -0.10 -0.43 -0.01 0.00 -1.58 0.00 0.00 42.46 40.34 2yue s ILE 58 CO 0.05 -0.04 0.03 -0.94 -1.23 0.00 0.00 174.94 172.80 2yue s SER 59 N -0.59 4.82 -1.01 3.58 1.04 -1.12 -4.81 113.70 115.61 2yue s SER 59 Ca -0.02 -0.41 -0.02 0.00 0.48 0.00 0.00 55.95 55.98 2yue s SER 59 Cb -0.05 -1.84 0.31 0.00 0.10 0.00 0.00 66.02 64.54 2yue s SER 59 CO -0.00 -0.07 1.52 -3.20 0.98 0.00 0.00 173.24 172.47 2yue n ASN 60 N 4.86 6.47 0.07 7.02 2.85 -1.26 -3.93 115.26 131.33 2yue n ASN 60 Ca -0.16 -3.52 0.00 0.00 -0.11 0.00 0.00 54.58 50.79 2yue n ASN 60 Cb 0.50 -1.17 0.00 0.00 1.24 0.00 0.00 39.78 40.36 2yue n ASN 60 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2yue n ASN 61 N 0.77 -0.96 -3.16 1.20 2.85 -1.26 -5.14 115.26 109.55 2yue n ASN 61 Ca 0.33 0.25 -0.22 0.00 -0.11 0.00 0.00 54.58 54.84 2yue n ASN 61 Cb 0.32 1.15 0.21 0.00 1.24 0.00 0.00 39.78 42.69 2yue n ASN 61 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 2yue n TRP 62 N -2.80 -3.32 -4.16 1.20 5.03 -1.26 -5.06 117.44 107.06 2yue n TRP 62 Ca 0.00 -0.59 -0.16 0.00 3.03 0.00 0.00 57.50 59.78 2yue n TRP 62 Cb 0.00 -0.88 -0.15 0.00 -1.03 0.00 0.00 31.31 29.26 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 -2.87 0.64 0.00 -0.99 0.02 -1.26 -4.74 114.94 105.73 2yue s ASN 63 Ca 0.48 -0.10 0.00 0.00 -1.02 0.00 0.00 52.86 52.22 2yue s ASN 63 Cb -0.08 -0.09 0.00 0.00 0.02 0.00 0.00 41.25 41.10 2yue s ASN 63 CO 0.40 0.06 0.00 0.61 0.02 0.00 0.00 177.10 178.18 2yue n GLY 64 N 3.02 0.85 3.26 0.66 0.00 -1.26 -4.67 105.19 107.05 2yue n GLY 64 Ca -0.14 -2.01 -0.11 0.00 0.00 0.00 0.00 46.02 43.76 2yue n GLY 64 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yue s GLY 65 N 0.00 -0.31 1.35 -0.02 0.00 -1.26 -4.18 107.32 102.89 2yue s GLY 65 Ca 0.00 1.46 -0.21 0.00 0.00 0.00 0.00 44.72 45.97 2yue s GLY 65 CO 0.00 1.59 0.75 0.29 0.00 0.00 0.00 173.10 175.73 2yue n ILE 66 N 4.14 0.00 -3.81 0.90 -5.35 -1.23 -4.53 119.36 109.49 2yue n ILE 66 Ca -0.23 -0.04 -0.12 0.00 -0.27 0.00 0.00 62.75 62.09 2yue n ILE 66 Cb 0.55 -0.86 -0.10 0.00 -1.74 0.00 0.00 39.64 37.49 2yue n ILE 66 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2yue s ARG 67 N -4.63 0.52 0.01 6.28 1.04 -1.17 -3.61 118.95 117.39 2yue s ARG 67 Ca 0.59 -0.14 -0.07 0.00 -1.04 0.00 0.00 55.73 55.07 2yue s ARG 67 Cb -0.11 0.23 -0.00 0.00 -2.04 0.00 0.00 34.95 33.03 2yue s ARG 67 CO 0.51 -0.13 0.13 -0.59 -0.04 0.00 0.00 175.30 175.18 2yue s PHE 68 N -1.02 0.06 0.00 5.89 -0.71 -1.00 -1.35 117.98 119.85 2yue s PHE 68 Ca -0.11 -0.18 0.00 0.00 -1.04 0.00 0.00 56.93 55.60 2yue s PHE 68 Cb -0.05 -0.06 0.00 0.00 -1.21 0.00 0.00 43.02 41.70 2yue s PHE 68 CO 0.02 -0.29 0.00 0.41 -1.34 0.00 0.00 175.22 174.02 2yue n GLY 69 N 1.39 0.89 3.47 1.99 0.00 -0.26 -1.14 105.19 111.53 2yue n GLY 69 Ca -0.23 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.30 2.19 0.01 1.61 0.08 -1.00 -0.73 117.98 117.83 2yue s PHE 70 Ca 0.00 -0.49 0.00 0.00 0.12 0.00 0.00 56.93 56.57 2yue s PHE 70 Cb 0.00 -1.12 -0.01 0.00 -0.57 0.00 0.00 43.02 41.33 2yue s PHE 70 CO 0.00 0.55 -0.02 -0.08 -0.10 0.00 0.00 175.22 175.57 2yue s THR 71 N -2.70 0.10 0.09 0.64 -1.32 -0.13 -0.13 115.64 112.18 2yue s THR 71 Ca 0.30 -0.30 0.06 0.00 -1.21 0.00 0.00 61.69 60.54 2yue s THR 71 Cb -0.00 -0.14 -0.22 0.00 -1.51 0.00 0.00 72.50 70.63 2yue s THR 71 CO 0.14 -0.13 1.17 -1.28 -2.21 0.00 0.00 174.62 172.31 2yue h SER 72 N 5.68 0.06 -4.26 8.08 0.87 -0.77 -2.89 113.55 120.33 2yue h SER 72 Ca -0.27 -0.07 -0.49 0.00 -1.23 0.00 0.00 61.79 59.73 2yue h SER 72 Cb 1.21 -0.02 0.04 0.00 -0.44 0.00 0.00 62.40 63.19 2yue h SER 72 CO 0.48 1.05 0.39 0.20 -0.53 0.00 0.00 176.83 178.42 2yue s ASN 73 N -6.69 6.25 0.38 6.23 0.01 -1.26 -4.91 114.94 114.95 2yue s ASN 73 Ca -0.01 1.57 -0.23 0.00 -0.71 0.00 0.00 52.86 53.48 2yue s ASN 73 Cb 0.09 -2.50 -0.10 0.00 0.41 0.00 0.00 41.25 39.15 2yue s ASN 73 CO 0.83 -0.85 0.95 -1.81 -1.51 0.00 0.00 177.10 174.71 2yue s ASP 74 N -3.43 7.13 0.37 -1.22 1.01 -1.26 -4.78 116.67 114.49 2yue s ASP 74 Ca 0.58 1.76 0.16 0.00 0.71 0.00 0.00 52.55 55.76 2yue s ASP 74 Cb -0.12 -2.56 0.71 0.00 1.01 0.00 0.00 42.92 41.97 2yue s ASP 74 CO 0.41 -0.22 1.78 1.55 0.21 0.00 0.00 175.17 178.90 2yue h PRO 75 N 2.51 0.00 0.00 8.23 0.13 -1.96 -2.78 132.00 138.13 2yue h PRO 75 Ca -0.48 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2yue h PRO 75 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2yue h PRO 75 CO 0.63 0.39 -0.14 -0.39 -0.23 0.00 0.00 178.00 178.26 2yue h VAL 76 N 0.00 0.36 -0.11 1.56 -1.51 -1.95 -2.41 116.25 112.18 2yue h VAL 76 Ca -0.00 -0.89 0.00 0.00 -1.23 0.00 0.00 66.70 64.58 2yue h VAL 76 Cb 0.79 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.62 2yue h VAL 76 CO 0.05 0.14 0.00 0.35 -1.23 0.00 0.00 177.57 176.88 2yue n THR 77 N -3.29 0.14 -0.03 7.19 -2.24 -1.05 -3.33 114.28 111.66 2yue n THR 77 Ca 0.00 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2yue n THR 77 Cb 0.38 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 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 -0.12 0.53 -4.64 3.22 4.77 -0.92 -4.96 117.00 114.88 2yue n LEU 78 Ca 0.14 -0.74 -0.50 0.00 -0.03 0.00 0.00 56.01 54.89 2yue n LEU 78 Cb 0.21 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 2yue n LEU 78 CO 0.11 0.13 1.10 1.21 -1.33 0.00 0.00 177.39 178.61 2yue n GLU 79 N -0.41 1.63 -2.65 3.23 2.13 -1.16 -0.55 120.64 122.85 2yue n GLU 79 Ca 0.00 0.59 -0.18 0.00 0.66 0.00 0.00 57.16 58.23 2yue n GLU 79 Cb 0.01 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.42 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 3.15 -0.50 2.65 8.31 0.00 -1.26 -4.85 105.19 112.68 2yue n GLY 80 Ca 0.19 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.82 0.04 -4.23 2.61 -2.24 0.28 -5.14 114.28 101.79 2yue n THR 81 Ca -0.15 -2.01 -0.28 0.00 -2.27 0.00 0.00 64.05 59.34 2yue n THR 81 Cb 0.62 1.09 -0.09 0.00 -2.10 0.00 0.00 70.33 69.85 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 -2.58 3.12 1.16 3.22 1.43 -1.25 -4.81 118.68 118.97 2yue s LEU 82 Ca 0.25 -0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 52.76 2yue s LEU 82 Cb 0.34 -1.86 0.27 0.00 0.03 0.00 0.00 46.19 44.97 2yue s LEU 82 CO -0.06 0.14 1.11 -2.16 0.23 0.00 0.00 176.35 175.61 2yue s PRO 83 N -2.52 -0.86 0.10 1.29 0.04 -1.26 -4.97 135.00 126.81 2yue s PRO 83 Ca 0.24 0.07 -0.16 0.00 0.04 0.00 0.00 61.00 61.19 2yue s PRO 83 Cb -0.10 -1.63 -0.07 0.00 0.04 0.00 0.00 34.50 32.74 2yue s PRO 83 CO 0.16 -3.50 1.47 0.87 0.04 0.00 0.00 177.00 176.04 2yue h LYS 84 N -2.43 0.63 0.00 4.56 1.57 -2.00 -3.46 116.57 115.44 2yue h LYS 84 Ca -0.47 -0.27 -0.49 0.00 -1.87 0.00 0.00 60.65 57.54 2yue h LYS 84 Cb 1.30 -0.02 -0.09 0.00 0.08 0.00 0.00 32.23 33.51 2yue h LYS 84 CO 0.40 0.85 -0.34 2.48 -0.57 0.00 0.00 179.45 182.27 2yue n TYR 85 N -4.40 0.69 -0.38 -1.35 0.18 -1.26 -3.92 117.16 106.72 2yue n TYR 85 Ca -0.03 -1.86 0.12 0.00 1.88 0.00 0.00 57.90 58.00 2yue n TYR 85 Cb 0.37 -0.26 0.32 0.00 -0.38 0.00 0.00 39.34 39.40 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 -1.83 2.41 0.00 -3.48 0.00 -1.26 -4.48 120.51 111.87 2yue n ALA 86 Ca -0.15 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 51.97 2yue n ALA 86 Cb 0.48 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.01 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 0.09 0.00 0.00 -0.04 -1.26 -4.82 135.00 128.94 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 -3.67 3.54 8.00 -1.26 -1.42 116.55 120.34 2yue n ASP 89 Ca 0.05 0.83 -0.43 0.00 0.71 0.00 0.00 54.79 55.95 2yue n ASP 89 Cb 0.14 -0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 40.88 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 -2.20 5.34 0.01 0.64 4.77 -1.18 -3.55 117.00 120.84 2yue n LEU 90 Ca 0.00 -3.45 0.00 0.00 -0.03 0.00 0.00 56.01 52.53 2yue n LEU 90 Cb 0.00 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 2yue n LEU 90 CO 0.00 0.30 0.00 0.35 -1.33 0.00 0.00 177.39 176.71 2yue n THR 91 N 5.58 0.00 0.23 -5.08 -2.24 -1.05 -4.49 114.28 107.25 2yue n THR 91 Ca 0.51 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 62.45 2yue n THR 91 Cb 0.40 0.00 0.86 0.00 -2.10 0.00 0.00 70.33 69.48 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 0.00 -3.46 3.42 7.08 -1.28 -3.38 115.58 117.96 2yue h ASN 92 Ca 0.00 0.00 -0.56 0.00 -3.08 0.00 0.00 56.30 52.66 2yue h ASN 92 Cb 0.00 0.00 0.18 0.00 -2.08 0.00 0.00 38.32 36.42 2yue h ASN 92 CO 0.00 0.00 -0.18 0.54 -2.08 0.00 0.00 177.43 175.71 2yue n ARG 93 N -3.79 0.39 -2.07 4.14 1.74 -1.25 -4.84 116.66 110.98 2yue n ARG 93 Ca 0.00 0.18 -0.41 0.00 -0.77 0.00 0.00 57.85 56.85 2yue n ARG 93 Cb 0.26 -2.00 -0.03 0.00 -1.02 0.00 0.00 32.46 29.68 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 -3.01 3.11 0.00 5.56 0.04 -1.26 -2.14 135.00 137.30 2yue s PRO 94 Ca 0.69 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.77 2yue s PRO 94 Cb -0.35 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 29.95 2yue s PRO 94 CO 0.55 -2.14 0.00 0.41 0.04 0.00 0.00 177.00 175.86 2yue n GLY 95 N 5.47 0.82 3.55 0.56 0.00 -1.26 -4.67 105.19 109.65 2yue n GLY 95 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2yue n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yue s PHE 96 N -2.00 3.17 0.14 1.61 0.40 -0.91 -0.09 117.98 120.30 2yue s PHE 96 Ca 0.00 -0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.25 2yue s PHE 96 Cb 0.00 -2.19 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 2yue s PHE 96 CO 0.00 -0.11 -0.13 -1.58 0.70 0.00 0.00 175.22 174.10 2yue s TRP 97 N 1.10 1.39 -0.28 0.36 0.51 0.81 -4.52 118.94 118.31 2yue s TRP 97 Ca 0.05 -0.61 -0.28 0.00 -2.12 0.00 0.00 56.10 53.13 2yue s TRP 97 Cb -0.14 -0.71 0.19 0.00 -0.81 0.00 0.00 33.47 32.00 2yue s TRP 97 CO 0.04 0.15 1.36 0.00 -0.51 0.00 0.00 176.95 177.99 2yue s ALA 98 N -2.55 -2.13 0.39 0.98 0.00 -1.26 -2.38 121.76 114.80 2yue s ALA 98 Ca 0.12 1.84 0.06 0.00 0.00 0.00 0.00 51.96 53.98 2yue s ALA 98 Cb -0.02 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.53 2yue s ALA 98 CO 0.03 -0.21 0.21 1.17 0.00 0.00 0.00 175.76 176.95 2yue n LYS 99 N 0.76 0.50 -4.89 0.00 3.00 -0.29 -4.93 118.16 112.32 2yue n LYS 99 Ca -0.03 -3.53 -0.32 0.00 -0.00 0.00 0.00 58.31 54.43 2yue n LYS 99 Cb 0.58 2.30 -0.13 0.00 0.00 0.00 0.00 35.03 37.79 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 -3.25 2.61 0.13 3.14 0.00 -1.26 -2.36 121.76 120.76 2yue s ALA 100 Ca 0.29 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 2yue s ALA 100 Cb 0.01 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 2yue s ALA 100 CO 0.21 0.56 0.33 -1.17 0.00 0.00 0.00 175.76 175.69 2yue s LEU 101 N -0.85 4.29 0.83 0.00 0.20 -1.24 -5.04 118.68 116.87 2yue s LEU 101 Ca 0.12 0.48 -0.11 0.00 0.69 0.00 0.00 54.13 55.31 2yue s LEU 101 Cb -0.11 -3.20 0.10 0.00 -0.43 0.00 0.00 46.19 42.55 2yue s LEU 101 CO 0.01 0.07 1.13 -2.28 -0.29 0.00 0.00 176.35 174.99 2yue s HIS 102 N -1.64 2.10 -1.23 5.38 5.65 -1.26 -4.76 115.29 119.51 2yue s HIS 102 Ca 0.39 1.67 0.29 0.00 0.25 0.00 0.00 55.06 57.67 2yue s HIS 102 Cb -0.12 -3.22 1.35 0.00 -1.18 0.00 0.00 32.58 29.41 2yue s HIS 102 CO 0.26 -2.32 1.97 -0.85 -0.65 0.00 0.00 174.74 173.15 2yue n GLU 103 N -3.77 0.24 0.00 2.88 0.28 -1.26 -3.01 120.64 115.99 2yue n GLU 103 Ca 0.11 -0.01 0.14 0.00 -0.16 0.00 0.00 57.16 57.23 2yue n GLU 103 Cb 0.52 -1.50 0.53 0.00 1.43 0.00 0.00 31.44 32.43 2yue n GLU 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2yue n GLN 104 N -1.37 0.49 -0.42 3.44 10.64 -1.26 -3.56 117.38 125.33 2yue n GLN 104 Ca 0.11 -0.19 0.07 0.00 -1.83 0.00 0.00 57.00 55.16 2yue n GLN 104 Cb 0.29 -1.50 0.15 0.00 -0.86 0.00 0.00 30.24 28.33 2yue n GLN 104 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2yue n TYR 105 N -1.09 0.00 -1.09 2.61 4.01 -1.16 -4.67 117.16 115.77 2yue n TYR 105 Ca 0.12 -1.12 0.03 0.00 -0.16 0.00 0.00 57.90 56.77 2yue n TYR 105 Cb 0.30 -0.19 0.27 0.00 -0.31 0.00 0.00 39.34 39.41 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 -2.94 2.71 0.79 0.00 8.01 -1.26 -4.89 118.70 121.12 2yue s GLU 107 Ca 0.46 0.36 -0.12 0.00 0.01 0.00 0.00 54.97 55.68 2yue s GLU 107 Cb 0.38 -2.03 0.07 0.00 -4.31 0.00 0.00 34.13 28.23 2yue s GLU 107 CO 0.08 -1.10 1.16 0.21 0.01 0.00 0.00 175.26 175.62 2yue s LYS 108 N -5.37 2.13 -1.11 1.61 2.20 -1.26 -3.92 119.74 114.03 2yue s LYS 108 Ca 0.58 0.20 -0.01 0.00 -0.36 0.00 0.00 55.97 56.39 2yue s LYS 108 Cb -0.11 -1.96 0.01 0.00 -1.51 0.00 0.00 37.83 34.26 2yue s LYS 108 CO 0.51 -1.50 0.07 -3.47 -0.36 0.00 0.00 175.35 170.60 2yue n ASP 109 N -3.27 -4.02 -4.52 1.43 -0.08 -1.05 -4.94 116.55 100.10 2yue n ASP 109 Ca 0.08 0.12 -0.34 0.00 -1.51 0.00 0.00 54.79 53.14 2yue n ASP 109 Cb 0.60 -3.40 -0.12 0.00 2.34 0.00 0.00 41.12 40.54 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 -2.12 4.49 -0.54 1.67 -0.87 -1.25 -4.95 114.94 111.37 2yue s ASN 110 Ca 0.05 -0.11 -0.18 0.00 -1.57 0.00 0.00 52.86 51.05 2yue s ASN 110 Cb -0.02 -1.29 0.09 0.00 -0.02 0.00 0.00 41.25 40.01 2yue s ASN 110 CO 0.06 0.30 0.60 -0.63 -2.57 0.00 0.00 177.10 174.86 2yue s ILE 111 N -0.43 4.97 -0.50 0.60 1.01 -1.26 -1.34 121.20 124.25 2yue s ILE 111 Ca 0.06 -0.97 -0.20 0.00 0.00 0.00 0.00 60.65 59.53 2yue s ILE 111 Cb -0.12 -4.36 0.05 0.00 0.01 0.00 0.00 42.46 38.04 2yue s ILE 111 CO 0.02 -0.92 0.69 -0.22 0.00 0.00 0.00 174.94 174.51 2yue s LEU 112 N 2.31 4.71 -0.02 2.97 2.96 0.84 -2.75 118.68 129.71 2yue s LEU 112 Ca 0.10 -0.70 0.03 0.00 -0.22 0.00 0.00 54.13 53.34 2yue s LEU 112 Cb -0.24 -2.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.85 2yue s LEU 112 CO 0.07 -0.94 -0.09 -0.72 -1.32 0.00 0.00 176.35 173.35 2yue s TYR 113 N 2.92 2.83 -0.18 5.38 -0.85 -0.82 -0.19 117.35 126.44 2yue s TYR 113 Ca 0.19 -0.07 -0.16 0.00 -0.52 0.00 0.00 57.07 56.52 2yue s TYR 113 Cb -0.17 -1.62 0.05 0.00 0.38 0.00 0.00 41.96 40.60 2yue s TYR 113 CO 0.15 0.32 0.48 1.52 -1.52 0.00 0.00 175.55 176.49 2yue s TYR 114 N -0.91 -0.55 0.08 -3.49 1.13 -0.35 -0.51 117.35 112.75 2yue s TYR 114 Ca 0.15 1.31 0.01 0.00 -1.41 0.00 0.00 57.07 57.13 2yue s TYR 114 Cb -0.11 0.21 -0.00 0.00 -1.10 0.00 0.00 41.96 40.95 2yue s TYR 114 CO 0.05 -0.27 0.09 2.48 -2.51 0.00 0.00 175.55 175.38 2yue n TYR 115 N 3.05 -0.40 -3.90 -3.49 4.11 0.35 -2.30 117.16 114.60 2yue n TYR 115 Ca -0.15 -0.61 -0.11 0.00 -0.00 0.00 0.00 57.90 57.04 2yue n TYR 115 Cb 0.57 0.09 -0.12 0.00 -0.00 0.00 0.00 39.34 39.88 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 -2.40 0.04 0.59 -3.48 0.11 -1.17 -0.10 120.40 113.99 2yue s VAL 116 Ca 0.08 -0.35 0.03 0.00 -2.93 0.00 0.00 61.98 58.82 2yue s VAL 116 Cb 0.00 -0.17 0.11 0.00 -1.53 0.00 0.00 36.38 34.80 2yue s VAL 116 CO 0.06 -0.19 0.81 -0.46 -3.33 0.00 0.00 175.10 171.99 2yue n ASN 117 N 2.44 1.47 0.00 3.54 0.23 -0.42 -3.22 115.26 119.30 2yue n ASN 117 Ca -0.17 -2.15 0.07 0.00 -0.53 0.00 0.00 54.58 51.81 2yue n ASN 117 Cb 0.58 -0.49 0.33 0.00 -2.08 0.00 0.00 39.78 38.12 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 -1.55 -0.97 1.83 4.83 0.00 -1.26 -2.55 105.19 105.52 2yue n GLY 118 Ca 0.15 -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 -1.46 4.48 -2.21 4.61 0.00 -1.26 -4.87 120.51 119.80 2yue n ALA 119 Ca 0.04 -1.99 -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 -0.13 3.39 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 4.97 -0.27 1.61 1.01 -1.26 -3.38 116.67 117.32 2yue s ASP 121 Ca 0.00 -0.37 -0.16 0.00 0.71 0.00 0.00 52.55 52.73 2yue s ASP 121 Cb 0.00 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 2yue s ASP 121 CO 0.00 -0.07 0.44 -0.69 0.21 0.00 0.00 175.17 175.05 2yue s VAL 122 N 1.56 5.12 0.04 -1.27 1.01 0.79 -1.30 120.40 126.36 2yue s VAL 122 Ca 0.05 0.69 0.06 0.00 0.00 0.00 0.00 61.98 62.78 2yue s VAL 122 Cb -0.15 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2yue s VAL 122 CO 0.02 0.11 -0.13 -0.63 0.00 0.00 0.00 175.10 174.47 2yue s ILE 123 N 2.18 3.14 0.34 2.22 1.09 0.86 -0.13 121.20 130.90 2yue s ILE 123 Ca 0.18 -1.08 0.04 0.00 -1.10 0.00 0.00 60.65 58.68 2yue s ILE 123 Cb -0.16 -2.37 -0.06 0.00 -1.06 0.00 0.00 42.46 38.82 2yue s ILE 123 CO 0.10 0.31 0.06 -0.72 -0.10 0.00 0.00 174.94 174.59 2yue s TYR 124 N -1.00 2.00 0.04 3.97 1.13 -1.25 -0.49 117.35 121.75 2yue s TYR 124 Ca 0.17 -0.96 -0.28 0.00 -1.41 0.00 0.00 57.07 54.59 2yue s TYR 124 Cb -0.11 -1.33 0.10 0.00 -1.10 0.00 0.00 41.96 39.52 2yue s TYR 124 CO 0.07 0.03 1.14 0.20 -2.51 0.00 0.00 175.55 174.49 2yue s GLY 125 N -3.53 -0.34 -0.11 5.49 0.00 0.33 -2.28 107.32 106.89 2yue s GLY 125 Ca 0.35 0.52 -0.01 0.00 0.00 0.00 0.00 44.72 45.57 2yue s GLY 125 CO 0.15 0.10 -0.02 -0.42 0.00 0.00 0.00 173.10 172.91 2yue s ILE 126 N -2.79 0.66 -1.06 0.90 -1.09 -1.23 -1.94 121.20 114.65 2yue s ILE 126 Ca 0.13 -0.17 -0.05 0.00 -2.23 0.00 0.00 60.65 58.33 2yue s ILE 126 Cb 0.02 -0.83 -0.06 0.00 -1.58 0.00 0.00 42.46 40.01 2yue s ILE 126 CO -0.02 0.21 0.92 0.59 -1.23 0.00 0.00 174.94 175.41 2yue n ASN 127 N 5.05 -5.89 -3.54 3.58 3.02 -1.11 -3.54 115.26 112.83 2yue n ASN 127 Ca -0.09 -0.69 -0.24 0.00 -0.03 0.00 0.00 54.58 53.53 2yue n ASN 127 Cb 0.49 -5.15 0.04 0.00 -0.61 0.00 0.00 39.78 34.55 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 -3.19 -5.86 -2.81 6.41 2.85 -1.26 -4.97 115.26 106.43 2yue n ASN 128 Ca -0.10 -0.83 -0.09 0.00 -0.11 0.00 0.00 54.58 53.45 2yue n ASN 128 Cb 0.63 -3.76 0.03 0.00 1.24 0.00 0.00 39.78 37.92 2yue n ASN 128 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2yue n GLU 129 N -3.52 0.72 -1.79 1.20 1.02 -1.23 -5.14 120.64 111.90 2yue n GLU 129 Ca -0.10 -1.95 -0.38 0.00 -0.02 0.00 0.00 57.16 54.72 2yue n GLU 129 Cb 0.59 -1.45 0.05 0.00 -0.02 0.00 0.00 31.44 30.61 2yue n GLU 129 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2yue s GLU 130 N 0.54 2.96 -0.05 3.49 1.03 -1.26 -3.49 118.70 121.92 2yue s GLU 130 Ca 0.32 2.16 0.11 0.00 0.03 0.00 0.00 54.97 57.58 2yue s GLU 130 Cb 0.18 -2.12 -0.16 0.00 -0.80 0.00 0.00 34.13 31.24 2yue s GLU 130 CO -0.20 -1.31 0.17 1.63 -1.33 0.00 0.00 175.26 174.22 2yue n LYS 131 N -1.32 1.10 0.00 -4.83 4.76 -0.97 -4.98 118.16 111.93 2yue n LYS 131 Ca 0.12 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2yue n LYS 131 Cb 0.46 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.38 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 2.05 2.05 3.68 0.72 0.00 -1.26 -5.05 105.19 107.38 2yue n GLY 132 Ca -0.08 -2.05 -0.46 0.00 0.00 0.00 0.00 46.02 43.43 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 -1.44 0.51 -0.05 1.61 3.14 -1.26 -3.90 118.33 116.93 2yue n VAL 133 Ca 0.00 -0.09 -0.05 0.00 -2.96 0.00 0.00 64.34 61.24 2yue n VAL 133 Cb 0.00 -1.93 -0.09 0.00 -1.06 0.00 0.00 33.84 30.77 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 4.92 0.74 -4.45 1.55 3.06 0.81 -4.96 119.36 121.03 2yue n ILE 134 Ca 0.21 -0.46 -0.20 0.00 -2.50 0.00 0.00 62.75 59.80 2yue n ILE 134 Cb 0.32 -0.72 -0.14 0.00 0.54 0.00 0.00 39.64 39.64 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 -4.81 2.09 0.00 9.51 2.96 -1.06 -4.98 118.68 122.40 2yue s LEU 135 Ca -0.05 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.57 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 0.44 0.09 0.17 0.35 -1.32 0.00 0.00 176.35 176.08 2yue n THR 136 N 2.37 0.00 -0.63 3.68 -2.24 -1.26 -0.15 114.28 116.05 2yue n THR 136 Ca -0.16 -2.19 0.00 0.00 -2.27 0.00 0.00 64.05 59.43 2yue n THR 136 Cb 0.55 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.56 0.69 3.57 3.38 0.00 -1.22 -4.99 105.19 106.06 2yue n GLY 137 Ca -0.02 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 4.77 0.51 -0.61 1.09 -1.23 -5.02 121.20 118.71 2yue s ILE 138 Ca 0.00 0.64 -0.20 0.00 -1.10 0.00 0.00 60.65 59.99 2yue s ILE 138 Cb 0.00 -4.19 -0.08 0.00 -1.06 0.00 0.00 42.46 37.13 2yue s ILE 138 CO 0.00 -0.47 1.06 -0.62 -0.10 0.00 0.00 174.94 174.81 2yue s ASP 139 N 1.90 6.16 -0.35 3.58 2.15 -1.26 -4.05 116.67 124.81 2yue s ASP 139 Ca 0.28 1.97 0.08 0.00 0.43 0.00 0.00 52.55 55.31 2yue s ASP 139 Cb -0.13 -2.56 0.45 0.00 -0.30 0.00 0.00 42.92 40.37 2yue s ASP 139 CO 0.18 -0.91 1.15 0.35 -0.17 0.00 0.00 175.17 175.77 2yue n THR 140 N -1.12 2.33 -0.06 1.71 -2.24 -1.26 -4.76 114.28 108.88 2yue n THR 140 Ca 0.10 -4.36 -0.12 0.00 -2.27 0.00 0.00 64.05 57.40 2yue n THR 140 Cb 0.52 -0.96 -0.04 0.00 -2.10 0.00 0.00 70.33 67.75 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 -0.59 0.30 -2.73 -0.78 5.12 -1.26 -5.07 116.66 111.64 2yue n ARG 141 Ca 0.38 0.13 -0.16 0.00 -1.93 0.00 0.00 57.85 56.27 2yue n ARG 141 Cb 0.84 -1.01 0.03 0.00 -1.16 0.00 0.00 32.46 31.15 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 -3.78 1.83 -4.48 0.55 2.88 -1.26 -5.10 113.62 104.26 2yue n SER 142 Ca -0.22 -2.21 -0.30 0.00 -1.33 0.00 0.00 58.87 54.81 2yue n SER 142 Cb 0.56 -0.19 0.21 0.00 -0.75 0.00 0.00 64.21 64.04 2yue n SER 142 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2yue n LEU 143 N 0.00 -0.21 -3.70 2.46 4.77 -1.26 -5.05 117.00 114.01 2yue n LEU 143 Ca 0.06 0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.99 2yue n LEU 143 Cb 0.44 -1.26 -0.10 0.00 -2.33 0.00 0.00 43.42 40.17 2yue n LEU 143 CO 0.27 -3.01 0.09 -0.76 -1.33 0.00 0.00 177.39 172.65 2yue s LEU 144 N -5.36 -0.04 0.15 2.23 1.43 -1.26 -4.88 118.68 110.95 2yue s LEU 144 Ca 0.65 0.93 0.09 0.00 -1.03 0.00 0.00 54.13 54.77 2yue s LEU 144 Cb -0.22 1.46 -0.04 0.00 0.03 0.00 0.00 46.19 47.42 2yue s LEU 144 CO 0.64 -0.19 -0.11 0.26 0.23 0.00 0.00 176.35 177.18 2yue s TRP 145 N 1.10 2.64 0.27 0.29 0.51 -1.09 -2.50 118.94 120.16 2yue s TRP 145 Ca -0.07 -0.21 -0.04 0.00 -2.12 0.00 0.00 56.10 53.65 2yue s TRP 145 Cb -0.07 -1.33 -0.05 0.00 -0.81 0.00 0.00 33.47 31.22 2yue s TRP 145 CO -0.10 0.47 0.52 0.95 -0.51 0.00 0.00 176.95 178.29 2yue s THR 146 N -1.50 5.06 -0.06 2.01 -4.23 -1.26 -0.96 115.64 114.70 2yue s THR 146 Ca 0.23 -0.03 -0.05 0.00 -1.18 0.00 0.00 61.69 60.66 2yue s THR 146 Cb -0.10 -3.73 0.02 0.00 1.34 0.00 0.00 72.50 70.03 2yue s THR 146 CO 0.14 -0.29 0.15 0.68 -0.54 0.00 0.00 174.62 174.76 2yue s VAL 147 N -2.04 -0.01 -0.05 2.29 -7.23 0.09 -1.83 120.40 111.62 2yue s VAL 147 Ca 0.43 0.04 -0.03 0.00 -1.81 0.00 0.00 61.98 60.61 2yue s VAL 147 Cb -0.11 -0.23 0.02 0.00 0.56 0.00 0.00 36.38 36.63 2yue s VAL 147 CO 0.30 0.02 0.12 -0.63 -0.31 0.00 0.00 175.10 174.59 2yue s ILE 148 N 0.34 -0.02 -0.33 -0.62 1.01 0.12 -1.10 121.20 120.59 2yue s ILE 148 Ca -0.02 0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.74 2yue s ILE 148 Cb -0.03 -0.19 0.10 0.00 0.01 0.00 0.00 42.46 42.35 2yue s ILE 148 CO -0.01 0.03 0.05 -0.62 0.00 0.00 0.00 174.94 174.38 2yue s ASP 149 N 0.49 4.70 0.16 3.58 -1.08 -0.46 -0.07 116.67 123.99 2yue s ASP 149 Ca -0.04 -2.08 -0.29 0.00 -0.52 0.00 0.00 52.55 49.62 2yue s ASP 149 Cb -0.05 -1.57 -0.07 0.00 -1.46 0.00 0.00 42.92 39.77 2yue s ASP 149 CO -0.02 -0.37 0.91 -0.63 0.52 0.00 0.00 175.17 175.58 2yue s ILE 150 N 0.96 4.36 0.01 4.11 1.09 -1.15 -3.03 121.20 127.55 2yue s ILE 150 Ca 0.10 1.98 0.00 0.00 -1.10 0.00 0.00 60.65 61.63 2yue s ILE 150 Cb -0.19 -4.28 0.00 0.00 -1.06 0.00 0.00 42.46 36.93 2yue s ILE 150 CO -0.09 0.41 0.00 0.00 -0.10 0.00 0.00 174.94 175.16 2yue n TYR 151 N 2.18 -1.06 -2.27 3.97 9.36 -1.26 -4.67 117.16 123.41 2yue n TYR 151 Ca -0.01 0.05 -0.42 0.00 3.32 0.00 0.00 57.90 60.85 2yue n TYR 151 Cb 0.48 0.31 -0.03 0.00 -0.63 0.00 0.00 39.34 39.47 2yue n TYR 151 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 2yue s GLY 152 N -2.00 0.81 -0.21 2.98 0.00 -1.26 -4.29 107.32 103.35 2yue s GLY 152 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 44.72 44.28 2yue s GLY 152 CO 0.00 2.96 0.01 -2.01 0.00 0.00 0.00 173.10 174.06 2yue n ASN 153 N 10.02 -7.31 -1.34 1.64 5.15 -1.26 -3.47 115.26 118.69 2yue n ASN 153 Ca 0.16 1.12 0.00 0.00 -0.60 0.00 0.00 54.58 55.27 2yue n ASN 153 Cb 0.49 -4.16 0.00 0.00 -0.53 0.00 0.00 39.78 35.58 2yue n ASN 153 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2yue n THR 155 N -0.11 0.00 -3.65 0.00 -2.24 -1.14 -2.79 114.28 104.35 2yue n THR 155 Ca 0.01 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.74 2yue n THR 155 Cb 0.07 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.69 -0.62 -0.10 3.38 0.00 -0.93 -1.99 107.32 106.37 2yue s GLY 156 Ca 0.00 2.18 0.03 0.00 0.00 0.00 0.00 44.72 46.94 2yue s GLY 156 CO 0.00 2.67 -0.22 -0.26 0.00 0.00 0.00 173.10 175.29 2yue s ILE 157 N 2.36 2.25 -0.15 0.90 -4.36 0.55 -0.04 121.20 122.72 2yue s ILE 157 Ca -0.07 -0.96 0.02 0.00 -0.26 0.00 0.00 60.65 59.39 2yue s ILE 157 Cb -0.10 -1.87 0.01 0.00 1.25 0.00 0.00 42.46 41.75 2yue s ILE 157 CO -0.18 0.55 -0.21 -0.70 0.24 0.00 0.00 174.94 174.64 2yue s GLU 158 N 0.29 3.02 0.49 0.37 2.12 -0.35 -0.45 118.70 124.19 2yue s GLU 158 Ca -0.16 -0.85 -0.19 0.00 0.36 0.00 0.00 54.97 54.13 2yue s GLU 158 Cb -0.17 -2.47 -0.08 0.00 0.26 0.00 0.00 34.13 31.67 2yue s GLU 158 CO 0.08 -0.06 1.01 -0.06 -0.54 0.00 0.00 175.26 175.69 2yue s PHE 159 N 0.92 3.17 0.31 5.30 0.40 -1.26 -0.10 117.98 126.72 2yue s PHE 159 Ca -0.04 1.55 0.07 0.00 -0.60 0.00 0.00 56.93 57.91 2yue s PHE 159 Cb -0.15 -2.94 -0.06 0.00 0.51 0.00 0.00 43.02 40.37 2yue s PHE 159 CO -0.04 -0.59 -0.04 -0.51 0.70 0.00 0.00 175.22 174.73 2yue s LEU 160 N -3.69 2.53 -0.45 -0.37 1.43 -0.59 -4.81 118.68 112.73 2yue s LEU 160 Ca 0.64 -1.23 -0.19 0.00 -1.03 0.00 0.00 54.13 52.31 2yue s LEU 160 Cb -0.13 -0.70 0.03 0.00 0.03 0.00 0.00 46.19 45.42 2yue s LEU 160 CO 0.23 -0.36 0.54 -1.81 0.23 0.00 0.00 176.35 175.18 2yue s ASP 161 N -3.51 6.24 0.43 2.29 1.11 -1.26 -4.25 116.67 117.72 2yue s ASP 161 Ca 0.32 -0.67 0.19 0.00 0.18 0.00 0.00 52.55 52.57 2yue s ASP 161 Cb 0.05 -2.27 1.13 0.00 1.07 0.00 0.00 42.92 42.90 2yue s ASP 161 CO 0.14 -0.72 1.86 0.77 1.18 0.00 0.00 175.17 178.40 2yue h SER 162 N 8.84 0.36 -0.47 0.27 4.64 -1.91 0.24 113.55 125.52 2yue h SER 162 Ca -0.26 0.04 0.14 0.00 -0.47 0.00 0.00 61.79 61.23 2yue h SER 162 Cb 1.10 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.14 2yue h SER 162 CO 0.87 0.14 0.40 0.03 -0.87 0.00 0.00 176.83 177.40 2yue h ARG 163 N 0.36 0.00 0.01 4.77 3.08 -1.90 0.32 114.38 121.02 2yue h ARG 163 Ca 0.46 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.26 2yue h ARG 163 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 2yue h ARG 163 CO -0.16 0.00 -1.25 0.82 -1.07 0.00 0.00 179.97 178.31 2yue h ILE 164 N 0.00 1.42 -0.56 2.04 2.04 -0.93 -3.32 117.51 118.20 2yue h ILE 164 Ca 0.22 -3.17 -0.30 0.00 1.00 0.00 0.00 64.86 62.62 2yue h ILE 164 Cb 1.02 2.72 -0.18 0.00 -0.74 0.00 0.00 36.82 39.64 2yue h ILE 164 CO -0.00 0.82 0.13 -1.22 0.00 0.00 0.00 178.15 177.87 2yue n TYR 165 N -3.27 1.73 -3.99 1.37 4.02 0.56 -4.99 117.16 112.59 2yue n TYR 165 Ca -0.06 -1.73 -0.10 0.00 -0.01 0.00 0.00 57.90 56.00 2yue n TYR 165 Cb 0.98 -0.64 -0.03 0.00 -0.02 0.00 0.00 39.34 39.63 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 -1.12 0.39 0.05 -0.72 2.81 0.82 -4.99 117.12 114.36 2yue n MET 166 Ca 0.42 -1.91 0.00 0.00 -1.81 0.00 0.00 57.70 54.40 2yue n MET 166 Cb 1.21 1.74 0.00 0.00 -0.71 0.00 0.00 33.22 35.46 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 -0.38 -1.37 0.60 2.03 4.02 -1.26 -4.90 117.16 115.88 2yue n TYR 167 Ca 0.02 0.22 0.07 0.00 -0.01 0.00 0.00 57.90 58.21 2yue n TYR 167 Cb 0.38 0.79 0.06 0.00 -0.02 0.00 0.00 39.34 40.55 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79