#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 4.87 0.21 1.61 1.04 -1.26 -5.11 113.70 115.07 2yue s SER 2 Ca 0.00 -0.38 -0.25 0.00 0.48 0.00 0.00 55.95 55.80 2yue s SER 2 Cb 0.00 -1.07 -0.08 0.00 0.10 0.00 0.00 66.02 64.97 2yue s SER 2 CO 0.00 0.07 0.82 -0.44 0.98 0.00 0.00 173.24 174.67 2yue s SER 3 N -3.08 7.35 0.00 7.02 0.01 -1.26 -5.01 113.70 118.73 2yue s SER 3 Ca 0.28 1.67 0.00 0.00 1.31 0.00 0.00 55.95 59.22 2yue s SER 3 Cb -0.09 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2yue s SER 3 CO 0.20 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.58 2yue n GLY 4 N 1.22 2.69 3.65 3.44 0.00 -1.26 -5.11 105.19 109.82 2yue n GLY 4 Ca -0.03 0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2yue n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yue s SER 5 N 0.00 6.35 -0.28 1.61 0.15 -1.26 -4.96 113.70 115.31 2yue s SER 5 Ca 0.00 2.23 -0.00 0.00 0.70 0.00 0.00 55.95 58.88 2yue s SER 5 Cb 0.00 -2.53 0.09 0.00 -1.71 0.00 0.00 66.02 61.87 2yue s SER 5 CO 0.00 -1.19 0.06 -0.55 1.20 0.00 0.00 173.24 172.76 2yue s SER 6 N 4.64 3.91 -0.86 5.45 0.15 -1.26 -5.05 113.70 120.68 2yue s SER 6 Ca 0.83 -1.50 0.00 0.00 0.70 0.00 0.00 55.95 55.97 2yue s SER 6 Cb -0.35 -0.95 0.24 0.00 -1.71 0.00 0.00 66.02 63.25 2yue s SER 6 CO 0.35 -0.37 0.88 0.61 1.20 0.00 0.00 173.24 175.90 2yue n GLY 7 N 4.79 4.44 3.68 9.45 0.00 -1.26 -5.07 105.19 121.21 2yue n GLY 7 Ca -0.04 -2.65 -0.29 0.00 0.00 0.00 0.00 46.02 43.05 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 -1.86 0.46 0.19 1.61 0.04 -1.26 -5.04 135.00 129.14 2yue s PRO 8 Ca 0.31 0.54 -0.11 0.00 0.04 0.00 0.00 61.00 61.77 2yue s PRO 8 Cb -0.00 -1.74 -0.07 0.00 0.04 0.00 0.00 34.50 32.73 2yue s PRO 8 CO -0.07 -2.71 0.54 -1.17 0.04 0.00 0.00 177.00 173.63 2yue s LEU 9 N -6.45 4.24 0.00 -3.56 2.96 -1.26 -4.98 118.68 109.63 2yue s LEU 9 Ca 0.65 0.97 -0.01 0.00 -0.22 0.00 0.00 54.13 55.53 2yue s LEU 9 Cb -0.19 -3.50 0.00 0.00 0.50 0.00 0.00 46.19 43.01 2yue s LEU 9 CO 0.58 0.00 0.28 0.00 -1.32 0.00 0.00 176.35 175.89 2yue n GLN 10 N 0.26 0.41 -3.19 1.98 6.02 -1.26 -4.87 117.38 116.73 2yue n GLN 10 Ca -0.02 -1.63 -0.36 0.00 -0.01 0.00 0.00 57.00 54.98 2yue n GLN 10 Cb 0.52 1.57 -0.06 0.00 1.02 0.00 0.00 30.24 33.29 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 -3.78 3.68 0.50 1.08 0.08 -1.26 -0.42 117.98 117.86 2yue s PHE 11 Ca 0.17 1.30 -0.12 0.00 0.12 0.00 0.00 56.93 58.40 2yue s PHE 11 Cb -0.01 -2.54 -0.06 0.00 -0.57 0.00 0.00 43.02 39.84 2yue s PHE 11 CO 0.12 0.41 0.91 -1.58 -0.10 0.00 0.00 175.22 174.98 2yue s HIS 12 N -1.42 3.51 0.46 0.36 2.46 -1.11 -4.37 115.29 115.19 2yue s HIS 12 Ca 0.39 1.23 0.13 0.00 0.47 0.00 0.00 55.06 57.28 2yue s HIS 12 Cb -0.17 -2.62 1.06 0.00 -0.13 0.00 0.00 32.58 30.73 2yue s HIS 12 CO 0.21 -0.36 2.07 0.77 -2.47 0.00 0.00 174.74 174.96 2yue h SER 13 N 0.64 0.14 -0.80 9.88 0.02 -1.92 -3.36 113.55 118.14 2yue h SER 13 Ca -0.46 -0.01 -0.46 0.00 -0.84 0.00 0.00 61.79 60.02 2yue h SER 13 Cb 1.19 -0.04 -0.07 0.00 0.14 0.00 0.00 62.40 63.63 2yue h SER 13 CO 0.62 0.16 1.30 0.54 -1.14 0.00 0.00 176.83 178.32 2yue s VAL 14 N -5.05 3.73 0.18 2.27 0.11 -1.26 -4.87 120.40 115.52 2yue s VAL 14 Ca -0.06 -0.90 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 2yue s VAL 14 Cb 0.17 -4.65 -0.00 0.00 -1.53 0.00 0.00 36.38 30.36 2yue s VAL 14 CO 0.70 -1.44 0.23 0.00 -3.33 0.00 0.00 175.10 171.26 2yue n HIS 15 N 11.60 -0.81 -0.96 1.54 -0.00 -1.26 -3.83 115.22 121.50 2yue n HIS 15 Ca 0.41 -1.31 -0.34 0.00 -0.00 0.00 0.00 57.72 56.48 2yue n HIS 15 Cb 0.48 0.25 0.09 0.00 -0.00 0.00 0.00 29.99 30.82 2yue n HIS 15 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2yue n GLY 16 N -0.31 -2.21 0.11 -1.39 0.00 0.27 -4.92 105.19 96.73 2yue n GLY 16 Ca 0.01 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.40 2yue n GLY 16 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2yue h ASP 17 N -1.14 0.00 -0.47 1.61 3.58 -1.82 -3.31 116.42 114.88 2yue h ASP 17 Ca -0.44 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 56.93 2yue h ASP 17 Cb 1.31 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.31 2yue h ASP 17 CO 0.35 0.51 0.07 0.59 -2.88 0.00 0.00 179.24 177.88 2yue n ASN 18 N -2.99 4.40 -4.38 2.28 3.02 -1.26 -4.92 115.26 111.41 2yue n ASN 18 Ca -0.05 -3.14 -0.37 0.00 -0.03 0.00 0.00 54.58 50.99 2yue n ASN 18 Cb 0.78 -0.64 -0.13 0.00 -0.61 0.00 0.00 39.78 39.19 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 -2.91 4.08 -0.60 2.41 -1.09 -1.25 -2.88 121.20 118.96 2yue s ILE 19 Ca 0.49 -0.51 -0.23 0.00 -2.23 0.00 0.00 60.65 58.17 2yue s ILE 19 Cb 0.39 -3.03 0.06 0.00 -1.58 0.00 0.00 42.46 38.30 2yue s ILE 19 CO 0.11 0.17 0.93 -0.60 -1.23 0.00 0.00 174.94 174.32 2yue s ARG 20 N 1.54 3.19 -0.95 2.79 3.52 0.89 -4.88 118.95 125.07 2yue s ARG 20 Ca 0.04 -0.62 -0.05 0.00 -0.13 0.00 0.00 55.73 54.97 2yue s ARG 20 Cb -0.16 -4.15 0.24 0.00 -1.56 0.00 0.00 34.95 29.31 2yue s ARG 20 CO 0.03 -1.64 0.87 0.42 -0.81 0.00 0.00 175.30 174.17 2yue s ILE 21 N 3.90 5.00 -0.17 4.11 1.01 -1.26 -1.06 121.20 132.73 2yue s ILE 21 Ca 0.25 -3.54 -0.09 0.00 0.00 0.00 0.00 60.65 57.27 2yue s ILE 21 Cb -0.15 -4.07 0.06 0.00 0.01 0.00 0.00 42.46 38.31 2yue s ILE 21 CO 0.14 -1.10 0.40 -0.44 0.00 0.00 0.00 174.94 173.93 2yue s SER 22 N 0.62 -0.49 0.30 3.58 0.01 -1.07 -4.86 113.70 111.79 2yue s SER 22 Ca 0.27 0.86 -0.18 0.00 1.31 0.00 0.00 55.95 58.22 2yue s SER 22 Cb -0.09 0.76 0.02 0.00 0.21 0.00 0.00 66.02 66.91 2yue s SER 22 CO -0.10 -0.19 0.68 -0.60 0.41 0.00 0.00 173.24 173.44 2yue s ARG 23 N 1.43 1.84 0.59 12.44 3.52 -1.26 -4.75 118.95 132.75 2yue s ARG 23 Ca -0.09 -1.15 0.29 0.00 -0.13 0.00 0.00 55.73 54.65 2yue s ARG 23 Cb -0.09 0.58 1.65 0.00 -1.56 0.00 0.00 34.95 35.53 2yue s ARG 23 CO -0.12 -0.83 2.08 0.22 -0.81 0.00 0.00 175.30 175.83 2yue h ASP 24 N 2.05 0.00 0.00 -2.12 3.58 -2.02 -3.37 116.42 114.54 2yue h ASP 24 Ca -0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2yue h ASP 24 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2yue h ASP 24 CO 0.29 0.00 -0.11 0.61 -2.88 0.00 0.00 179.24 177.15 2yue n GLY 25 N -1.41 -0.15 0.00 -0.78 0.00 -1.26 -5.13 105.19 96.46 2yue n GLY 25 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.23 0.00 -3.53 2.61 5.66 -1.26 -5.06 114.28 109.48 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 0.06 0.00 -0.05 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 -0.57 -0.29 1.09 0.20 -1.26 -4.08 118.68 113.77 2yue s LEU 27 Ca 0.00 0.58 0.01 0.00 0.69 0.00 0.00 54.13 55.41 2yue s LEU 27 Cb 0.00 2.35 0.08 0.00 -0.43 0.00 0.00 46.19 48.19 2yue s LEU 27 CO 0.00 -0.56 0.02 0.00 -0.29 0.00 0.00 176.35 175.52 2yue s ALA 28 N -1.37 2.10 -0.05 5.97 0.00 0.42 -2.59 121.76 126.24 2yue s ALA 28 Ca -0.07 -1.77 0.06 0.00 0.00 0.00 0.00 51.96 50.18 2yue s ALA 28 Cb -0.00 -1.63 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 2yue s ALA 28 CO 0.06 -1.47 -0.25 -0.98 0.00 0.00 0.00 175.76 173.13 2yue s ARG 29 N 1.32 2.49 -0.09 0.00 1.70 -0.22 -0.30 118.95 123.85 2yue s ARG 29 Ca 0.03 -0.90 -0.24 0.00 -0.47 0.00 0.00 55.73 54.15 2yue s ARG 29 Cb -0.18 -2.15 -0.03 0.00 -0.57 0.00 0.00 34.95 32.01 2yue s ARG 29 CO -0.12 0.41 0.72 -0.98 -1.08 0.00 0.00 175.30 174.25 2yue s ARG 30 N -0.24 4.41 -0.11 3.89 1.04 -0.85 -0.07 118.95 127.01 2yue s ARG 30 Ca -0.01 0.89 0.19 0.00 -1.04 0.00 0.00 55.73 55.76 2yue s ARG 30 Cb -0.13 -3.47 -0.27 0.00 -2.04 0.00 0.00 34.95 29.04 2yue s ARG 30 CO 0.03 -0.01 0.29 1.97 -0.04 0.00 0.00 175.30 177.54 2yue n PHE 31 N 4.05 0.11 -3.70 5.89 1.16 -1.14 -4.88 117.46 118.95 2yue n PHE 31 Ca -0.00 0.04 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 2yue n PHE 31 Cb 0.51 -0.84 0.00 0.00 -1.61 0.00 0.00 39.48 37.53 2yue n PHE 31 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 2yue n GLU 32 N -2.60 2.27 -1.60 3.97 2.13 -1.15 -5.04 120.64 118.61 2yue n GLU 32 Ca -0.21 0.00 -0.54 0.00 0.66 0.00 0.00 57.16 57.08 2yue n GLU 32 Cb 0.93 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.57 2yue n GLU 32 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2yue n SER 33 N -0.99 2.45 -0.13 4.31 2.88 -1.26 -4.79 113.62 116.10 2yue n SER 33 Ca 0.00 0.81 0.27 0.00 -1.33 0.00 0.00 58.87 58.62 2yue n SER 33 Cb 0.00 -1.22 0.72 0.00 -0.75 0.00 0.00 64.21 62.96 2yue n SER 33 CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 2yue h PHE 34 N 9.48 0.00 -2.62 0.66 -5.15 -1.92 -3.42 116.94 113.96 2yue h PHE 34 Ca -0.39 0.00 -0.60 0.00 -0.20 0.00 0.00 57.97 56.78 2yue h PHE 34 Cb 1.31 0.00 0.11 0.00 0.22 0.00 0.00 35.95 37.59 2yue h PHE 34 CO 0.87 0.00 0.26 0.00 -2.00 0.00 0.00 178.31 177.43 2yue n ARG 36 N 0.86 -1.96 0.00 0.00 1.74 -1.17 -4.96 116.66 111.18 2yue n ARG 36 Ca 0.09 1.00 0.00 0.00 -0.77 0.00 0.00 57.85 58.17 2yue n ARG 36 Cb 0.32 -5.69 0.00 0.00 -1.02 0.00 0.00 32.46 26.08 2yue n ARG 36 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yue n ALA 37 N -2.93 1.65 -1.23 7.54 0.00 -1.16 -4.23 120.51 120.14 2yue n ALA 37 Ca -0.06 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.39 2yue n ALA 37 Cb 0.59 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.04 2yue n ALA 37 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2yue n ILE 38 N -0.65 -2.21 -3.73 0.00 5.41 -1.26 -0.57 119.36 116.35 2yue n ILE 38 Ca 0.00 1.12 -0.14 0.00 1.00 0.00 0.00 62.75 64.74 2yue n ILE 38 Cb 0.00 -1.87 -0.09 0.00 -0.71 0.00 0.00 39.64 36.98 2yue n ILE 38 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2yue s THR 39 N -5.06 0.04 0.45 1.39 -4.23 0.11 -0.89 115.64 107.44 2yue s THR 39 Ca 0.00 -0.34 0.01 0.00 -1.18 0.00 0.00 61.69 60.17 2yue s THR 39 Cb 0.00 -0.64 -0.00 0.00 1.34 0.00 0.00 72.50 73.20 2yue s THR 39 CO 0.00 -0.19 0.02 0.49 -0.54 0.00 0.00 174.62 174.40 2yue n PHE 40 N 1.51 0.92 -3.41 3.99 3.01 -1.25 -0.43 117.46 121.81 2yue n PHE 40 Ca -0.20 -2.29 -0.38 0.00 1.01 0.00 0.00 57.45 55.60 2yue n PHE 40 Cb 0.56 -0.26 -0.06 0.00 -0.01 0.00 0.00 39.48 39.72 2yue n PHE 40 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2yue s SER 41 N -3.49 6.82 0.15 4.37 0.15 -0.73 -2.76 113.70 118.21 2yue s SER 41 Ca 0.03 0.97 -0.12 0.00 0.70 0.00 0.00 55.95 57.53 2yue s SER 41 Cb 0.00 -2.28 0.01 0.00 -1.71 0.00 0.00 66.02 62.04 2yue s SER 41 CO 0.02 0.23 1.59 0.00 1.20 0.00 0.00 173.24 176.27 2yue h ALA 42 N 5.24 0.65 -3.07 5.45 0.00 -0.94 -3.38 119.26 123.22 2yue h ALA 42 Ca -0.48 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 53.61 2yue h ALA 42 Cb 1.21 -0.18 -0.19 0.00 0.00 0.00 0.00 17.79 18.63 2yue h ALA 42 CO 0.66 0.49 -0.79 1.03 0.00 0.00 0.00 179.25 180.64 2yue s ARG 43 N -4.95 1.22 -0.09 0.00 0.52 -1.26 -4.83 118.95 109.56 2yue s ARG 43 Ca -0.12 -1.34 -0.30 0.00 -0.52 0.00 0.00 55.73 53.45 2yue s ARG 43 Cb 0.11 -1.30 -0.04 0.00 0.52 0.00 0.00 34.95 34.24 2yue s ARG 43 CO 0.83 0.27 1.52 -1.25 0.02 0.00 0.00 175.30 176.69 2yue s PRO 44 N -2.60 4.20 0.06 3.54 0.04 -1.26 -4.82 135.00 134.16 2yue s PRO 44 Ca 0.13 2.01 -0.19 0.00 0.04 0.00 0.00 61.00 62.99 2yue s PRO 44 Cb -0.07 -3.89 -0.07 0.00 0.04 0.00 0.00 34.50 30.52 2yue s PRO 44 CO 0.06 -0.79 0.56 0.14 0.04 0.00 0.00 177.00 177.01 2yue s VAL 45 N 3.78 4.77 1.01 -0.36 -7.23 -0.30 -4.90 120.40 117.18 2yue s VAL 45 Ca 0.67 1.19 -0.16 0.00 -1.81 0.00 0.00 61.98 61.87 2yue s VAL 45 Cb -0.30 -3.89 0.21 0.00 0.56 0.00 0.00 36.38 32.96 2yue s VAL 45 CO 0.25 0.55 1.21 -0.60 -0.31 0.00 0.00 175.10 176.20 2yue s ARG 46 N -1.03 0.27 0.01 4.82 3.52 -1.26 -4.17 118.95 121.10 2yue s ARG 46 Ca 0.29 -0.14 -0.09 0.00 -0.13 0.00 0.00 55.73 55.66 2yue s ARG 46 Cb -0.19 -1.78 -0.05 0.00 -1.56 0.00 0.00 34.95 31.37 2yue s ARG 46 CO 0.18 -2.71 0.94 0.82 -0.81 0.00 0.00 175.30 173.73 2yue h ILE 47 N -1.86 0.00 0.00 4.11 1.08 -1.95 -3.10 117.51 115.79 2yue h ILE 47 Ca -0.46 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 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 0.43 0.00 0.00 0.78 -0.69 0.00 0.00 178.15 178.67 2yue h ASN 48 N -0.39 0.00 -1.70 1.72 -0.26 -1.90 -3.00 115.58 110.05 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 0.25 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.52 2yue h ASN 48 CO 0.06 0.00 1.09 1.21 -1.06 0.00 0.00 177.43 178.72 2yue n GLU 49 N -3.08 1.62 -2.74 0.81 2.13 -1.17 -4.82 120.64 113.39 2yue n GLU 49 Ca -0.02 0.57 -0.42 0.00 0.66 0.00 0.00 57.16 57.96 2yue n GLU 49 Cb 0.17 -2.42 -0.03 0.00 0.27 0.00 0.00 31.44 29.42 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 4.28 4.55 -0.57 5.31 6.06 -1.26 -4.58 118.95 132.74 2yue s ARG 50 Ca 0.98 1.37 -0.08 0.00 -2.50 0.00 0.00 55.73 55.50 2yue s ARG 50 Cb -0.86 -3.46 0.15 0.00 0.06 0.00 0.00 34.95 30.84 2yue s ARG 50 CO 0.56 -0.04 0.43 0.42 -2.50 0.00 0.00 175.30 174.18 2yue s ILE 51 N 0.99 4.21 0.05 4.11 1.01 -1.20 -4.54 121.20 125.83 2yue s ILE 51 Ca 0.51 -2.28 -0.18 0.00 0.00 0.00 0.00 60.65 58.70 2yue s ILE 51 Cb -0.21 -3.74 -0.06 0.00 0.01 0.00 0.00 42.46 38.46 2yue s ILE 51 CO 0.27 -0.84 0.52 0.00 0.00 0.00 0.00 174.94 174.88 2yue s VAL 53 N -1.06 -0.32 0.08 0.00 1.01 0.82 -1.83 120.40 119.11 2yue s VAL 53 Ca 0.27 0.07 -0.19 0.00 0.00 0.00 0.00 61.98 62.13 2yue s VAL 53 Cb -0.19 -0.54 -0.07 0.00 0.00 0.00 0.00 36.38 35.59 2yue s VAL 53 CO 0.17 -0.06 0.57 -0.75 0.00 0.00 0.00 175.10 175.03 2yue s LYS 54 N 2.33 4.18 -0.67 2.72 2.20 0.94 -0.13 119.74 131.31 2yue s LYS 54 Ca 0.05 0.72 -0.25 0.00 -0.36 0.00 0.00 55.97 56.13 2yue s LYS 54 Cb -0.14 -3.20 0.05 0.00 -1.51 0.00 0.00 37.83 33.03 2yue s LYS 54 CO -0.10 0.62 1.09 -0.06 -0.36 0.00 0.00 175.35 176.54 2yue s PHE 55 N -1.15 2.54 -0.01 4.03 0.08 -0.31 -1.27 117.98 121.89 2yue s PHE 55 Ca 0.30 -0.28 -0.22 0.00 0.12 0.00 0.00 56.93 56.85 2yue s PHE 55 Cb -0.19 -4.40 -0.13 0.00 -0.57 0.00 0.00 43.02 37.72 2yue s PHE 55 CO 0.19 -1.78 0.97 0.00 -0.10 0.00 0.00 175.22 174.51 2yue h ALA 56 N 9.71 -0.66 -3.01 5.36 0.00 -1.61 0.11 119.26 129.17 2yue h ALA 56 Ca -0.28 -0.18 -0.64 0.00 0.00 0.00 0.00 54.91 53.81 2yue h ALA 56 Cb 1.06 0.25 -0.16 0.00 0.00 0.00 0.00 17.79 18.95 2yue h ALA 56 CO 1.21 -0.66 -0.77 -1.21 0.00 0.00 0.00 179.25 177.82 2yue s GLU 57 N -4.17 1.80 0.02 0.00 2.02 -0.86 -4.56 118.70 112.94 2yue s GLU 57 Ca -0.12 -1.42 0.02 0.00 0.02 0.00 0.00 54.97 53.47 2yue s GLU 57 Cb 0.01 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 32.24 2yue s GLU 57 CO 0.40 0.41 -0.07 0.42 0.02 0.00 0.00 175.26 176.44 2yue s ILE 58 N -1.76 0.55 -0.22 -1.63 -1.09 -1.26 -2.77 121.20 113.00 2yue s ILE 58 Ca 0.24 -0.60 -0.06 0.00 -2.23 0.00 0.00 60.65 57.99 2yue s ILE 58 Cb -0.08 -0.52 -0.03 0.00 -1.58 0.00 0.00 42.46 40.25 2yue s ILE 58 CO 0.13 -0.06 0.04 -0.94 -1.23 0.00 0.00 174.94 172.88 2yue s SER 59 N -0.72 5.01 -0.79 3.58 1.04 -1.26 -4.73 113.70 115.83 2yue s SER 59 Ca -0.02 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.24 2yue s SER 59 Cb -0.05 -1.88 0.21 0.00 0.10 0.00 0.00 66.02 64.40 2yue s SER 59 CO 0.00 0.02 0.71 -0.46 0.98 0.00 0.00 173.24 174.49 2yue n ASN 60 N 4.56 3.80 0.00 7.02 6.94 -1.26 -4.53 115.26 131.79 2yue n ASN 60 Ca -0.17 -3.24 0.00 0.00 -0.02 0.00 0.00 54.58 51.16 2yue n ASN 60 Cb 0.52 -0.88 0.00 0.00 -2.36 0.00 0.00 39.78 37.05 2yue n ASN 60 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2yue n ASN 61 N 1.85 0.00 -2.00 0.53 5.03 -1.26 -5.15 115.26 114.25 2yue n ASN 61 Ca 0.23 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.68 2yue n ASN 61 Cb 0.37 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.13 2yue n ASN 61 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 2yue n TRP 62 N -0.28 -3.91 -2.94 3.10 5.03 -1.26 -5.02 117.44 112.17 2yue n TRP 62 Ca 0.00 0.00 -0.41 0.00 3.03 0.00 0.00 57.50 60.12 2yue n TRP 62 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 31.31 30.24 2yue n TRP 62 CO 0.00 0.00 0.00 -0.80 -0.03 0.00 0.00 177.69 176.86 2yue s ASN 63 N -1.00 6.99 0.33 -0.99 0.02 -1.26 -4.89 114.94 114.13 2yue s ASN 63 Ca 0.00 1.20 -0.27 0.00 -1.02 0.00 0.00 52.86 52.77 2yue s ASN 63 Cb 0.00 -2.44 -0.09 0.00 0.02 0.00 0.00 41.25 38.73 2yue s ASN 63 CO 0.00 -0.29 1.02 -0.83 0.02 0.00 0.00 177.10 177.02 2yue s GLY 64 N 1.04 2.89 0.00 0.66 0.00 -1.26 -3.66 107.32 106.99 2yue s GLY 64 Ca 0.39 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.81 2yue s GLY 64 CO 0.15 1.20 0.00 0.61 0.00 0.00 0.00 173.10 175.06 2yue n GLY 65 N 0.78 0.04 3.50 0.20 0.00 -1.26 -4.86 105.19 103.58 2yue n GLY 65 Ca 0.02 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 1.75 0.03 -0.61 -4.36 -1.26 -4.76 121.20 111.99 2yue s ILE 66 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 60.65 60.44 2yue s ILE 66 Cb 0.00 -2.22 -0.02 0.00 1.25 0.00 0.00 42.46 41.47 2yue s ILE 66 CO 0.00 0.00 -0.13 -0.60 0.24 0.00 0.00 174.94 174.45 2yue s ARG 67 N -4.86 0.92 -0.27 0.37 3.00 -1.24 -3.67 118.95 113.21 2yue s ARG 67 Ca 0.68 -0.70 -0.26 0.00 -1.00 0.00 0.00 55.73 54.45 2yue s ARG 67 Cb -0.19 -0.91 0.13 0.00 0.00 0.00 0.00 34.95 33.99 2yue s ARG 67 CO 0.60 0.23 1.09 -0.59 0.00 0.00 0.00 175.30 176.63 2yue s PHE 68 N -0.78 -0.39 0.00 5.12 -0.71 -1.00 -1.35 117.98 118.86 2yue s PHE 68 Ca 0.02 0.92 0.00 0.00 -1.04 0.00 0.00 56.93 56.82 2yue s PHE 68 Cb -0.07 0.39 0.00 0.00 -1.21 0.00 0.00 43.02 42.13 2yue s PHE 68 CO 0.01 -0.21 0.00 0.41 -1.34 0.00 0.00 175.22 174.08 2yue n GLY 69 N 1.87 1.93 3.59 1.99 0.00 -0.32 -1.06 105.19 113.19 2yue n GLY 69 Ca -0.12 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.26 2.32 -0.14 1.61 0.08 -0.93 -0.54 117.98 119.11 2yue s PHE 70 Ca 0.00 -0.78 -0.13 0.00 0.12 0.00 0.00 56.93 56.14 2yue s PHE 70 Cb 0.00 -1.64 0.04 0.00 -0.57 0.00 0.00 43.02 40.85 2yue s PHE 70 CO 0.00 0.31 0.38 -0.08 -0.10 0.00 0.00 175.22 175.73 2yue s THR 71 N -2.87 -0.00 0.08 0.64 -1.32 0.10 -0.30 115.64 111.96 2yue s THR 71 Ca 0.32 0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.80 2yue s THR 71 Cb 0.09 -0.53 -0.27 0.00 -1.51 0.00 0.00 72.50 70.28 2yue s THR 71 CO 0.16 0.00 1.14 -1.28 -2.21 0.00 0.00 174.62 172.43 2yue h SER 72 N 5.67 0.32 -4.27 8.08 0.87 -0.90 -2.97 113.55 120.35 2yue h SER 72 Ca -0.27 -0.35 -0.50 0.00 -1.23 0.00 0.00 61.79 59.43 2yue h SER 72 Cb 1.18 -0.10 0.08 0.00 -0.44 0.00 0.00 62.40 63.12 2yue h SER 72 CO 0.27 1.28 0.37 0.20 -0.53 0.00 0.00 176.83 178.42 2yue s ASN 73 N -7.02 5.58 0.42 6.23 0.01 -1.26 -4.89 114.94 114.01 2yue s ASN 73 Ca -0.03 1.71 -0.22 0.00 -0.71 0.00 0.00 52.86 53.61 2yue s ASN 73 Cb 0.08 -2.51 -0.11 0.00 0.41 0.00 0.00 41.25 39.12 2yue s ASN 73 CO 0.87 -1.30 0.95 -1.81 -1.51 0.00 0.00 177.10 174.29 2yue s ASP 74 N -3.30 6.99 0.43 -1.22 1.01 -1.26 -4.81 116.67 114.51 2yue s ASP 74 Ca 0.61 1.71 0.22 0.00 0.71 0.00 0.00 52.55 55.79 2yue s ASP 74 Cb -0.15 -2.54 0.96 0.00 1.01 0.00 0.00 42.92 42.19 2yue s ASP 74 CO 0.46 -0.32 1.86 1.55 0.21 0.00 0.00 175.17 178.92 2yue h PRO 75 N 2.06 0.00 -0.01 8.23 0.13 -1.96 -2.94 132.00 137.51 2yue h PRO 75 Ca -0.49 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.46 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 0.61 0.26 -0.81 -0.39 -0.23 0.00 0.00 178.00 177.44 2yue h VAL 76 N 0.00 1.48 0.00 1.56 -1.51 -1.95 -2.39 116.25 113.45 2yue h VAL 76 Ca -0.00 -2.51 0.00 0.00 -1.23 0.00 0.00 66.70 62.96 2yue h VAL 76 Cb 0.69 2.38 0.00 0.00 -2.13 0.00 0.00 31.29 32.22 2yue h VAL 76 CO 0.03 0.73 0.00 0.35 -1.23 0.00 0.00 177.57 177.45 2yue n THR 77 N -3.69 1.03 -0.01 7.19 -2.24 -1.11 -2.17 114.28 113.29 2yue n THR 77 Ca -0.03 0.32 0.06 0.00 -2.27 0.00 0.00 64.05 62.14 2yue n THR 77 Cb 0.76 -1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 67.68 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 -1.91 0.00 -4.63 3.22 4.77 -1.14 -5.00 117.00 112.31 2yue n LEU 78 Ca 0.02 0.00 -0.49 0.00 -0.03 0.00 0.00 56.01 55.51 2yue n LEU 78 Cb 0.16 0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2yue n LEU 78 CO 0.14 0.01 1.05 1.21 -1.33 0.00 0.00 177.39 178.48 2yue n GLU 79 N -1.97 1.63 -0.61 3.23 2.13 -0.91 -1.75 120.64 122.39 2yue n GLU 79 Ca -0.03 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.38 2yue n GLU 79 Cb 0.36 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.78 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 2.99 0.71 0.00 8.31 0.00 -1.26 -4.98 105.19 110.96 2yue n GLY 80 Ca 0.18 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2yue n GLY 80 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2yue n THR 81 N -2.56 0.00 -4.26 2.61 5.66 -0.72 -5.17 114.28 109.85 2yue n THR 81 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 2yue n THR 81 Cb 0.03 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.72 2yue n THR 81 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2yue s LEU 82 N 0.00 3.40 1.11 1.09 1.43 -1.26 -4.89 118.68 119.57 2yue s LEU 82 Ca 0.00 -0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 52.82 2yue s LEU 82 Cb 0.00 -2.04 0.24 0.00 0.03 0.00 0.00 46.19 44.43 2yue s LEU 82 CO 0.00 0.23 1.10 -2.16 0.23 0.00 0.00 176.35 175.76 2yue s PRO 83 N -1.85 -0.50 0.38 1.29 0.04 -1.26 -4.95 135.00 128.14 2yue s PRO 83 Ca 0.22 0.19 0.20 0.00 0.04 0.00 0.00 61.00 61.65 2yue s PRO 83 Cb -0.11 -1.66 0.57 0.00 0.04 0.00 0.00 34.50 33.34 2yue s PRO 83 CO 0.13 -3.29 1.67 0.87 0.04 0.00 0.00 177.00 176.43 2yue h LYS 84 N -2.28 0.00 0.00 4.56 1.57 -1.98 -3.44 116.57 114.99 2yue h LYS 84 Ca -0.50 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.00 2yue h LYS 84 Cb 1.31 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.55 2yue h LYS 84 CO 0.45 0.32 -0.24 2.48 -0.57 0.00 0.00 179.45 181.90 2yue n TYR 85 N -3.34 -0.75 -0.27 -1.35 0.18 -1.26 -3.02 117.16 107.35 2yue n TYR 85 Ca 0.01 -1.81 0.12 0.00 1.88 0.00 0.00 57.90 58.09 2yue n TYR 85 Cb 0.55 0.26 0.31 0.00 -0.38 0.00 0.00 39.34 40.08 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 -1.43 2.39 0.00 -3.48 0.00 -1.26 -4.46 120.51 112.27 2yue n ALA 86 Ca -0.08 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.10 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 -1.42 0.00 -3.78 3.54 9.92 -1.26 -1.44 116.55 122.10 2yue n ASP 89 Ca 0.05 0.75 -0.42 0.00 -0.53 0.00 0.00 54.79 54.64 2yue n ASP 89 Cb 0.15 -0.25 -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 -1.83 5.11 0.00 0.64 4.77 -1.19 -3.37 117.00 121.12 2yue n LEU 90 Ca 0.00 -3.44 0.00 0.00 -0.03 0.00 0.00 56.01 52.54 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 0.12 0.00 0.35 -1.33 0.00 0.00 177.39 176.53 2yue n THR 91 N 5.81 0.00 -0.30 -5.08 -2.24 -1.11 -4.40 114.28 106.95 2yue n THR 91 Ca 0.50 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.39 2yue n THR 91 Cb 0.41 0.00 0.33 0.00 -2.10 0.00 0.00 70.33 68.97 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 0.75 -3.93 3.42 4.21 -1.26 -3.41 115.58 115.37 2yue h ASN 92 Ca 0.00 0.05 -0.56 0.00 1.21 0.00 0.00 56.30 57.00 2yue h ASN 92 Cb 0.00 -0.10 0.17 0.00 -1.12 0.00 0.00 38.32 37.27 2yue h ASN 92 CO 0.00 0.38 0.28 0.54 -1.29 0.00 0.00 177.43 177.34 2yue n ARG 93 N -4.59 0.71 -2.21 0.81 1.74 -1.26 -4.92 116.66 106.93 2yue n ARG 93 Ca 0.18 0.30 -0.42 0.00 -0.77 0.00 0.00 57.85 57.15 2yue n ARG 93 Cb 0.44 -2.35 -0.03 0.00 -1.02 0.00 0.00 32.46 29.50 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 -3.40 4.36 0.00 5.56 0.04 -1.26 -2.69 135.00 137.62 2yue s PRO 94 Ca 0.77 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.85 2yue s PRO 94 Cb -0.36 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 30.95 2yue s PRO 94 CO 0.46 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.58 2yue n GLY 95 N 2.96 1.85 3.72 0.56 0.00 -1.26 -4.74 105.19 108.28 2yue n GLY 95 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.35 3.49 0.05 1.61 0.40 -1.09 -0.23 117.98 119.85 2yue s PHE 96 Ca 0.00 0.77 0.03 0.00 -0.60 0.00 0.00 56.93 57.12 2yue s PHE 96 Cb 0.00 -2.47 -0.03 0.00 0.51 0.00 0.00 43.02 41.03 2yue s PHE 96 CO 0.00 0.19 -0.09 -1.58 0.70 0.00 0.00 175.22 174.44 2yue s TRP 97 N 0.60 0.77 -0.13 0.36 0.51 0.59 -4.63 118.94 117.00 2yue s TRP 97 Ca 0.22 -0.51 -0.29 0.00 -2.12 0.00 0.00 56.10 53.40 2yue s TRP 97 Cb -0.14 -0.45 0.08 0.00 -0.81 0.00 0.00 33.47 32.14 2yue s TRP 97 CO 0.08 -0.06 0.73 0.00 -0.51 0.00 0.00 176.95 177.19 2yue s ALA 98 N -1.44 -1.80 -0.05 0.98 0.00 -1.26 -2.19 121.76 116.00 2yue s ALA 98 Ca -0.08 1.58 -0.10 0.00 0.00 0.00 0.00 51.96 53.36 2yue s ALA 98 Cb -0.09 -0.47 0.02 0.00 0.00 0.00 0.00 23.12 22.57 2yue s ALA 98 CO 0.01 -0.35 0.24 0.21 0.00 0.00 0.00 175.76 175.87 2yue s LYS 99 N -0.65 0.44 -0.09 0.00 2.20 -0.23 -4.93 119.74 116.48 2yue s LYS 99 Ca -0.06 0.03 -0.18 0.00 -0.36 0.00 0.00 55.97 55.39 2yue s LYS 99 Cb -0.02 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.46 2yue s LYS 99 CO 0.06 -0.09 0.49 0.00 -0.36 0.00 0.00 175.35 175.45 2yue s ALA 100 N -0.61 3.50 0.43 3.13 0.00 -1.26 -2.39 121.76 124.55 2yue s ALA 100 Ca -0.07 -0.15 -0.17 0.00 0.00 0.00 0.00 51.96 51.56 2yue s ALA 100 Cb -0.04 -2.64 -0.09 0.00 0.00 0.00 0.00 23.12 20.35 2yue s ALA 100 CO 0.02 0.08 0.89 -1.17 0.00 0.00 0.00 175.76 175.57 2yue s LEU 101 N 0.32 3.86 1.09 0.00 0.20 -1.24 -5.01 118.68 117.90 2yue s LEU 101 Ca 0.27 1.50 -0.18 0.00 0.69 0.00 0.00 54.13 56.41 2yue s LEU 101 Cb -0.16 -4.37 0.09 0.00 -0.43 0.00 0.00 46.19 41.32 2yue s LEU 101 CO 0.12 -0.40 0.08 1.57 -0.29 0.00 0.00 176.35 177.43 2yue n HIS 102 N -0.93 -1.44 0.70 5.38 -0.00 -1.26 -4.60 115.22 113.07 2yue n HIS 102 Ca 0.06 0.16 0.11 0.00 0.46 0.00 0.00 57.72 58.51 2yue n HIS 102 Cb 0.54 -1.61 0.09 0.00 -0.12 0.00 0.00 29.99 28.90 2yue n HIS 102 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 2yue n GLU 103 N -1.96 0.20 0.00 1.57 0.28 -1.26 -3.83 120.64 115.63 2yue n GLU 103 Ca 0.02 0.01 0.15 0.00 -0.16 0.00 0.00 57.16 57.19 2yue n GLU 103 Cb 0.61 -1.58 0.87 0.00 1.43 0.00 0.00 31.44 32.76 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 -1.85 0.77 -0.59 3.44 10.64 -1.26 -3.14 117.38 125.40 2yue n GLN 104 Ca 0.03 0.00 0.06 0.00 -1.83 0.00 0.00 57.00 55.27 2yue n GLN 104 Cb 0.41 -1.50 0.19 0.00 -0.86 0.00 0.00 30.24 28.48 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 -1.11 0.00 -0.93 2.61 4.01 -1.25 -4.70 117.16 115.79 2yue n TYR 105 Ca 0.20 -1.39 -0.10 0.00 -0.16 0.00 0.00 57.90 56.45 2yue n TYR 105 Cb 0.16 -0.23 0.26 0.00 -0.31 0.00 0.00 39.34 39.21 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 -2.88 3.89 0.61 0.00 2.02 -1.26 -4.95 118.70 116.13 2yue s GLU 107 Ca 0.52 0.90 -0.09 0.00 0.02 0.00 0.00 54.97 56.33 2yue s GLU 107 Cb 0.42 -2.14 -0.01 0.00 0.10 0.00 0.00 34.13 32.50 2yue s GLU 107 CO 0.12 -0.30 0.96 0.21 0.02 0.00 0.00 175.26 176.27 2yue s LYS 108 N -4.22 3.20 -1.54 1.61 2.20 -1.26 -3.90 119.74 115.83 2yue s LYS 108 Ca 0.58 0.35 0.00 0.00 -0.36 0.00 0.00 55.97 56.54 2yue s LYS 108 Cb -0.10 -2.18 0.00 0.00 -1.51 0.00 0.00 37.83 34.04 2yue s LYS 108 CO 0.34 -0.66 0.00 -3.47 -0.36 0.00 0.00 175.35 171.20 2yue n ASP 109 N -2.68 -4.65 -4.78 1.43 2.03 0.38 -4.94 116.55 103.33 2yue n ASP 109 Ca 0.05 0.22 -0.36 0.00 0.52 0.00 0.00 54.79 55.22 2yue n ASP 109 Cb 0.56 -4.03 -0.08 0.00 -0.72 0.00 0.00 41.12 36.86 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 -2.18 5.90 -0.41 1.67 -0.87 -1.25 -4.85 114.94 112.95 2yue s ASN 110 Ca 0.00 0.31 -0.21 0.00 -1.57 0.00 0.00 52.86 51.39 2yue s ASN 110 Cb 0.00 -1.85 0.02 0.00 -0.02 0.00 0.00 41.25 39.40 2yue s ASN 110 CO 0.00 0.37 0.65 -0.63 -2.57 0.00 0.00 177.10 174.92 2yue s ILE 111 N -0.79 4.83 -0.41 0.60 1.09 -1.26 -1.16 121.20 124.09 2yue s ILE 111 Ca 0.13 0.32 -0.10 0.00 -1.10 0.00 0.00 60.65 59.90 2yue s ILE 111 Cb -0.12 -4.17 0.07 0.00 -1.06 0.00 0.00 42.46 37.18 2yue s ILE 111 CO 0.03 -0.50 0.26 -0.22 -0.10 0.00 0.00 174.94 174.40 2yue s LEU 112 N 2.83 5.08 -0.12 2.97 2.96 0.82 -2.69 118.68 130.52 2yue s LEU 112 Ca 0.24 -1.36 -0.03 0.00 -0.22 0.00 0.00 54.13 52.76 2yue s LEU 112 Cb -0.14 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 2yue s LEU 112 CO 0.18 -0.51 -0.02 -0.72 -1.32 0.00 0.00 176.35 173.96 2yue s TYR 113 N 1.48 3.09 -0.09 5.38 -0.85 -0.64 -0.13 117.35 125.59 2yue s TYR 113 Ca 0.03 -0.03 -0.03 0.00 -0.52 0.00 0.00 57.07 56.51 2yue s TYR 113 Cb -0.22 -1.87 0.05 0.00 0.38 0.00 0.00 41.96 40.29 2yue s TYR 113 CO 0.04 0.22 0.17 1.52 -1.52 0.00 0.00 175.55 175.98 2yue s TYR 114 N -0.26 -0.20 0.10 -3.49 1.13 -0.38 -0.53 117.35 113.72 2yue s TYR 114 Ca 0.05 0.64 0.01 0.00 -1.41 0.00 0.00 57.07 56.36 2yue s TYR 114 Cb -0.12 -0.24 -0.00 0.00 -1.10 0.00 0.00 41.96 40.49 2yue s TYR 114 CO 0.02 -0.28 0.02 2.48 -2.51 0.00 0.00 175.55 175.28 2yue n TYR 115 N 5.33 0.11 -3.90 -3.49 4.11 0.20 -3.21 117.16 116.30 2yue n TYR 115 Ca -0.05 -0.56 -0.11 0.00 -0.00 0.00 0.00 57.90 57.18 2yue n TYR 115 Cb 0.50 -0.03 -0.13 0.00 -0.00 0.00 0.00 39.34 39.69 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 -1.71 0.04 0.60 -3.48 0.11 -1.13 -0.11 120.40 114.72 2yue s VAL 116 Ca 0.03 -0.34 0.03 0.00 -2.93 0.00 0.00 61.98 58.77 2yue s VAL 116 Cb 0.00 -0.15 0.11 0.00 -1.53 0.00 0.00 36.38 34.81 2yue s VAL 116 CO 0.02 -0.19 0.82 -0.46 -3.33 0.00 0.00 175.10 171.96 2yue n ASN 117 N 2.47 1.42 0.00 3.54 0.23 -0.41 -3.31 115.26 119.21 2yue n ASN 117 Ca -0.17 -2.13 0.07 0.00 -0.53 0.00 0.00 54.58 51.83 2yue n ASN 117 Cb 0.58 -0.50 0.33 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 -1.57 -0.97 1.82 4.83 0.00 -1.26 -2.56 105.19 105.49 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 4.47 -2.22 4.61 0.00 -1.26 -4.87 120.51 119.78 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 -0.38 -0.15 3.38 0.00 0.00 -1.06 -4.92 105.19 102.05 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 4.89 -0.33 1.61 1.01 -1.26 -3.37 116.67 117.19 2yue s ASP 121 Ca 0.00 -0.39 -0.18 0.00 0.71 0.00 0.00 52.55 52.68 2yue s ASP 121 Cb 0.00 -1.86 -0.01 0.00 1.01 0.00 0.00 42.92 42.06 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 1.55 5.01 0.05 -1.27 1.01 0.86 -1.28 120.40 126.32 2yue s VAL 122 Ca 0.05 0.54 0.04 0.00 0.00 0.00 0.00 61.98 62.61 2yue s VAL 122 Cb -0.15 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2yue s VAL 122 CO 0.01 -0.15 -0.02 -0.63 0.00 0.00 0.00 175.10 174.32 2yue s ILE 123 N 2.43 3.93 0.27 2.22 1.09 0.84 -0.54 121.20 131.45 2yue s ILE 123 Ca 0.20 -0.88 0.05 0.00 -1.10 0.00 0.00 60.65 58.92 2yue s ILE 123 Cb -0.15 -2.81 -0.06 0.00 -1.06 0.00 0.00 42.46 38.38 2yue s ILE 123 CO 0.12 0.23 -0.01 -0.72 -0.10 0.00 0.00 174.94 174.46 2yue s TYR 124 N -1.19 1.79 -0.06 3.97 1.13 -1.25 -0.63 117.35 121.10 2yue s TYR 124 Ca 0.22 -0.84 -0.31 0.00 -1.41 0.00 0.00 57.07 54.73 2yue s TYR 124 Cb -0.11 -1.06 0.11 0.00 -1.10 0.00 0.00 41.96 39.80 2yue s TYR 124 CO 0.14 0.09 1.04 0.20 -2.51 0.00 0.00 175.55 174.51 2yue s GLY 125 N -3.39 -0.38 -0.06 5.49 0.00 0.31 -2.32 107.32 106.96 2yue s GLY 125 Ca 0.30 1.14 0.04 0.00 0.00 0.00 0.00 44.72 46.21 2yue s GLY 125 CO 0.11 0.37 -0.18 -0.42 0.00 0.00 0.00 173.10 172.98 2yue s ILE 126 N -2.83 1.57 -1.25 0.90 -1.09 -1.16 -1.62 121.20 115.72 2yue s ILE 126 Ca 0.08 -0.77 -0.07 0.00 -2.23 0.00 0.00 60.65 57.66 2yue s ILE 126 Cb -0.01 -1.37 -0.01 0.00 -1.58 0.00 0.00 42.46 39.50 2yue s ILE 126 CO -0.06 0.45 0.69 0.59 -1.23 0.00 0.00 174.94 175.37 2yue n ASN 127 N 3.38 -2.73 -3.79 3.58 3.02 -1.09 -1.70 115.26 115.93 2yue n ASN 127 Ca -0.19 -0.91 -0.25 0.00 -0.03 0.00 0.00 54.58 53.19 2yue n ASN 127 Cb 0.53 -3.72 0.03 0.00 -0.61 0.00 0.00 39.78 36.00 2yue n ASN 127 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2yue n ASN 128 N -2.93 -2.75 -3.29 6.41 3.02 -1.26 -4.94 115.26 109.51 2yue n ASN 128 Ca -0.22 -0.80 -0.25 0.00 -0.03 0.00 0.00 54.58 53.28 2yue n ASN 128 Cb 0.65 -3.99 -0.09 0.00 -0.61 0.00 0.00 39.78 35.74 2yue n ASN 128 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2yue n GLU 129 N -4.46 0.43 -1.41 3.52 1.02 -0.69 -5.13 120.64 113.92 2yue n GLU 129 Ca -0.15 -3.19 -0.35 0.00 -0.02 0.00 0.00 57.16 53.45 2yue n GLU 129 Cb 0.61 -1.46 0.10 0.00 -0.02 0.00 0.00 31.44 30.68 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 -0.51 2.07 -0.02 3.49 1.03 -1.26 -3.01 118.70 120.49 2yue s GLU 130 Ca 0.34 1.86 0.04 0.00 0.03 0.00 0.00 54.97 57.24 2yue s GLU 130 Cb 0.10 -1.81 -0.06 0.00 -0.80 0.00 0.00 34.13 31.56 2yue s GLU 130 CO -0.16 -1.91 0.06 1.63 -1.33 0.00 0.00 175.26 173.55 2yue n LYS 131 N -2.68 1.43 0.00 -4.83 4.76 -0.98 -4.96 118.16 110.89 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 2.47 3.06 3.64 0.72 0.00 -1.26 -5.07 105.19 108.75 2yue n GLY 132 Ca -0.03 -1.89 -0.47 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.54 0.71 -0.01 1.61 3.14 -1.26 -3.89 118.33 117.10 2yue n VAL 133 Ca 0.00 -0.18 -0.01 0.00 -2.96 0.00 0.00 64.34 61.19 2yue n VAL 133 Cb 0.00 -1.26 -0.01 0.00 -1.06 0.00 0.00 33.84 31.52 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 2.06 0.07 -4.83 1.55 3.06 0.30 -4.96 119.36 116.62 2yue n ILE 134 Ca 0.14 -0.03 -0.29 0.00 -2.50 0.00 0.00 62.75 60.07 2yue n ILE 134 Cb 0.28 -0.63 -0.15 0.00 0.54 0.00 0.00 39.64 39.68 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 -4.86 2.16 0.00 9.51 2.96 -1.04 -5.01 118.68 122.40 2yue s LEU 135 Ca -0.01 -0.56 0.07 0.00 -0.22 0.00 0.00 54.13 53.40 2yue s LEU 135 Cb 0.00 -1.18 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 2yue s LEU 135 CO 0.03 0.23 0.25 0.35 -1.32 0.00 0.00 176.35 175.89 2yue n THR 136 N 1.82 0.00 -0.65 3.68 -2.24 -1.26 -0.10 114.28 115.54 2yue n THR 136 Ca -0.17 -2.45 0.00 0.00 -2.27 0.00 0.00 64.05 59.16 2yue n THR 136 Cb 0.52 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 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 -0.71 0.65 3.68 3.38 0.00 -1.22 -5.00 105.19 105.98 2yue n GLY 137 Ca 0.04 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 2yue n GLY 137 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yue s ILE 138 N -2.00 5.04 0.21 -0.61 1.09 -1.23 -4.99 121.20 118.71 2yue s ILE 138 Ca 0.00 1.25 -0.25 0.00 -1.10 0.00 0.00 60.65 60.55 2yue s ILE 138 Cb 0.00 -3.96 -0.08 0.00 -1.06 0.00 0.00 42.46 37.35 2yue s ILE 138 CO 0.00 0.17 0.81 -0.62 -0.10 0.00 0.00 174.94 175.20 2yue s ASP 139 N 1.01 7.34 -0.47 3.58 2.15 -1.26 -4.27 116.67 124.74 2yue s ASP 139 Ca 0.31 1.66 0.04 0.00 0.43 0.00 0.00 52.55 55.00 2yue s ASP 139 Cb -0.16 -2.51 0.42 0.00 -0.30 0.00 0.00 42.92 40.37 2yue s ASP 139 CO 0.12 0.13 1.23 0.35 -0.17 0.00 0.00 175.17 176.83 2yue n THR 140 N 1.26 2.53 -0.06 1.71 -2.24 -1.26 -4.73 114.28 111.49 2yue n THR 140 Ca -0.04 -4.79 -0.13 0.00 -2.27 0.00 0.00 64.05 56.83 2yue n THR 140 Cb 0.49 -1.25 -0.04 0.00 -2.10 0.00 0.00 70.33 67.43 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 -0.51 0.31 -1.90 -0.78 5.12 -1.26 -5.08 116.66 112.56 2yue n ARG 141 Ca 0.41 0.13 -0.04 0.00 -1.93 0.00 0.00 57.85 56.43 2yue n ARG 141 Cb 0.64 -1.03 -0.00 0.00 -1.16 0.00 0.00 32.46 30.91 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 -3.79 1.36 -4.35 0.55 2.88 -1.26 -5.10 113.62 103.91 2yue n SER 142 Ca -0.23 -1.28 -0.33 0.00 -1.33 0.00 0.00 58.87 55.71 2yue n SER 142 Cb 0.57 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 64.17 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 -1.20 -3.70 2.46 4.77 -1.26 -5.03 117.00 113.04 2yue n LEU 143 Ca -0.01 0.15 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 2yue n LEU 143 Cb 0.09 -1.09 -0.11 0.00 -2.33 0.00 0.00 43.42 39.97 2yue n LEU 143 CO 0.05 -3.49 0.01 -0.76 -1.33 0.00 0.00 177.39 171.88 2yue s LEU 144 N -0.84 -0.02 0.28 2.23 1.43 -1.26 -4.92 118.68 115.59 2yue s LEU 144 Ca 0.56 0.81 0.11 0.00 -1.03 0.00 0.00 54.13 54.58 2yue s LEU 144 Cb -0.17 1.20 -0.05 0.00 0.03 0.00 0.00 46.19 47.20 2yue s LEU 144 CO 0.67 -0.19 -0.12 0.26 0.23 0.00 0.00 176.35 177.20 2yue s TRP 145 N 1.46 2.45 0.26 0.29 0.51 -1.12 -1.14 118.94 121.64 2yue s TRP 145 Ca -0.09 -0.30 0.09 0.00 -2.12 0.00 0.00 56.10 53.68 2yue s TRP 145 Cb -0.09 -1.09 -0.04 0.00 -0.81 0.00 0.00 33.47 31.44 2yue s TRP 145 CO -0.12 0.67 0.07 -0.08 -0.51 0.00 0.00 176.95 176.98 2yue s THR 146 N -2.44 3.80 0.02 2.01 -1.32 -1.26 -0.72 115.64 115.72 2yue s THR 146 Ca 0.31 -1.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.06 2yue s THR 146 Cb -0.05 -3.04 -0.02 0.00 -1.51 0.00 0.00 72.50 67.88 2yue s THR 146 CO 0.17 -0.36 -0.03 0.68 -2.21 0.00 0.00 174.62 172.87 2yue s VAL 147 N -2.25 0.12 -0.07 5.08 -7.23 0.30 -1.78 120.40 114.57 2yue s VAL 147 Ca 0.32 -0.73 -0.05 0.00 -1.81 0.00 0.00 61.98 59.71 2yue s VAL 147 Cb -0.07 -0.24 0.02 0.00 0.56 0.00 0.00 36.38 36.66 2yue s VAL 147 CO 0.22 -0.38 0.17 -0.63 -0.31 0.00 0.00 175.10 174.17 2yue s ILE 148 N -1.14 -0.01 -0.14 -0.62 1.01 0.43 -1.18 121.20 119.56 2yue s ILE 148 Ca -0.12 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.57 2yue s ILE 148 Cb -0.08 -0.25 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 2yue s ILE 148 CO -0.01 0.01 -0.16 -0.62 0.00 0.00 0.00 174.94 174.16 2yue s ASP 149 N 0.29 3.64 -0.23 3.58 2.15 -0.46 0.07 116.67 125.72 2yue s ASP 149 Ca -0.02 -0.45 -0.07 0.00 0.43 0.00 0.00 52.55 52.44 2yue s ASP 149 Cb -0.03 -1.54 -0.03 0.00 -0.30 0.00 0.00 42.92 41.01 2yue s ASP 149 CO -0.01 0.12 0.07 0.27 -0.17 0.00 0.00 175.17 175.46 2yue s ILE 150 N 0.58 4.53 0.00 4.11 -0.00 -1.26 -3.67 121.20 125.49 2yue s ILE 150 Ca -0.10 -0.11 0.00 0.00 -0.00 0.00 0.00 60.65 60.44 2yue s ILE 150 Cb -0.16 -3.09 0.00 0.00 -0.00 0.00 0.00 42.46 39.21 2yue s ILE 150 CO 0.03 0.38 0.00 0.00 -0.00 0.00 0.00 174.94 175.35 2yue n TYR 151 N 4.42 0.00 0.00 1.37 4.11 -1.25 -4.63 117.16 121.18 2yue n TYR 151 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 2yue n TYR 151 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 2yue n TYR 151 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2yue n GLY 152 N -0.68 0.01 2.33 -7.48 0.00 -1.26 -4.69 105.19 93.41 2yue n GLY 152 Ca 0.00 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 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 8.04 -3.57 1.61 2.85 -1.24 -4.61 115.26 118.35 2yue n ASN 153 Ca 0.00 -2.53 -0.01 0.00 -0.11 0.00 0.00 54.58 51.93 2yue n ASN 153 Cb 0.00 -1.49 -0.06 0.00 1.24 0.00 0.00 39.78 39.47 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 4.07 0.22 -3.68 0.00 -2.24 -1.12 -3.74 114.28 107.79 2yue n THR 155 Ca -0.16 -0.22 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 2yue n THR 155 Cb 0.56 -0.23 -0.13 0.00 -2.10 0.00 0.00 70.33 68.43 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 -3.29 -0.16 -0.14 3.38 0.00 -1.19 -2.00 107.32 103.91 2yue s GLY 156 Ca -0.03 1.04 -0.00 0.00 0.00 0.00 0.00 44.72 45.74 2yue s GLY 156 CO 0.28 1.77 -0.14 -0.26 0.00 0.00 0.00 173.10 174.75 2yue s ILE 157 N 2.01 2.85 -0.17 0.90 -4.36 0.59 -1.49 121.20 121.54 2yue s ILE 157 Ca -0.03 -0.72 0.01 0.00 -0.26 0.00 0.00 60.65 59.65 2yue s ILE 157 Cb -0.11 -2.20 0.01 0.00 1.25 0.00 0.00 42.46 41.41 2yue s ILE 157 CO -0.09 0.52 -0.19 -0.70 0.24 0.00 0.00 174.94 174.71 2yue s GLU 158 N 0.62 3.04 0.40 0.37 2.12 -0.39 -0.44 118.70 124.42 2yue s GLU 158 Ca -0.08 -0.82 -0.23 0.00 0.36 0.00 0.00 54.97 54.20 2yue s GLU 158 Cb -0.16 -2.56 -0.10 0.00 0.26 0.00 0.00 34.13 31.57 2yue s GLU 158 CO 0.03 -0.14 1.00 -0.06 -0.54 0.00 0.00 175.26 175.56 2yue s PHE 159 N 1.13 3.33 0.36 5.30 0.40 -1.26 -0.04 117.98 127.20 2yue s PHE 159 Ca 0.01 1.66 0.09 0.00 -0.60 0.00 0.00 56.93 58.09 2yue s PHE 159 Cb -0.14 -3.02 -0.07 0.00 0.51 0.00 0.00 43.02 40.31 2yue s PHE 159 CO -0.08 -0.37 -0.05 -0.51 0.70 0.00 0.00 175.22 174.91 2yue s LEU 160 N -2.74 2.81 -0.58 -0.37 1.43 -0.76 -4.84 118.68 113.62 2yue s LEU 160 Ca 0.58 -1.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.27 2yue s LEU 160 Cb -0.18 -1.05 0.06 0.00 0.03 0.00 0.00 46.19 45.06 2yue s LEU 160 CO 0.23 -0.26 0.84 -1.81 0.23 0.00 0.00 176.35 175.57 2yue s ASP 161 N -3.65 6.24 0.45 2.29 1.11 -1.26 -4.44 116.67 117.40 2yue s ASP 161 Ca 0.34 -0.84 0.20 0.00 0.18 0.00 0.00 52.55 52.43 2yue s ASP 161 Cb 0.03 -2.38 1.17 0.00 1.07 0.00 0.00 42.92 42.82 2yue s ASP 161 CO 0.17 -1.20 1.87 0.77 1.18 0.00 0.00 175.17 177.97 2yue h SER 162 N 9.30 0.31 -0.47 0.27 4.64 -1.91 0.24 113.55 125.93 2yue h SER 162 Ca -0.28 0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.21 2yue h SER 162 Cb 1.08 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.13 2yue h SER 162 CO 1.09 0.12 0.39 0.03 -0.87 0.00 0.00 176.83 177.59 2yue h ARG 163 N 0.31 0.00 0.14 4.77 2.47 -1.91 0.14 114.38 120.30 2yue h ARG 163 Ca 0.44 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.87 2yue h ARG 163 Cb 1.24 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.58 2yue h ARG 163 CO -0.13 0.00 -1.26 0.82 0.56 0.00 0.00 179.97 179.96 2yue h ILE 164 N 0.00 1.35 -0.88 2.04 2.04 -0.93 -3.27 117.51 117.85 2yue h ILE 164 Ca 0.22 -2.66 -0.41 0.00 1.00 0.00 0.00 64.86 63.01 2yue h ILE 164 Cb 0.99 2.79 -0.25 0.00 -0.74 0.00 0.00 36.82 39.62 2yue h ILE 164 CO -0.00 0.79 0.50 -1.22 0.00 0.00 0.00 178.15 178.22 2yue n TYR 165 N -3.71 2.76 -4.29 1.37 4.02 0.00 -4.95 117.16 112.37 2yue n TYR 165 Ca -0.12 -1.66 -0.18 0.00 -0.01 0.00 0.00 57.90 55.93 2yue n TYR 165 Cb 1.00 -0.85 -0.09 0.00 -0.02 0.00 0.00 39.34 39.39 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 -3.22 1.60 0.18 -0.72 -1.94 0.28 -5.02 119.30 110.47 2yue s MET 166 Ca 0.56 -1.91 0.00 0.00 -1.71 0.00 0.00 55.69 52.62 2yue s MET 166 Cb 0.46 0.14 0.00 0.00 2.01 0.00 0.00 34.83 37.44 2yue s MET 166 CO 0.11 -0.53 0.00 0.66 -0.01 0.00 0.00 175.02 175.25 2yue n TYR 167 N -0.55 -1.77 -1.31 -0.03 4.02 -1.26 -4.91 117.16 111.35 2yue n TYR 167 Ca 0.04 0.35 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 2yue n TYR 167 Cb 0.64 0.80 0.00 0.00 -0.02 0.00 0.00 39.34 40.76 2yue n TYR 167 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79