#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yud s SER 2 N 0.00 4.88 -0.01 1.61 0.01 -1.26 -4.94 113.70 113.99 2yud s SER 2 Ca 0.00 0.38 0.03 0.00 1.31 0.00 0.00 55.95 57.68 2yud s SER 2 Cb 0.00 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 2yud s SER 2 CO 0.00 -2.72 -0.09 -0.94 0.41 0.00 0.00 173.24 169.90 2yud s SER 3 N 9.55 4.43 0.00 2.44 1.04 -1.26 -5.13 113.70 124.78 2yud s SER 3 Ca 0.79 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 57.05 2yud s SER 3 Cb -0.13 -1.00 0.00 0.00 0.10 0.00 0.00 66.02 64.99 2yud s SER 3 CO 0.18 0.30 0.00 0.61 0.98 0.00 0.00 173.24 175.31 2yud n GLY 4 N 1.78 4.06 3.33 7.32 0.00 -1.26 -5.17 105.19 115.26 2yud n GLY 4 Ca -0.16 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 2yud n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yud s SER 5 N -0.13 -0.31 0.13 1.61 0.15 -1.26 -5.18 113.70 108.71 2yud s SER 5 Ca 0.00 0.02 -0.07 0.00 0.70 0.00 0.00 55.95 56.60 2yud s SER 5 Cb 0.00 0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 64.73 2yud s SER 5 CO 0.00 -0.68 0.20 -0.55 1.20 0.00 0.00 173.24 173.41 2yud s SER 6 N -2.01 0.14 -0.60 5.45 0.15 -1.26 -4.92 113.70 110.65 2yud s SER 6 Ca -0.05 -0.90 -0.03 0.00 0.70 0.00 0.00 55.95 55.67 2yud s SER 6 Cb -0.01 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 2yud s SER 6 CO -0.02 -0.80 0.45 0.61 1.20 0.00 0.00 173.24 174.67 2yud n GLY 7 N -0.13 0.28 3.73 9.45 0.00 -1.26 -4.96 105.19 112.30 2yud n GLY 7 Ca -0.09 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 2yud n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2yud n VAL 8 N -3.62 1.54 -3.13 1.61 0.31 -1.26 -4.98 118.33 108.80 2yud n VAL 8 Ca -0.01 -0.38 -0.10 0.00 -0.01 0.00 0.00 64.34 63.83 2yud n VAL 8 Cb 0.53 -1.81 -0.04 0.00 -0.91 0.00 0.00 33.84 31.61 2yud n VAL 8 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2yud s ARG 9 N -1.30 0.88 -0.25 5.55 6.06 -1.26 -5.13 118.95 123.49 2yud s ARG 9 Ca 0.59 -1.03 -0.23 0.00 -2.50 0.00 0.00 55.73 52.57 2yud s ARG 9 Cb -0.53 -0.44 0.06 0.00 0.06 0.00 0.00 34.95 34.11 2yud s ARG 9 CO 0.57 -1.28 0.66 0.00 -2.50 0.00 0.00 175.30 172.75 2yud s ALA 10 N 1.08 -1.63 -0.11 6.12 0.00 -1.26 -5.16 121.76 120.80 2yud s ALA 10 Ca 0.24 1.87 -0.02 0.00 0.00 0.00 0.00 51.96 54.05 2yud s ALA 10 Cb -0.04 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.96 2yud s ALA 10 CO -0.07 -0.31 -0.03 0.54 0.00 0.00 0.00 175.76 175.88 2yud s VAL 11 N 0.38 3.98 -0.12 0.00 0.11 -1.26 -5.10 120.40 118.40 2yud s VAL 11 Ca -0.00 -0.35 -0.02 0.00 -2.93 0.00 0.00 61.98 58.67 2yud s VAL 11 Cb -0.05 -2.69 0.04 0.00 -1.53 0.00 0.00 36.38 32.15 2yud s VAL 11 CO 0.00 0.56 0.02 -0.60 -3.33 0.00 0.00 175.10 171.75 2yud s ARG 12 N -0.35 0.56 -0.24 1.54 3.00 -1.26 -4.64 118.95 117.58 2yud s ARG 12 Ca 0.06 -0.06 -0.37 0.00 -1.00 0.00 0.00 55.73 54.36 2yud s ARG 12 Cb -0.12 -1.38 0.15 0.00 0.00 0.00 0.00 34.95 33.59 2yud s ARG 12 CO 0.02 -0.44 1.32 0.21 0.00 0.00 0.00 175.30 176.42 2yud s LYS 13 N 1.95 0.14 -1.72 5.12 2.20 -1.26 -4.97 119.74 121.20 2yud s LYS 13 Ca 0.03 -0.05 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 2yud s LYS 13 Cb -0.14 0.06 0.00 0.00 -1.51 0.00 0.00 37.83 36.24 2yud s LYS 13 CO -0.06 -0.06 0.00 -3.47 -0.36 0.00 0.00 175.35 171.40 2yud n ASP 14 N -0.08 -5.28 -3.36 1.43 2.03 -1.26 -2.09 116.55 107.94 2yud n ASP 14 Ca 0.03 0.17 -0.24 0.00 0.52 0.00 0.00 54.79 55.27 2yud n ASP 14 Cb 0.57 -4.37 0.01 0.00 -0.72 0.00 0.00 41.12 36.62 2yud n ASP 14 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2yud n GLN 15 N -2.64 -3.93 -0.07 -0.67 7.27 -1.26 -4.83 117.38 111.24 2yud n GLN 15 Ca -0.20 0.58 -0.06 0.00 0.07 0.00 0.00 57.00 57.39 2yud n GLN 15 Cb 0.64 -5.34 -0.13 0.00 2.41 0.00 0.00 30.24 27.82 2yud n GLN 15 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2yud n THR 16 N -4.14 0.96 0.36 1.69 -1.04 -0.89 -4.28 114.28 106.94 2yud n THR 16 Ca -0.03 -0.65 -0.14 0.00 -2.04 0.00 0.00 64.05 61.19 2yud n THR 16 Cb 0.56 -0.47 -0.07 0.00 -1.82 0.00 0.00 70.33 68.53 2yud n THR 16 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 2yud h SER 17 N 0.00 -0.77 -0.88 8.00 0.87 -1.82 0.14 113.55 119.09 2yud h SER 17 Ca -0.38 0.03 0.18 0.00 -1.23 0.00 0.00 61.79 60.38 2yud h SER 17 Cb 1.84 0.20 -0.11 0.00 -0.44 0.00 0.00 62.40 63.89 2yud h SER 17 CO 0.02 -0.54 0.44 0.11 -0.53 0.00 0.00 176.83 176.34 2yud h LYS 18 N -0.93 0.55 -0.25 2.24 1.57 -1.95 0.37 116.57 118.17 2yud h LYS 18 Ca -0.09 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 2yud h LYS 18 Cb 0.69 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2yud h LYS 18 CO 0.15 0.36 0.10 1.25 -0.57 0.00 0.00 179.45 180.74 2yud h LEU 19 N 0.56 0.36 -0.30 2.94 6.46 -1.71 -0.82 115.31 122.80 2yud h LEU 19 Ca 0.51 -0.18 0.00 0.00 -0.12 0.00 0.00 57.88 58.09 2yud h LEU 19 Cb 0.82 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 2yud h LEU 19 CO -0.42 0.44 0.00 1.17 -0.62 0.00 0.00 178.44 179.01 2yud n LYS 20 N -4.77 0.13 0.04 1.25 4.81 0.49 -3.02 118.16 117.10 2yud n LYS 20 Ca -0.03 0.29 -0.22 0.00 -0.87 0.00 0.00 58.31 57.48 2yud n LYS 20 Cb 0.14 -1.71 -0.14 0.00 0.02 0.00 0.00 35.03 33.33 2yud n LYS 20 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 2yud h TYR 21 N 0.00 0.60 -0.00 5.64 5.03 0.33 -2.55 116.97 126.02 2yud h TYR 21 Ca 0.00 -0.44 0.00 0.00 2.58 0.00 0.00 58.73 60.87 2yud h TYR 21 Cb 0.41 -0.02 -0.00 0.00 1.55 0.00 0.00 36.73 38.66 2yud h TYR 21 CO 0.00 1.65 0.06 -0.39 -1.32 0.00 0.00 178.16 178.16 2yud h VAL 22 N -0.04 0.02 -0.07 1.81 -1.51 -1.08 0.13 116.25 115.51 2yud h VAL 22 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 2yud h VAL 22 Cb 1.98 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 32.08 2yud h VAL 22 CO 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.47 2yud n LEU 23 N -3.08 1.98 -4.54 4.19 -0.00 -1.24 -4.75 117.00 109.56 2yud n LEU 23 Ca -0.03 -1.71 -0.50 0.00 -0.00 0.00 0.00 56.01 53.77 2yud n LEU 23 Cb 0.13 -0.05 -0.06 0.00 -0.00 0.00 0.00 43.42 43.44 2yud n LEU 23 CO 0.19 0.48 1.68 1.67 -0.00 0.00 0.00 177.39 181.42 2yud n GLN 24 N -0.10 1.39 -3.37 1.47 7.27 0.03 -0.57 117.38 123.50 2yud n GLN 24 Ca 0.03 0.43 -0.19 0.00 0.07 0.00 0.00 57.00 57.34 2yud n GLN 24 Cb 0.24 -2.52 0.07 0.00 2.41 0.00 0.00 30.24 30.43 2yud n GLN 24 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2yud n ASP 25 N 8.82 -4.93 -4.91 1.69 2.03 -1.26 -4.72 116.55 113.28 2yud n ASP 25 Ca 0.35 -0.46 -0.23 0.00 0.52 0.00 0.00 54.79 54.96 2yud n ASP 25 Cb 0.25 -4.27 -0.01 0.00 -0.72 0.00 0.00 41.12 36.37 2yud n ASP 25 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yud s ALA 26 N -3.27 4.31 -0.20 -1.67 0.00 0.26 -3.43 121.76 117.76 2yud s ALA 26 Ca 0.39 -1.64 -0.06 0.00 0.00 0.00 0.00 51.96 50.65 2yud s ALA 26 Cb -0.17 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 2yud s ALA 26 CO 0.60 -0.42 0.02 1.03 0.00 0.00 0.00 175.76 177.00 2yud s ARG 27 N -4.27 3.72 -0.20 0.00 1.81 0.69 -4.89 118.95 115.81 2yud s ARG 27 Ca 0.43 -0.47 -0.11 0.00 -1.72 0.00 0.00 55.73 53.86 2yud s ARG 27 Cb -0.03 -3.12 -0.05 0.00 -0.45 0.00 0.00 34.95 31.30 2yud s ARG 27 CO 0.26 0.08 0.18 -0.06 -0.68 0.00 0.00 175.30 175.08 2yud s PHE 28 N 0.84 3.40 -0.17 -0.53 0.40 -1.26 -0.11 117.98 120.55 2yud s PHE 28 Ca 0.02 0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.72 2yud s PHE 28 Cb -0.14 -2.23 0.02 0.00 0.51 0.00 0.00 43.02 41.18 2yud s PHE 28 CO 0.02 0.22 -0.18 -0.06 0.70 0.00 0.00 175.22 175.92 2yud s PHE 29 N 0.57 2.55 -0.36 0.36 0.08 -0.36 -1.57 117.98 119.25 2yud s PHE 29 Ca 0.10 -1.47 -0.24 0.00 0.12 0.00 0.00 56.93 55.44 2yud s PHE 29 Cb -0.12 -1.79 0.01 0.00 -0.57 0.00 0.00 43.02 40.55 2yud s PHE 29 CO 0.01 -0.74 0.85 -1.17 -0.10 0.00 0.00 175.22 174.06 2yud s LEU 30 N 1.32 4.07 -0.21 -0.37 0.20 -0.84 -2.48 118.68 120.38 2yud s LEU 30 Ca 0.04 0.46 -0.05 0.00 0.69 0.00 0.00 54.13 55.28 2yud s LEU 30 Cb -0.13 -3.13 -0.02 0.00 -0.43 0.00 0.00 46.19 42.48 2yud s LEU 30 CO -0.11 -0.78 -0.01 0.27 -0.29 0.00 0.00 176.35 175.42 2yud s ILE 31 N 3.26 3.73 -0.12 6.68 -5.25 -1.05 -0.27 121.20 128.18 2yud s ILE 31 Ca 0.34 -0.38 -0.03 0.00 -0.99 0.00 0.00 60.65 59.59 2yud s ILE 31 Cb -0.13 -2.69 -0.03 0.00 2.95 0.00 0.00 42.46 42.56 2yud s ILE 31 CO 0.18 0.42 0.01 -0.54 -1.79 0.00 0.00 174.94 173.22 2yud s LYS 32 N 1.23 3.31 0.27 0.37 -0.14 -1.26 -2.77 119.74 120.74 2yud s LYS 32 Ca 0.03 -0.41 0.02 0.00 -1.36 0.00 0.00 55.97 54.26 2yud s LYS 32 Cb -0.15 -2.91 0.02 0.00 -1.68 0.00 0.00 37.83 33.12 2yud s LYS 32 CO 0.00 0.54 0.18 0.45 -0.76 0.00 0.00 175.35 175.77 2yud n SER 33 N 2.64 1.94 -0.74 2.83 2.88 -1.19 -4.74 113.62 117.24 2yud n SER 33 Ca -0.18 -1.95 0.04 0.00 -1.33 0.00 0.00 58.87 55.45 2yud n SER 33 Cb 0.53 -0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.04 2yud n SER 33 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2yud n ASN 34 N -1.85 0.88 -3.62 -3.46 0.23 -1.26 -3.71 115.26 102.47 2yud n ASN 34 Ca -0.02 -2.40 -0.04 0.00 -0.53 0.00 0.00 54.58 51.60 2yud n ASN 34 Cb 0.31 -0.31 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 2yud n ASN 34 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2yud s ASN 35 N -1.86 -0.11 0.26 0.53 4.22 -1.26 -5.00 114.94 111.72 2yud s ASN 35 Ca 0.20 0.07 0.14 0.00 -2.14 0.00 0.00 52.86 51.13 2yud s ASN 35 Cb 0.20 0.10 0.07 0.00 1.28 0.00 0.00 41.25 42.91 2yud s ASN 35 CO -0.05 -0.13 1.44 0.45 -2.04 0.00 0.00 177.10 176.77 2yud h HIS 36 N 2.10 0.00 -0.73 1.54 3.86 -1.98 -3.30 115.15 116.64 2yud h HIS 36 Ca -0.09 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.25 2yud h HIS 36 Cb 1.17 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.55 2yud h HIS 36 CO 0.25 0.58 0.29 0.93 0.86 0.00 0.00 177.93 180.84 2yud h GLU 37 N 0.00 0.44 -0.31 2.45 5.08 -1.97 -0.67 114.58 119.60 2yud h GLU 37 Ca -0.01 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2yud h GLU 37 Cb 1.41 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.54 2yud h GLU 37 CO 0.08 0.29 0.15 -0.91 -1.00 0.00 0.00 179.01 177.62 2yud h ASN 38 N 0.45 0.23 0.76 1.42 2.35 -1.89 0.18 115.58 119.07 2yud h ASN 38 Ca 0.40 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 56.12 2yud h ASN 38 Cb 0.57 -0.03 0.01 0.00 0.05 0.00 0.00 38.32 38.92 2yud h ASN 38 CO -0.38 0.17 -0.36 0.58 -1.65 0.00 0.00 177.43 175.79 2yud h VAL 39 N 0.32 0.00 -0.30 2.81 2.07 -1.40 0.01 116.25 119.76 2yud h VAL 39 Ca 0.13 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.71 2yud h VAL 39 Cb 0.04 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.74 2yud h VAL 39 CO -0.09 0.00 -0.17 0.28 0.02 0.00 0.00 177.57 177.62 2yud h SER 40 N -1.03 -0.55 -0.93 0.57 0.02 -1.15 0.83 113.55 111.32 2yud h SER 40 Ca -0.10 0.12 0.12 0.00 -0.84 0.00 0.00 61.79 61.09 2yud h SER 40 Cb 0.78 0.29 -0.08 0.00 0.14 0.00 0.00 62.40 63.53 2yud h SER 40 CO 0.17 -0.20 0.56 0.25 -1.14 0.00 0.00 176.83 176.46 2yud h LEU 41 N -0.13 0.79 -0.99 5.07 5.85 -0.63 0.19 115.31 125.47 2yud h LEU 41 Ca 0.16 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 2yud h LEU 41 Cb 0.37 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2yud h LEU 41 CO -0.38 0.42 -0.43 0.00 -0.34 0.00 0.00 178.44 177.71 2yud h ALA 42 N 1.52 1.15 0.00 1.25 0.00 0.39 -1.19 119.26 122.38 2yud h ALA 42 Ca 0.46 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2yud h ALA 42 Cb 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2yud h ALA 42 CO -0.27 0.59 -0.47 0.87 0.00 0.00 0.00 179.25 179.96 2yud h LYS 43 N 0.13 0.00 0.04 0.00 1.57 0.11 0.26 116.57 118.68 2yud h LYS 43 Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2yud h LYS 43 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 2yud h LYS 43 CO 0.06 0.47 -0.41 0.00 -0.57 0.00 0.00 179.45 179.01 2yud h ALA 44 N 1.53 0.01 0.00 3.86 0.00 -0.43 -3.34 119.26 120.88 2yud h ALA 44 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2yud h ALA 44 Cb 1.28 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.19 2yud h ALA 44 CO 0.06 0.21 -0.37 0.87 0.00 0.00 0.00 179.25 180.02 2yud h LYS 45 N -0.80 0.00 -1.91 0.00 1.79 -1.32 -3.48 116.57 110.84 2yud h LYS 45 Ca -0.09 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.24 2yud h LYS 45 Cb 1.23 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.90 2yud h LYS 45 CO 0.02 0.00 -0.22 0.41 -1.08 0.00 0.00 179.45 178.58 2yud n GLY 46 N 1.15 0.24 2.60 3.86 0.00 0.86 -5.03 105.19 108.87 2yud n GLY 46 Ca 0.03 -0.46 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2yud n GLY 46 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2yud n VAL 47 N -3.70 0.00 -3.38 1.61 0.24 -0.82 -3.69 118.33 108.59 2yud n VAL 47 Ca -0.04 -1.97 0.02 0.00 -2.04 0.00 0.00 64.34 60.31 2yud n VAL 47 Cb 0.54 0.97 -0.03 0.00 -1.47 0.00 0.00 33.84 33.85 2yud n VAL 47 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2yud s TRP 48 N -3.08 -0.97 -0.00 6.34 -0.00 -1.21 -4.41 118.94 115.61 2yud s TRP 48 Ca 0.32 1.45 -0.01 0.00 -0.00 0.00 0.00 56.10 57.86 2yud s TRP 48 Cb 0.02 0.50 -0.04 0.00 -0.00 0.00 0.00 33.47 33.94 2yud s TRP 48 CO 0.22 -0.50 0.10 0.45 -0.00 0.00 0.00 176.95 177.23 2yud s SER 49 N 2.70 5.84 0.33 5.86 0.15 -1.26 -3.01 113.70 124.31 2yud s SER 49 Ca 0.01 0.19 -0.12 0.00 0.70 0.00 0.00 55.95 56.73 2yud s SER 49 Cb -0.10 -1.72 0.02 0.00 -1.71 0.00 0.00 66.02 62.52 2yud s SER 49 CO -0.17 0.27 0.61 0.28 1.20 0.00 0.00 173.24 175.43 2yud s THR 50 N -1.23 0.00 1.00 6.45 -1.32 -1.25 -5.02 115.64 114.28 2yud s THR 50 Ca 0.24 -1.28 -0.16 0.00 -1.21 0.00 0.00 61.69 59.28 2yud s THR 50 Cb -0.12 -2.54 -0.02 0.00 -1.51 0.00 0.00 72.50 68.30 2yud s THR 50 CO 0.15 0.00 -0.17 0.18 -2.21 0.00 0.00 174.62 172.57 2yud n LEU 51 N -0.50 -2.42 -0.10 9.08 7.99 -1.26 -4.09 117.00 125.70 2yud n LEU 51 Ca -0.03 0.18 -0.12 0.00 -0.01 0.00 0.00 56.01 56.02 2yud n LEU 51 Cb 0.61 -0.98 -0.01 0.00 -0.11 0.00 0.00 43.42 42.93 2yud n LEU 51 CO 0.25 -4.11 0.55 1.55 -1.51 0.00 0.00 177.39 174.12 2yud h PRO 52 N -1.44 0.89 -0.73 3.23 0.13 -1.77 -2.93 132.00 129.38 2yud h PRO 52 Ca -0.45 -0.47 0.07 0.00 -0.87 0.00 0.00 66.00 64.27 2yud h PRO 52 Cb 1.31 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.40 2yud h PRO 52 CO 0.31 1.12 0.42 -0.39 -0.23 0.00 0.00 178.00 179.22 2yud h VAL 53 N 0.73 0.97 -0.18 1.56 -1.51 -1.90 -1.09 116.25 114.83 2yud h VAL 53 Ca 0.06 -0.26 -0.10 0.00 -1.23 0.00 0.00 66.70 65.17 2yud h VAL 53 Cb 0.98 0.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.27 2yud h VAL 53 CO 0.09 0.14 -0.32 0.78 -1.23 0.00 0.00 177.57 177.03 2yud h ASN 54 N 0.76 0.37 0.57 4.19 2.35 -1.90 -1.42 115.58 120.49 2yud h ASN 54 Ca 0.33 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 2yud h ASN 54 Cb 0.21 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 38.49 2yud h ASN 54 CO -0.19 0.68 -0.27 -0.08 -1.65 0.00 0.00 177.43 175.91 2yud h GLU 55 N 0.31 -0.74 -0.60 0.81 4.81 -1.07 -1.03 114.58 117.07 2yud h GLU 55 Ca 0.04 0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2yud h GLU 55 Cb 0.73 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.24 2yud h GLU 55 CO 0.06 -0.43 0.37 1.57 -0.73 0.00 0.00 179.01 179.85 2yud h LYS 56 N -1.02 0.81 -0.05 1.92 2.10 -1.27 -0.66 116.57 118.40 2yud h LYS 56 Ca -0.08 -0.06 -0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2yud h LYS 56 Cb 0.65 -0.18 -0.00 0.00 -0.90 0.00 0.00 32.23 31.80 2yud h LYS 56 CO 0.13 0.56 0.02 0.87 -2.00 0.00 0.00 179.45 179.03 2yud h LYS 57 N 0.83 0.08 -0.36 0.07 1.57 -1.20 -1.47 116.57 116.08 2yud h LYS 57 Ca 0.22 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 2yud h LYS 57 Cb -0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2yud h LYS 57 CO -0.04 0.21 -0.07 -0.07 -0.57 0.00 0.00 179.45 178.91 2yud h LEU 58 N -0.07 0.59 0.05 2.94 3.38 -0.84 -1.49 115.31 119.87 2yud h LEU 58 Ca 0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2yud h LEU 58 Cb 0.16 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2yud h LEU 58 CO -0.00 0.71 -0.03 0.78 0.09 0.00 0.00 178.44 179.99 2yud h ASN 59 N 0.57 -0.06 -0.27 -0.43 -0.26 -0.92 0.29 115.58 114.49 2yud h ASN 59 Ca 0.11 -0.13 -0.01 0.00 -0.56 0.00 0.00 56.30 55.71 2yud h ASN 59 Cb 0.47 0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.74 2yud h ASN 59 CO 0.03 0.09 0.11 -0.07 -1.06 0.00 0.00 177.43 176.52 2yud h LEU 60 N -0.21 0.37 -1.60 1.61 3.38 -1.16 -1.24 115.31 116.44 2yud h LEU 60 Ca -0.01 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2yud h LEU 60 Cb 0.18 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2yud h LEU 60 CO 0.01 0.42 -0.20 0.00 0.09 0.00 0.00 178.44 178.76 2yud h ALA 61 N 0.96 1.30 0.06 1.53 0.00 -1.21 0.81 119.26 122.70 2yud h ALA 61 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2yud h ALA 61 Cb 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2yud h ALA 61 CO -0.01 0.26 -0.03 0.35 0.00 0.00 0.00 179.25 179.82 2yud h PHE 62 N 0.00 -0.07 0.00 0.00 3.04 0.05 0.15 116.94 120.11 2yud h PHE 62 Ca -0.00 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 61.87 2yud h PHE 62 Cb 0.48 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.00 2yud h PHE 62 CO 0.00 0.51 -0.35 0.07 -2.02 0.00 0.00 178.31 176.53 2yud h ARG 63 N -0.75 0.00 0.13 1.11 0.11 -1.16 -3.12 114.38 110.70 2yud h ARG 63 Ca -0.01 0.00 -0.30 0.00 0.10 0.00 0.00 59.98 59.77 2yud h ARG 63 Cb 0.62 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.69 2yud h ARG 63 CO 0.01 0.35 -1.49 1.03 0.10 0.00 0.00 179.97 179.97 2yud h SER 64 N 0.00 0.43 -3.67 0.08 0.87 -0.88 -3.47 113.55 106.90 2yud h SER 64 Ca -0.00 -0.56 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 2yud h SER 64 Cb 0.87 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2yud h SER 64 CO 0.05 1.46 0.00 0.00 -0.53 0.00 0.00 176.83 177.80 2yud n ALA 65 N -2.65 0.00 -0.46 6.23 0.00 0.53 -5.05 120.51 119.10 2yud n ALA 65 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2yud n ALA 65 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.49 2yud n ALA 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2yud n ARG 66 N -0.69 0.00 -4.52 0.00 1.74 -1.22 -4.76 116.66 107.21 2yud n ARG 66 Ca 0.00 0.27 -0.25 0.00 -0.77 0.00 0.00 57.85 57.10 2yud n ARG 66 Cb 0.00 -0.86 -0.09 0.00 -1.02 0.00 0.00 32.46 30.49 2yud n ARG 66 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2yud s SER 67 N -2.06 2.80 -0.28 0.55 0.01 -1.26 -4.89 113.70 108.57 2yud s SER 67 Ca 0.00 -1.56 -0.03 0.00 1.31 0.00 0.00 55.95 55.67 2yud s SER 67 Cb 0.00 0.29 0.09 0.00 0.21 0.00 0.00 66.02 66.61 2yud s SER 67 CO 0.00 -0.80 0.10 -0.69 0.41 0.00 0.00 173.24 172.26 2yud s VAL 68 N -3.20 0.36 0.35 3.43 1.01 -1.26 -0.23 120.40 120.87 2yud s VAL 68 Ca 0.26 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 61.10 2yud s VAL 68 Cb 0.05 -1.22 -0.10 0.00 0.00 0.00 0.00 36.38 35.11 2yud s VAL 68 CO 0.14 -0.61 0.89 -0.63 0.00 0.00 0.00 175.10 174.89 2yud s ILE 69 N 1.89 4.38 -0.30 2.22 -1.09 0.84 -0.20 121.20 128.95 2yud s ILE 69 Ca 0.07 1.52 0.00 0.00 -2.23 0.00 0.00 60.65 60.01 2yud s ILE 69 Cb -0.17 -3.78 0.09 0.00 -1.58 0.00 0.00 42.46 37.03 2yud s ILE 69 CO -0.27 -0.07 0.07 -0.76 -1.23 0.00 0.00 174.94 172.67 2yud s LEU 70 N -2.61 2.71 -0.34 2.97 1.43 0.21 -1.22 118.68 121.84 2yud s LEU 70 Ca 0.54 -1.63 -0.25 0.00 -1.03 0.00 0.00 54.13 51.76 2yud s LEU 70 Cb -0.13 -1.04 0.01 0.00 0.03 0.00 0.00 46.19 45.06 2yud s LEU 70 CO 0.18 -0.38 0.89 -0.63 0.23 0.00 0.00 176.35 176.64 2yud s ILE 71 N 1.47 4.66 -0.08 -0.59 1.01 -1.03 -1.50 121.20 125.14 2yud s ILE 71 Ca 0.07 1.25 -0.23 0.00 0.00 0.00 0.00 60.65 61.75 2yud s ILE 71 Cb -0.18 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 2yud s ILE 71 CO -0.18 -0.41 0.68 -0.36 0.00 0.00 0.00 174.94 174.66 2yud s PHE 72 N 3.28 3.56 -0.12 3.97 0.40 0.02 -2.53 117.98 126.57 2yud s PHE 72 Ca 0.37 1.21 -0.03 0.00 -0.60 0.00 0.00 56.93 57.87 2yud s PHE 72 Cb -0.13 -2.78 0.04 0.00 0.51 0.00 0.00 43.02 40.66 2yud s PHE 72 CO 0.16 0.09 0.05 0.45 0.70 0.00 0.00 175.22 176.67 2yud s SER 73 N 0.79 1.93 0.11 1.36 0.15 -1.12 -1.90 113.70 115.03 2yud s SER 73 Ca 0.36 -0.34 -0.30 0.00 0.70 0.00 0.00 55.95 56.37 2yud s SER 73 Cb -0.17 -0.31 -0.06 0.00 -1.71 0.00 0.00 66.02 63.77 2yud s SER 73 CO 0.17 -0.28 1.01 -0.69 1.20 0.00 0.00 173.24 174.65 2yud s VAL 74 N 2.07 4.37 0.44 4.45 1.01 -1.26 -3.18 120.40 128.30 2yud s VAL 74 Ca 0.03 1.93 -0.24 0.00 0.00 0.00 0.00 61.98 63.71 2yud s VAL 74 Cb -0.14 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 31.92 2yud s VAL 74 CO -0.06 0.28 1.16 -0.60 0.00 0.00 0.00 175.10 175.87 2yud s ARG 75 N 0.09 3.87 -1.72 2.72 3.52 -1.24 -2.81 118.95 123.38 2yud s ARG 75 Ca 0.49 1.77 0.00 0.00 -0.13 0.00 0.00 55.73 57.85 2yud s ARG 75 Cb -0.25 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.66 2yud s ARG 75 CO 0.31 -0.46 0.00 0.39 -0.81 0.00 0.00 175.30 174.73 2yud n GLU 76 N -0.31 -1.60 -0.10 5.12 1.02 -1.26 -4.81 120.64 118.70 2yud n GLU 76 Ca 0.06 0.96 -0.11 0.00 -0.02 0.00 0.00 57.16 58.05 2yud n GLU 76 Cb 0.48 -5.42 -0.14 0.00 -0.02 0.00 0.00 31.44 26.33 2yud n GLU 76 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2yud n SER 77 N -1.40 0.72 -0.70 1.62 3.41 -1.12 -5.01 113.62 111.15 2yud n SER 77 Ca -0.19 -0.03 -0.08 0.00 -0.26 0.00 0.00 58.87 58.32 2yud n SER 77 Cb 0.61 0.67 -0.02 0.00 -0.26 0.00 0.00 64.21 65.21 2yud n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yud n GLY 78 N 1.94 0.60 3.60 5.00 0.00 -1.26 -4.98 105.19 110.09 2yud n GLY 78 Ca -0.34 -0.65 -0.05 0.00 0.00 0.00 0.00 46.02 44.99 2yud n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yud s LYS 79 N -3.34 0.30 0.25 1.61 -2.85 -1.26 -2.58 119.74 111.86 2yud s LYS 79 Ca 0.00 -0.08 -0.28 0.00 -1.00 0.00 0.00 55.97 54.61 2yud s LYS 79 Cb 0.00 0.14 -0.09 0.00 -2.06 0.00 0.00 37.83 35.82 2yud s LYS 79 CO 0.00 -0.12 0.91 -0.06 0.10 0.00 0.00 175.35 176.18 2yud s PHE 80 N -2.16 3.89 -0.40 1.78 0.40 0.93 -4.01 117.98 118.41 2yud s PHE 80 Ca 0.09 1.83 0.09 0.00 -0.60 0.00 0.00 56.93 58.34 2yud s PHE 80 Cb -0.01 -2.93 0.62 0.00 0.51 0.00 0.00 43.02 41.21 2yud s PHE 80 CO -0.05 0.40 1.52 1.04 0.70 0.00 0.00 175.22 178.83 2yud n GLN 81 N 1.22 3.66 0.00 0.44 1.13 -0.80 -2.48 117.38 120.55 2yud n GLN 81 Ca -0.01 -2.43 0.00 0.00 -1.94 0.00 0.00 57.00 52.62 2yud n GLN 81 Cb 0.48 -2.07 0.00 0.00 0.11 0.00 0.00 30.24 28.77 2yud n GLN 81 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2yud n GLY 82 N 0.25 -1.39 2.92 1.08 0.00 -1.24 -4.87 105.19 101.93 2yud n GLY 82 Ca 0.26 -2.11 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 2yud n GLY 82 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2yud n PHE 83 N -0.01 -1.81 -3.64 1.61 -1.74 -1.26 -0.80 117.46 109.81 2yud n PHE 83 Ca 0.00 -1.64 -0.06 0.00 -0.56 0.00 0.00 57.45 55.19 2yud n PHE 83 Cb 0.00 0.64 -0.07 0.00 1.52 0.00 0.00 39.48 41.57 2yud n PHE 83 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2yud s ALA 84 N -2.11 -2.13 -0.11 1.98 0.00 -0.56 -4.15 121.76 114.69 2yud s ALA 84 Ca 0.17 1.89 -0.18 0.00 0.00 0.00 0.00 51.96 53.83 2yud s ALA 84 Cb -0.03 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.45 2yud s ALA 84 CO 0.12 -0.23 0.49 0.50 0.00 0.00 0.00 175.76 176.64 2yud s ARG 85 N 0.42 4.33 -0.45 0.00 3.52 -1.26 -0.62 118.95 124.90 2yud s ARG 85 Ca 0.01 0.48 -0.32 0.00 -0.13 0.00 0.00 55.73 55.77 2yud s ARG 85 Cb -0.05 -3.43 -0.11 0.00 -1.56 0.00 0.00 34.95 29.81 2yud s ARG 85 CO -0.10 0.17 2.31 -0.11 -0.81 0.00 0.00 175.30 176.76 2yud n LEU 86 N 3.60 2.08 0.00 -0.88 7.94 0.73 -3.31 117.00 127.15 2yud n LEU 86 Ca -0.07 0.14 0.14 0.00 -1.11 0.00 0.00 56.01 55.11 2yud n LEU 86 Cb 0.52 -1.33 0.66 0.00 0.53 0.00 0.00 43.42 43.80 2yud n LEU 86 CO 0.43 -0.92 0.98 -0.24 -1.11 0.00 0.00 177.39 176.53 2yud n SER 87 N 11.57 0.00 -3.62 1.96 2.88 -0.42 -4.61 113.62 121.38 2yud n SER 87 Ca 0.42 0.25 -0.01 0.00 -1.33 0.00 0.00 58.87 58.21 2yud n SER 87 Cb 0.30 -0.42 -0.01 0.00 -0.75 0.00 0.00 64.21 63.33 2yud n SER 87 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yud s SER 88 N -2.83 -0.01 1.16 -3.46 0.15 -1.23 -5.04 113.70 102.44 2yud s SER 88 Ca 0.19 -0.00 -0.10 0.00 0.70 0.00 0.00 55.95 56.74 2yud s SER 88 Cb 0.19 0.02 0.15 0.00 -1.71 0.00 0.00 66.02 64.67 2yud s SER 88 CO 0.49 -0.03 0.43 -0.62 1.20 0.00 0.00 173.24 174.71 2yud n GLU 89 N -0.15 -2.57 -0.92 5.44 1.02 -1.26 -4.10 120.64 118.11 2yud n GLU 89 Ca 0.01 -0.70 -0.31 0.00 -0.02 0.00 0.00 57.16 56.15 2yud n GLU 89 Cb 0.58 -0.76 0.26 0.00 -0.02 0.00 0.00 31.44 31.50 2yud n GLU 89 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2yud s SER 90 N -2.64 0.13 0.39 1.62 1.04 -1.26 -4.18 113.70 108.80 2yud s SER 90 Ca 0.30 0.54 0.03 0.00 0.48 0.00 0.00 55.95 57.30 2yud s SER 90 Cb -0.04 -0.70 0.03 0.00 0.10 0.00 0.00 66.02 65.41 2yud s SER 90 CO 0.24 -4.60 0.24 1.41 0.98 0.00 0.00 173.24 171.51 2yud n HIS 91 N -5.07 -0.52 0.00 5.02 8.25 0.85 -4.93 115.22 118.82 2yud n HIS 91 Ca 0.15 -1.71 0.00 0.00 -0.26 0.00 0.00 57.72 55.90 2yud n HIS 91 Cb 0.60 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2yud n HIS 91 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2yud n HIS 92 N -1.33 -0.31 -1.30 4.41 8.25 -1.26 -4.50 115.22 119.17 2yud n HIS 92 Ca -0.04 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.13 2yud n HIS 92 Cb 0.46 0.10 0.18 0.00 1.12 0.00 0.00 29.99 31.85 2yud n HIS 92 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2yud s GLY 93 N -2.08 1.58 0.00 -1.41 0.00 -1.26 -4.84 107.32 99.30 2yud s GLY 93 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.14 2yud s GLY 93 CO 0.00 0.08 0.00 0.61 0.00 0.00 0.00 173.10 173.79 2yud n GLY 94 N -1.54 1.45 3.20 0.20 0.00 -1.26 -4.84 105.19 102.39 2yud n GLY 94 Ca 0.07 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 2yud n GLY 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yud s SER 95 N -4.00 -0.03 0.82 1.61 0.01 -1.26 -5.16 113.70 105.69 2yud s SER 95 Ca 0.00 -0.28 -0.11 0.00 1.31 0.00 0.00 55.95 56.87 2yud s SER 95 Cb 0.00 0.31 0.08 0.00 0.21 0.00 0.00 66.02 66.62 2yud s SER 95 CO 0.00 -0.56 1.09 -2.16 0.41 0.00 0.00 173.24 172.02 2yud s PRO 96 N -2.45 1.91 0.83 12.44 0.04 -1.26 -5.03 135.00 141.47 2yud s PRO 96 Ca -0.06 1.05 -0.11 0.00 0.04 0.00 0.00 61.00 61.92 2yud s PRO 96 Cb -0.01 -1.87 0.09 0.00 0.04 0.00 0.00 34.50 32.75 2yud s PRO 96 CO -0.03 -1.85 1.09 0.96 0.04 0.00 0.00 177.00 177.21 2yud s ILE 97 N -2.91 2.96 -1.14 0.56 -5.25 -1.26 -4.89 121.20 109.26 2yud s ILE 97 Ca 0.62 0.31 -0.16 0.00 -0.99 0.00 0.00 60.65 60.43 2yud s ILE 97 Cb -0.17 -2.95 -0.06 0.00 2.95 0.00 0.00 42.46 42.23 2yud s ILE 97 CO 0.56 -0.41 2.15 0.00 -1.79 0.00 0.00 174.94 175.46 2yud n HIS 98 N -3.59 2.58 -0.70 1.37 -0.00 -1.26 -4.95 115.22 108.68 2yud n HIS 98 Ca 0.07 -2.42 -0.33 0.00 -0.00 0.00 0.00 57.72 55.04 2yud n HIS 98 Cb 0.56 -2.13 0.16 0.00 -0.00 0.00 0.00 29.99 28.58 2yud n HIS 98 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 2yud n TRP 99 N 6.31 -1.43 -3.61 -1.40 7.02 -1.26 -4.94 117.44 118.12 2yud n TRP 99 Ca 0.52 0.17 -0.40 0.00 -1.02 0.00 0.00 57.50 56.78 2yud n TRP 99 Cb 0.36 -1.56 -0.10 0.00 -2.42 0.00 0.00 31.31 27.59 2yud n TRP 99 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2yud s VAL 100 N -2.23 4.07 0.18 -0.99 0.11 -1.26 -5.08 120.40 115.20 2yud s VAL 100 Ca 0.55 -1.66 0.08 0.00 -2.93 0.00 0.00 61.98 58.02 2yud s VAL 100 Cb -0.11 -3.61 -0.04 0.00 -1.53 0.00 0.00 36.38 31.09 2yud s VAL 100 CO 0.66 -0.64 -0.03 -0.76 -3.33 0.00 0.00 175.10 171.00 2yud s LEU 101 N 1.36 3.20 0.00 2.54 1.43 -1.26 -4.87 118.68 121.08 2yud s LEU 101 Ca 0.05 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 52.63 2yud s LEU 101 Cb -0.24 -1.86 0.09 0.00 0.03 0.00 0.00 46.19 44.20 2yud s LEU 101 CO -0.00 0.09 0.31 -0.81 0.23 0.00 0.00 176.35 176.17 2yud n PRO 102 N -0.06 -1.62 -1.55 1.29 -0.04 -1.26 -4.88 135.00 126.88 2yud n PRO 102 Ca -0.10 -0.49 -0.35 0.00 -0.04 0.00 0.00 63.50 62.52 2yud n PRO 102 Cb 0.55 -0.46 -0.04 0.00 -0.04 0.00 0.00 33.50 33.51 2yud n PRO 102 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yud n ALA 103 N -3.53 7.05 0.03 0.55 0.00 -1.26 -4.02 120.51 119.33 2yud n ALA 103 Ca -0.06 -3.51 0.00 0.00 0.00 0.00 0.00 53.44 49.87 2yud n ALA 103 Cb 0.17 -2.91 0.00 0.00 0.00 0.00 0.00 19.45 16.70 2yud n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yud n GLY 104 N 2.49 -0.78 3.76 0.00 0.00 -1.26 -5.14 105.19 104.27 2yud n GLY 104 Ca 0.66 0.24 -0.39 0.00 0.00 0.00 0.00 46.02 46.53 2yud n GLY 104 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2yud s MET 105 N -2.00 3.55 0.22 1.61 0.00 -1.26 -5.03 119.30 116.40 2yud s MET 105 Ca 0.00 2.18 0.06 0.00 0.00 0.00 0.00 55.69 57.93 2yud s MET 105 Cb 0.00 -2.48 -0.04 0.00 0.00 0.00 0.00 34.83 32.31 2yud s MET 105 CO 0.00 -0.84 0.16 -1.12 0.00 0.00 0.00 175.02 173.22 2yud s SER 106 N -0.88 5.45 0.24 1.11 0.01 -1.26 -4.69 113.70 113.69 2yud s SER 106 Ca 0.64 -0.23 0.17 0.00 1.31 0.00 0.00 55.95 57.84 2yud s SER 106 Cb -0.39 -1.38 0.04 0.00 0.21 0.00 0.00 66.02 64.51 2yud s SER 106 CO 0.48 0.00 1.28 0.00 0.41 0.00 0.00 173.24 175.41 2yud h ALA 107 N 1.86 0.69 0.00 1.44 0.00 -2.00 -3.27 119.26 117.98 2yud h ALA 107 Ca -0.48 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 53.95 2yud h ALA 107 Cb 1.22 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2yud h ALA 107 CO 0.61 0.58 -0.10 1.57 0.00 0.00 0.00 179.25 181.91 2yud h LYS 108 N 0.00 0.00 0.00 0.00 2.10 -1.95 -1.55 116.57 115.16 2yud h LYS 108 Ca -0.04 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.53 2yud h LYS 108 Cb 1.36 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.68 2yud h LYS 108 CO 0.05 0.10 -0.37 0.52 -2.00 0.00 0.00 179.45 177.76 2yud h MET 109 N 0.00 0.00 0.00 0.07 2.86 -1.95 -2.63 114.93 113.28 2yud h MET 109 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2yud h MET 109 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2yud h MET 109 CO 0.01 0.37 0.00 1.28 1.06 0.00 0.00 176.91 179.63 2yud n LEU 110 N -3.59 0.48 0.00 1.22 4.77 -0.58 -2.69 117.00 116.61 2yud n LEU 110 Ca -0.00 0.63 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 2yud n LEU 110 Cb 0.49 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2yud n LEU 110 CO 0.37 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.51 2yud n GLY 111 N -0.18 2.09 0.00 -0.72 0.00 -1.00 -3.76 105.19 101.63 2yud n GLY 111 Ca 0.02 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2yud n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yud n GLY 112 N 0.00 3.24 3.35 -0.02 0.00 -1.26 -4.89 105.19 105.60 2yud n GLY 112 Ca 0.00 -2.04 -0.28 0.00 0.00 0.00 0.00 46.02 43.69 2yud n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yud s VAL 113 N 1.70 2.10 0.17 1.61 1.01 -1.26 -4.53 120.40 121.20 2yud s VAL 113 Ca 0.00 -1.56 0.07 0.00 0.00 0.00 0.00 61.98 60.48 2yud s VAL 113 Cb 0.00 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2yud s VAL 113 CO 0.00 0.17 0.04 -0.36 0.00 0.00 0.00 175.10 174.95 2yud s PHE 114 N -0.96 2.93 -0.47 5.22 0.08 -1.17 -0.11 117.98 123.51 2yud s PHE 114 Ca 0.12 -0.10 -0.11 0.00 0.12 0.00 0.00 56.93 56.96 2yud s PHE 114 Cb -0.10 -1.42 0.11 0.00 -0.57 0.00 0.00 43.02 41.04 2yud s PHE 114 CO 0.04 0.52 0.36 0.15 -0.10 0.00 0.00 175.22 176.18 2yud s LYS 115 N -2.96 2.63 -0.15 0.44 -0.14 -1.26 -3.33 119.74 114.98 2yud s LYS 115 Ca 0.28 -1.65 -0.06 0.00 -1.36 0.00 0.00 55.97 53.18 2yud s LYS 115 Cb -0.10 -3.97 -0.04 0.00 -1.68 0.00 0.00 37.83 32.04 2yud s LYS 115 CO 0.20 -1.15 0.05 0.96 -0.76 0.00 0.00 175.35 174.66 2yud s ILE 116 N 1.44 4.74 -0.69 2.17 -4.36 -1.24 -1.30 121.20 121.96 2yud s ILE 116 Ca 0.04 -0.06 -0.10 0.00 -0.26 0.00 0.00 60.65 60.28 2yud s ILE 116 Cb -0.26 -3.09 0.18 0.00 1.25 0.00 0.00 42.46 40.54 2yud s ILE 116 CO 0.01 0.52 0.58 -1.81 0.24 0.00 0.00 174.94 174.48 2yud s ASP 117 N -0.15 6.06 -0.34 4.36 1.01 -1.21 -4.65 116.67 121.76 2yud s ASP 117 Ca 0.07 -2.57 -0.35 0.00 0.71 0.00 0.00 52.55 50.41 2yud s ASP 117 Cb -0.12 -2.06 -0.11 0.00 1.01 0.00 0.00 42.92 41.64 2yud s ASP 117 CO 0.01 -0.54 2.19 0.79 0.21 0.00 0.00 175.17 177.83 2yud n TRP 118 N 4.04 1.63 0.02 4.23 7.02 -1.26 -4.04 117.44 129.07 2yud n TRP 118 Ca 0.07 0.24 -0.01 0.00 -1.02 0.00 0.00 57.50 56.78 2yud n TRP 118 Cb 0.42 -2.55 -0.09 0.00 -2.42 0.00 0.00 31.31 26.67 2yud n TRP 118 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2yud n ILE 119 N 7.25 1.16 -3.90 -0.99 -0.00 -1.26 -4.79 119.36 116.84 2yud n ILE 119 Ca 0.40 -0.70 -0.29 0.00 -0.00 0.00 0.00 62.75 62.16 2yud n ILE 119 Cb 0.25 -0.70 -0.16 0.00 -0.00 0.00 0.00 39.64 39.03 2yud n ILE 119 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2yud n ARG 121 N 4.78 2.23 -2.14 0.00 0.63 -1.26 -4.44 116.66 116.47 2yud n ARG 121 Ca -0.12 -2.21 -0.01 0.00 -0.92 0.00 0.00 57.85 54.59 2yud n ARG 121 Cb 0.45 -1.98 -0.00 0.00 0.45 0.00 0.00 32.46 31.38 2yud n ARG 121 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2yud n ARG 122 N 0.48 0.23 -2.78 -0.14 5.12 -1.26 -5.13 116.66 113.17 2yud n ARG 122 Ca 0.44 -0.20 -0.09 0.00 -1.93 0.00 0.00 57.85 56.06 2yud n ARG 122 Cb 0.55 0.15 -0.02 0.00 -1.16 0.00 0.00 32.46 31.98 2yud n ARG 122 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2yud n GLU 123 N -0.04 1.33 -3.56 5.56 4.71 -1.26 -3.67 120.64 123.71 2yud n GLU 123 Ca 0.00 -1.10 -0.00 0.00 -0.01 0.00 0.00 57.16 56.05 2yud n GLU 123 Cb 0.04 0.40 -0.04 0.00 -1.01 0.00 0.00 31.44 30.83 2yud n GLU 123 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 2yud s LEU 124 N 0.00 -1.07 0.27 -4.62 1.98 -1.04 -4.43 118.68 109.77 2yud s LEU 124 Ca 0.02 1.38 -0.29 0.00 -2.89 0.00 0.00 54.13 52.35 2yud s LEU 124 Cb 0.00 2.19 -0.10 0.00 0.66 0.00 0.00 46.19 48.94 2yud s LEU 124 CO 0.02 -0.20 1.26 -2.16 -1.89 0.00 0.00 176.35 173.37 2yud s PRO 125 N 2.83 4.44 0.65 0.98 0.04 -1.26 -0.05 135.00 142.62 2yud s PRO 125 Ca -0.03 2.06 0.35 0.00 0.04 0.00 0.00 61.00 63.41 2yud s PRO 125 Cb -0.11 -3.15 1.90 0.00 0.04 0.00 0.00 34.50 33.18 2yud s PRO 125 CO -0.19 -0.12 2.12 0.74 0.04 0.00 0.00 177.00 179.59 2yud h PHE 126 N 4.25 0.00 -0.14 0.56 0.04 -1.85 -0.47 116.94 119.32 2yud h PHE 126 Ca -0.47 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.34 2yud h PHE 126 Cb 1.22 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.36 2yud h PHE 126 CO 0.59 0.00 0.11 1.15 -0.60 0.00 0.00 178.31 179.55 2yud h THR 127 N 0.00 0.89 0.00 -1.55 2.02 -1.90 0.44 112.91 112.80 2yud h THR 127 Ca 0.03 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.08 2yud h THR 127 Cb 0.41 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2yud h THR 127 CO -0.00 0.00 -1.04 0.11 0.37 0.00 0.00 175.52 174.96 2yud h LYS 128 N 0.00 0.00 -0.00 6.66 1.79 -1.46 -3.29 116.57 120.27 2yud h LYS 128 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2yud h LYS 128 Cb 0.28 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2yud h LYS 128 CO -0.00 0.34 -0.54 -1.13 -1.08 0.00 0.00 179.45 177.04 2yud n SER 129 N -2.99 0.65 -3.90 0.86 3.41 -0.26 -4.64 113.62 106.75 2yud n SER 129 Ca -0.05 -0.45 -0.41 0.00 -0.26 0.00 0.00 58.87 57.71 2yud n SER 129 Cb 0.78 0.34 -0.04 0.00 -0.26 0.00 0.00 64.21 65.03 2yud n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2yud n ALA 130 N -1.37 3.71 0.00 7.33 0.00 0.14 -2.94 120.51 127.37 2yud n ALA 130 Ca 0.06 -3.48 0.00 0.00 0.00 0.00 0.00 53.44 50.02 2yud n ALA 130 Cb 0.34 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.20 2yud n ALA 130 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2yud n HIS 131 N 8.26 0.00 -1.04 0.00 1.44 -1.26 -5.03 115.22 117.59 2yud n HIS 131 Ca 0.49 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.88 2yud n HIS 131 Cb 0.42 0.00 0.13 0.00 0.12 0.00 0.00 29.99 30.66 2yud n HIS 131 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2yud s LEU 132 N -1.06 3.06 -0.14 2.39 1.43 -1.15 -5.04 118.68 118.18 2yud s LEU 132 Ca 0.00 2.26 -0.04 0.00 -1.03 0.00 0.00 54.13 55.32 2yud s LEU 132 Cb 0.00 -4.58 0.07 0.00 0.03 0.00 0.00 46.19 41.71 2yud s LEU 132 CO 0.00 -2.69 0.18 0.42 0.23 0.00 0.00 176.35 174.49 2yud s THR 133 N -2.36 -0.28 -0.52 5.49 -4.23 -1.26 -3.99 115.64 108.49 2yud s THR 133 Ca 0.70 0.15 -0.23 0.00 -1.18 0.00 0.00 61.69 61.13 2yud s THR 133 Cb -0.26 -0.46 0.04 0.00 1.34 0.00 0.00 72.50 73.16 2yud s THR 133 CO 0.52 -0.01 0.85 0.21 -0.54 0.00 0.00 174.62 175.66 2yud s ASN 134 N 2.30 6.34 0.00 3.99 3.84 0.88 -4.89 114.94 127.40 2yud s ASN 134 Ca 0.04 -0.37 0.14 0.00 0.21 0.00 0.00 52.86 52.88 2yud s ASN 134 Cb -0.14 -2.40 0.66 0.00 -0.55 0.00 0.00 41.25 38.83 2yud s ASN 134 CO -0.08 -1.09 1.43 -0.81 -2.79 0.00 0.00 177.10 173.76 2yud n PRO 135 N 7.06 0.09 -1.37 0.43 -0.04 -1.26 -3.07 135.00 136.83 2yud n PRO 135 Ca 0.01 0.21 -0.25 0.00 -0.04 0.00 0.00 63.50 63.43 2yud n PRO 135 Cb 0.47 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.35 2yud n PRO 135 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2yud n TRP 136 N -1.41 1.27 0.00 0.54 7.02 -1.26 -4.24 117.44 119.37 2yud n TRP 136 Ca 0.05 -2.03 0.00 0.00 -1.02 0.00 0.00 57.50 54.50 2yud n TRP 136 Cb 0.15 -1.63 0.00 0.00 -2.42 0.00 0.00 31.31 27.40 2yud n TRP 136 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2yud n ASN 137 N 1.83 -0.08 -1.24 -0.99 2.85 -1.25 -5.01 115.26 111.36 2yud n ASN 137 Ca 0.52 0.25 -0.01 0.00 -0.11 0.00 0.00 54.58 55.23 2yud n ASN 137 Cb 0.60 0.32 0.01 0.00 1.24 0.00 0.00 39.78 41.95 2yud n ASN 137 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 2yud n GLU 138 N -2.26 0.15 -1.51 1.20 0.28 -1.26 -4.95 120.64 112.30 2yud n GLU 138 Ca 0.00 -0.22 -0.17 0.00 -0.16 0.00 0.00 57.16 56.60 2yud n GLU 138 Cb 0.00 0.26 -0.07 0.00 1.43 0.00 0.00 31.44 33.06 2yud n GLU 138 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2yud n HIS 139 N -0.18 -0.01 -2.44 -1.84 8.25 -1.18 -4.97 115.22 112.86 2yud n HIS 139 Ca -0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.10 2yud n HIS 139 Cb 0.47 -2.98 -0.02 0.00 1.12 0.00 0.00 29.99 28.58 2yud n HIS 139 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2yud s LYS 140 N -3.48 3.82 0.84 -0.41 -2.85 -1.22 -4.62 119.74 111.83 2yud s LYS 140 Ca 0.00 0.75 -0.11 0.00 -1.00 0.00 0.00 55.97 55.61 2yud s LYS 140 Cb 0.00 -2.21 0.10 0.00 -2.06 0.00 0.00 37.83 33.66 2yud s LYS 140 CO 0.00 -0.26 1.09 -1.25 0.10 0.00 0.00 175.35 175.04 2yud s PRO 141 N -4.24 1.71 0.51 1.78 0.04 -1.26 -0.08 135.00 133.45 2yud s PRO 141 Ca 0.56 0.98 0.28 0.00 0.04 0.00 0.00 61.00 62.86 2yud s PRO 141 Cb -0.10 -1.85 1.34 0.00 0.04 0.00 0.00 34.50 33.93 2yud s PRO 141 CO 0.36 -1.97 2.00 -0.24 0.04 0.00 0.00 177.00 177.19 2yud h VAL 142 N -1.36 0.45 -0.06 -0.36 3.04 -1.86 -2.55 116.25 113.54 2yud h VAL 142 Ca -0.47 -0.68 0.02 0.00 -1.01 0.00 0.00 66.70 64.56 2yud h VAL 142 Cb 1.26 1.48 -0.00 0.00 -2.01 0.00 0.00 31.29 32.02 2yud h VAL 142 CO 0.53 0.13 0.12 0.07 -1.01 0.00 0.00 177.57 177.40 2yud h LYS 143 N 0.00 0.00 -5.51 4.17 2.10 -1.91 -3.40 116.57 112.02 2yud h LYS 143 Ca -0.00 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 58.00 2yud h LYS 143 Cb 0.47 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 31.71 2yud h LYS 143 CO 0.02 0.00 -0.49 0.42 -2.00 0.00 0.00 179.45 177.40 2yud s ILE 144 N -4.40 5.44 0.00 0.07 1.01 -0.96 -5.04 121.20 117.32 2yud s ILE 144 Ca -0.05 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.79 2yud s ILE 144 Cb 0.13 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 39.19 2yud s ILE 144 CO 0.46 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.56 2yud n GLY 145 N 2.55 2.45 0.00 6.18 0.00 -1.26 -4.90 105.19 110.21 2yud n GLY 145 Ca -0.19 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2yud n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yud n ARG 146 N -1.37 1.62 -2.92 1.61 5.12 -1.26 -5.05 116.66 114.41 2yud n ARG 146 Ca 0.00 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.50 2yud n ARG 146 Cb 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.25 2yud n ARG 146 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2yud s ASP 147 N -0.99 6.68 0.00 0.55 2.15 -1.26 -3.89 116.67 119.91 2yud s ASP 147 Ca 0.00 0.70 0.00 0.00 0.43 0.00 0.00 52.55 53.68 2yud s ASP 147 Cb 0.00 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 2yud s ASP 147 CO 0.00 -0.63 0.00 0.61 -0.17 0.00 0.00 175.17 174.98 2yud n GLY 148 N 4.16 1.24 3.59 2.66 0.00 0.63 -4.87 105.19 112.60 2yud n GLY 148 Ca 0.04 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2yud n GLY 148 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yud s GLN 149 N -1.24 3.71 0.54 1.61 -1.52 -1.15 -4.93 119.66 116.68 2yud s GLN 149 Ca 0.00 -0.42 -0.21 0.00 -1.95 0.00 0.00 55.36 52.79 2yud s GLN 149 Cb 0.00 -3.04 -0.05 0.00 -0.22 0.00 0.00 33.01 29.70 2yud s GLN 149 CO 0.00 0.33 1.20 -2.00 -0.25 0.00 0.00 175.29 174.57 2yud s GLU 150 N 0.16 3.31 0.04 2.91 2.12 -1.26 -1.98 118.70 124.00 2yud s GLU 150 Ca 0.02 1.82 0.04 0.00 0.36 0.00 0.00 54.97 57.21 2yud s GLU 150 Cb -0.13 -2.13 -0.02 0.00 0.26 0.00 0.00 34.13 32.11 2yud s GLU 150 CO 0.02 -0.93 -0.13 0.42 -0.54 0.00 0.00 175.26 174.10 2yud s ILE 151 N -1.57 1.00 0.87 -3.70 1.01 -0.61 -4.90 121.20 113.30 2yud s ILE 151 Ca 0.71 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 60.26 2yud s ILE 151 Cb -0.30 -0.92 0.22 0.00 0.01 0.00 0.00 42.46 41.48 2yud s ILE 151 CO 0.34 -0.03 0.50 1.21 0.00 0.00 0.00 174.94 176.96 2yud n GLU 152 N 1.92 -3.50 -0.08 2.79 2.13 -1.26 -4.13 120.64 118.51 2yud n GLU 152 Ca -0.18 -0.85 -0.13 0.00 0.66 0.00 0.00 57.16 56.66 2yud n GLU 152 Cb 0.55 -1.14 -0.09 0.00 0.27 0.00 0.00 31.44 31.03 2yud n GLU 152 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2yud h LEU 153 N 0.00 0.00 -0.51 4.31 5.85 -1.99 -3.28 115.31 119.70 2yud h LEU 153 Ca -0.23 -0.52 0.05 0.00 0.84 0.00 0.00 57.88 58.02 2yud h LEU 153 Cb 0.77 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 2yud h LEU 153 CO 0.14 1.07 0.24 -0.33 -0.34 0.00 0.00 178.44 179.22 2yud h GLU 154 N -1.00 0.46 0.04 1.25 5.08 -1.98 -0.47 114.58 117.95 2yud h GLU 154 Ca -0.13 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2yud h GLU 154 Cb 0.89 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2yud h GLU 154 CO -0.08 0.30 -0.09 0.00 -1.00 0.00 0.00 179.01 178.14 2yud h GLY 156 N -0.14 0.74 0.04 0.00 0.00 -1.60 -1.17 103.07 100.95 2yud h GLY 156 Ca -0.00 -0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.31 2yud h GLY 156 CO -0.04 -0.11 -0.24 -0.84 0.00 0.00 0.00 176.54 175.31 2yud h THR 157 N 0.24 0.00 -0.53 4.70 2.02 -0.85 -0.17 112.91 118.32 2yud h THR 157 Ca 0.31 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.59 2yud h THR 157 Cb 0.46 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.77 2yud h THR 157 CO -0.40 0.00 -0.08 1.56 0.37 0.00 0.00 175.52 176.97 2yud h GLN 158 N -0.33 0.04 -0.97 6.66 1.08 -0.85 0.11 115.11 120.85 2yud h GLN 158 Ca -0.00 -0.00 0.19 0.00 -1.45 0.00 0.00 58.65 57.39 2yud h GLN 158 Cb 0.34 -0.01 -0.09 0.00 -0.05 0.00 0.00 27.48 27.67 2yud h GLN 158 CO -0.14 0.03 0.61 1.25 -0.95 0.00 0.00 178.83 179.63 2yud h LEU 159 N 0.04 0.65 -0.08 1.46 7.12 -0.82 -0.37 115.31 123.33 2yud h LEU 159 Ca 0.26 0.07 -0.03 0.00 0.13 0.00 0.00 57.88 58.31 2yud h LEU 159 Cb 0.41 -0.05 -0.00 0.00 -0.53 0.00 0.00 40.66 40.49 2yud h LEU 159 CO -0.51 0.25 -0.07 0.00 -0.13 0.00 0.00 178.44 177.98 2yud h LEU 161 N -0.24 0.45 -0.81 0.00 3.38 -0.14 -1.76 115.31 116.19 2yud h LEU 161 Ca 0.01 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.10 2yud h LEU 161 Cb 0.57 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.14 2yud h LEU 161 CO 0.02 0.29 0.42 -0.07 0.09 0.00 0.00 178.44 179.19 2yud h LEU 162 N 0.51 0.54 -9.66 1.67 3.38 -1.04 -3.43 115.31 107.28 2yud h LEU 162 Ca 0.25 0.07 -0.57 0.00 0.09 0.00 0.00 57.88 57.72 2yud h LEU 162 Cb 0.32 -0.02 0.18 0.00 0.09 0.00 0.00 40.66 41.22 2yud h LEU 162 CO -0.07 0.27 -0.27 0.49 0.09 0.00 0.00 178.44 178.95 2yud n PHE 163 N -4.84 -0.39 -1.16 1.13 3.01 -0.66 -4.97 117.46 109.58 2yud n PHE 163 Ca 0.15 0.39 -0.29 0.00 1.01 0.00 0.00 57.45 58.71 2yud n PHE 163 Cb 0.35 -1.97 0.18 0.00 -0.01 0.00 0.00 39.48 38.03 2yud n PHE 163 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2yud s PRO 164 N -2.61 0.34 0.36 -1.08 0.04 -1.26 -5.00 135.00 125.79 2yud s PRO 164 Ca 0.69 0.49 -0.27 0.00 0.04 0.00 0.00 61.00 61.95 2yud s PRO 164 Cb -0.39 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 2yud s PRO 164 CO 0.54 -2.78 1.21 -1.25 0.04 0.00 0.00 177.00 174.75 2yud s PRO 165 N -4.96 4.24 -0.17 0.56 0.04 -1.26 -5.00 135.00 128.44 2yud s PRO 165 Ca 0.65 1.96 -0.04 0.00 0.04 0.00 0.00 61.00 63.62 2yud s PRO 165 Cb -0.19 -2.89 -0.02 0.00 0.04 0.00 0.00 34.50 31.45 2yud s PRO 165 CO 0.58 -0.20 -0.04 0.16 0.04 0.00 0.00 177.00 177.54 2yud s ASP 166 N -0.88 4.66 -0.10 6.66 -4.77 -1.26 -4.98 116.67 116.00 2yud s ASP 166 Ca 0.52 -0.20 0.15 0.00 -3.30 0.00 0.00 52.55 49.72 2yud s ASP 166 Cb -0.34 -1.77 0.32 0.00 -1.09 0.00 0.00 42.92 40.04 2yud s ASP 166 CO 0.44 0.12 1.15 -0.62 0.70 0.00 0.00 175.17 176.96 2yud n GLU 167 N 3.83 0.84 -0.30 2.11 1.02 -1.26 -4.69 120.64 122.18 2yud n GLU 167 Ca -0.17 -2.40 0.02 0.00 -0.02 0.00 0.00 57.16 54.58 2yud n GLU 167 Cb 0.52 -0.99 0.02 0.00 -0.02 0.00 0.00 31.44 30.97 2yud n GLU 167 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2yud n SER 168 N -0.60 0.51 -3.79 1.62 2.88 -1.26 -5.06 113.62 107.92 2yud n SER 168 Ca 0.12 -1.99 -0.13 0.00 -1.33 0.00 0.00 58.87 55.54 2yud n SER 168 Cb 0.79 -0.19 -0.12 0.00 -0.75 0.00 0.00 64.21 63.94 2yud n SER 168 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2yud s ILE 169 N -0.54 -0.01 -0.56 2.46 1.01 -1.26 -5.06 121.20 117.24 2yud s ILE 169 Ca 0.05 0.04 -0.28 0.00 0.00 0.00 0.00 60.65 60.46 2yud s ILE 169 Cb 0.05 -0.29 0.02 0.00 0.01 0.00 0.00 42.46 42.25 2yud s ILE 169 CO 0.01 0.02 1.34 -1.81 0.00 0.00 0.00 174.94 174.49 2yud s ASP 170 N 0.36 6.25 -0.02 3.58 1.01 -1.26 -4.85 116.67 121.75 2yud s ASP 170 Ca -0.02 0.25 -0.09 0.00 0.71 0.00 0.00 52.55 53.40 2yud s ASP 170 Cb -0.04 -2.55 -0.30 0.00 1.01 0.00 0.00 42.92 41.04 2yud s ASP 170 CO -0.02 -1.62 0.79 0.25 0.21 0.00 0.00 175.17 174.79 2yud h LEU 171 N 12.63 0.57 -0.76 1.23 6.46 -1.96 -3.35 115.31 130.14 2yud h LEU 171 Ca -0.26 -0.79 0.00 0.00 -0.12 0.00 0.00 57.88 56.71 2yud h LEU 171 Cb 1.08 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.79 2yud h LEU 171 CO 1.18 1.65 0.48 0.22 -0.62 0.00 0.00 178.44 181.35 2yud h TYR 172 N 0.10 0.98 -0.63 1.25 3.20 -1.97 -1.85 116.97 118.06 2yud h TYR 172 Ca -0.29 0.01 0.15 0.00 3.14 0.00 0.00 58.73 61.74 2yud h TYR 172 Cb 2.08 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 39.99 2yud h TYR 172 CO 0.09 0.64 0.43 1.96 -1.64 0.00 0.00 178.16 179.64 2yud h GLN 173 N 1.04 0.19 0.00 1.82 4.20 -1.98 0.28 115.11 120.66 2yud h GLN 173 Ca 0.28 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.93 2yud h GLN 173 Cb -0.08 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2yud h GLN 173 CO -0.06 0.13 -0.23 0.28 -0.67 0.00 0.00 178.83 178.28 2yud h VAL 174 N 0.20 0.82 0.06 -0.54 2.07 -1.46 -2.37 116.25 115.03 2yud h VAL 174 Ca 0.30 -0.92 -0.32 0.00 0.82 0.00 0.00 66.70 66.58 2yud h VAL 174 Cb 0.91 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 2yud h VAL 174 CO -0.05 0.23 -1.81 0.40 0.02 0.00 0.00 177.57 176.36 2yud h ILE 175 N 0.00 0.78 -0.51 4.57 2.04 -0.54 -3.36 117.51 120.50 2yud h ILE 175 Ca -0.00 -2.57 -0.05 0.00 1.00 0.00 0.00 64.86 63.24 2yud h ILE 175 Cb 0.53 2.49 -0.02 0.00 -0.74 0.00 0.00 36.82 39.08 2yud h ILE 175 CO 0.03 0.69 0.11 -0.74 0.00 0.00 0.00 178.15 178.24 2yud h HIS 176 N 0.04 0.81 0.00 1.37 2.76 -0.97 -0.97 115.15 118.18 2yud h HIS 176 Ca -0.34 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 57.74 2yud h HIS 176 Cb 2.02 -0.24 -0.00 0.00 1.55 0.00 0.00 27.41 30.74 2yud h HIS 176 CO 0.04 0.69 -0.11 1.57 -1.30 0.00 0.00 177.93 178.82 2yud h LYS 177 N 0.75 0.00 0.00 5.26 2.10 -1.58 0.13 116.57 123.23 2yud h LYS 177 Ca 0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.82 2yud h LYS 177 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2yud h LYS 177 CO 0.00 0.11 -0.16 0.52 -2.00 0.00 0.00 179.45 177.92 2yud h MET 178 N 0.00 0.00 -0.77 0.07 2.86 -1.50 -3.38 114.93 112.21 2yud h MET 178 Ca -0.00 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.81 2yud h MET 178 Cb 0.27 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.88 2yud h MET 178 CO 0.01 0.00 0.52 0.07 1.06 0.00 0.00 176.91 178.57 2yud h ARG 179 N -0.39 0.32 -0.01 1.72 0.11 -1.27 -3.52 114.38 111.33 2yud h ARG 179 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2yud h ARG 179 Cb 0.16 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.17 2yud h ARG 179 CO 0.00 0.21 0.00 1.58 0.10 0.00 0.00 179.97 181.86