#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuj n SER 2 N 0.00 -0.01 -2.58 1.61 2.88 -1.26 -5.14 113.62 109.13 2yuj n SER 2 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 2yuj n SER 2 Cb 0.00 0.08 -0.04 0.00 -0.75 0.00 0.00 64.21 63.50 2yuj n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yuj n SER 3 N -2.51 -1.56 0.00 -3.46 7.64 -1.26 -5.07 113.62 107.40 2yuj n SER 3 Ca 0.00 1.42 0.00 0.00 1.01 0.00 0.00 58.87 61.30 2yuj n SER 3 Cb 0.00 -5.20 0.00 0.00 -1.01 0.00 0.00 64.21 58.00 2yuj n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuj n GLY 4 N 1.77 3.78 0.06 0.23 0.00 -1.26 -5.04 105.19 104.73 2yuj n GLY 4 Ca -0.37 -0.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.26 2yuj n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2yuj h SER 5 N 0.00 -0.02 -4.34 1.61 4.64 -2.07 -3.50 113.55 109.88 2yuj h SER 5 Ca 0.00 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2yuj h SER 5 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2yuj h SER 5 CO 0.00 0.55 -0.89 -1.20 -0.87 0.00 0.00 176.83 174.43 2yuj n SER 6 N -4.83 -8.47 0.00 4.97 7.64 -1.26 -5.09 113.62 106.58 2yuj n SER 6 Ca -0.09 1.30 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2yuj n SER 6 Cb 0.29 -4.77 0.00 0.00 -1.01 0.00 0.00 64.21 58.71 2yuj n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuj n GLY 7 N 1.76 -0.36 3.73 0.23 0.00 -1.26 -5.15 105.19 104.14 2yuj n GLY 7 Ca 0.00 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 2yuj n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2yuj s ILE 8 N -2.00 2.61 -1.00 -0.61 -4.36 -1.26 -4.86 121.20 109.73 2yuj s ILE 8 Ca 0.00 0.27 -0.07 0.00 -0.26 0.00 0.00 60.65 60.60 2yuj s ILE 8 Cb 0.00 -2.75 -0.08 0.00 1.25 0.00 0.00 42.46 40.88 2yuj s ILE 8 CO 0.00 -0.19 2.44 -0.81 0.24 0.00 0.00 174.94 176.62 2yuj n PRO 9 N -2.91 2.46 0.00 0.37 -0.04 -1.26 -4.92 135.00 128.70 2yuj n PRO 9 Ca 0.12 -1.57 0.00 0.00 -0.04 0.00 0.00 63.50 62.01 2yuj n PRO 9 Cb 0.51 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 2yuj n PRO 9 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2yuj n ARG 10 N 3.82 0.00 -4.43 0.54 1.74 -1.26 -4.94 116.66 112.13 2yuj n ARG 10 Ca 0.52 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 57.38 2yuj n ARG 10 Cb 0.23 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.58 2yuj n ARG 10 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2yuj s VAL 11 N 0.00 0.49 -0.49 1.55 -7.23 -1.26 -5.06 120.40 108.40 2yuj s VAL 11 Ca 0.00 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.20 2yuj s VAL 11 Cb 0.00 -2.45 0.50 0.00 0.56 0.00 0.00 36.38 35.00 2yuj s VAL 11 CO 0.00 0.00 1.75 0.49 -0.31 0.00 0.00 175.10 177.03 2yuj n PHE 12 N -0.76 2.75 -3.71 2.82 3.01 -1.26 -4.90 117.46 115.41 2yuj n PHE 12 Ca -0.02 -2.42 -0.38 0.00 1.01 0.00 0.00 57.45 55.65 2yuj n PHE 12 Cb 0.65 -0.98 -0.11 0.00 -0.01 0.00 0.00 39.48 39.03 2yuj n PHE 12 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 2yuj s GLN 13 N -3.59 2.29 0.00 -1.08 0.74 -1.26 -5.04 119.66 111.71 2yuj s GLN 13 Ca 0.57 -1.66 0.00 0.00 0.05 0.00 0.00 55.36 54.33 2yuj s GLN 13 Cb 0.47 -3.65 0.00 0.00 1.10 0.00 0.00 33.01 30.93 2yuj s GLN 13 CO 0.02 -1.01 0.00 -1.71 -0.55 0.00 0.00 175.29 172.04 2yuj n ASN 14 N 4.73 0.00 -1.40 6.67 2.85 -1.26 -5.10 115.26 121.75 2yuj n ASN 14 Ca -0.06 -0.97 0.18 0.00 -0.11 0.00 0.00 54.58 53.62 2yuj n ASN 14 Cb 0.42 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.36 2yuj n ASN 14 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2yuj n ARG 15 N 0.00 -3.10 -3.90 1.20 1.74 -1.26 -4.83 116.66 106.51 2yuj n ARG 15 Ca 0.00 2.40 -0.35 0.00 -0.77 0.00 0.00 57.85 59.13 2yuj n ARG 15 Cb 0.00 -3.68 -0.10 0.00 -1.02 0.00 0.00 32.46 27.67 2yuj n ARG 15 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2yuj s PHE 16 N -3.57 3.27 -0.30 -1.55 5.36 -1.26 -5.00 117.98 114.93 2yuj s PHE 16 Ca 0.00 0.09 -0.04 0.00 -0.96 0.00 0.00 56.93 56.02 2yuj s PHE 16 Cb 0.00 -2.13 0.17 0.00 -0.34 0.00 0.00 43.02 40.72 2yuj s PHE 16 CO 0.00 0.12 0.61 -1.54 -1.46 0.00 0.00 175.22 172.95 2yuj s SER 17 N 0.57 -1.32 -0.23 6.13 1.04 -1.22 -3.49 113.70 115.18 2yuj s SER 17 Ca 0.05 1.07 -0.36 0.00 0.48 0.00 0.00 55.95 57.19 2yuj s SER 17 Cb -0.13 2.21 0.15 0.00 0.10 0.00 0.00 66.02 68.35 2yuj s SER 17 CO 0.01 -0.25 1.28 0.28 0.98 0.00 0.00 173.24 175.54 2yuj s THR 18 N 2.87 0.00 -0.25 2.02 -1.32 -1.21 -5.00 115.64 112.75 2yuj s THR 18 Ca 0.13 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.47 2yuj s THR 18 Cb -0.14 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.81 2yuj s THR 18 CO -0.20 0.00 0.35 -1.10 -2.21 0.00 0.00 174.62 171.46 2yuj s GLN 19 N -2.21 4.06 0.07 7.08 -0.21 -1.26 -1.95 119.66 125.25 2yuj s GLN 19 Ca 0.10 0.04 0.08 0.00 0.02 0.00 0.00 55.36 55.59 2yuj s GLN 19 Cb -0.01 -3.61 -0.04 0.00 1.00 0.00 0.00 33.01 30.35 2yuj s GLN 19 CO -0.04 -0.18 -0.16 0.71 -2.12 0.00 0.00 175.29 173.50 2yuj s TYR 20 N 1.76 2.59 0.04 0.91 2.02 -1.07 -4.81 117.35 118.80 2yuj s TYR 20 Ca 0.15 -0.23 -0.30 0.00 -0.37 0.00 0.00 57.07 56.31 2yuj s TYR 20 Cb -0.15 -1.43 -0.05 0.00 -0.40 0.00 0.00 41.96 39.93 2yuj s TYR 20 CO 0.09 0.33 1.17 1.03 -1.57 0.00 0.00 175.55 176.59 2yuj s ARG 21 N -1.78 4.44 -0.16 -0.62 0.52 -1.26 -2.04 118.95 118.05 2yuj s ARG 21 Ca 0.17 1.71 -0.10 0.00 -0.52 0.00 0.00 55.73 56.99 2yuj s ARG 21 Cb -0.11 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 31.93 2yuj s ARG 21 CO 0.08 -0.24 0.17 0.00 0.02 0.00 0.00 175.30 175.33 2yuj s PHE 23 N -0.08 1.74 -0.01 0.00 0.08 -0.18 -3.06 117.98 116.46 2yuj s PHE 23 Ca 0.12 -1.52 -0.02 0.00 0.12 0.00 0.00 56.93 55.63 2yuj s PHE 23 Cb -0.12 -0.87 -0.04 0.00 -0.57 0.00 0.00 43.02 41.42 2yuj s PHE 23 CO 0.01 -0.65 0.17 0.45 -0.10 0.00 0.00 175.22 175.10 2yuj s SER 24 N -3.45 6.27 0.58 1.36 0.15 -1.26 -1.36 113.70 115.99 2yuj s SER 24 Ca 0.34 0.32 0.27 0.00 0.70 0.00 0.00 55.95 57.58 2yuj s SER 24 Cb 0.03 -1.95 1.67 0.00 -1.71 0.00 0.00 66.02 64.06 2yuj s SER 24 CO 0.22 0.26 2.17 -0.37 1.20 0.00 0.00 173.24 176.72 2yuj h VAL 25 N 2.87 0.57 -0.33 4.45 -1.51 -1.89 -1.18 116.25 119.22 2yuj h VAL 25 Ca -0.49 0.00 0.09 0.00 -1.23 0.00 0.00 66.70 65.08 2yuj h VAL 25 Cb 1.19 0.92 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 2yuj h VAL 25 CO 0.68 0.00 0.24 -1.28 -1.23 0.00 0.00 177.57 175.98 2yuj h SER 26 N 0.00 0.01 0.53 4.19 0.87 -1.77 0.34 113.55 117.71 2yuj h SER 26 Ca 0.05 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 2yuj h SER 26 Cb 0.25 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2yuj h SER 26 CO -0.00 0.00 -0.57 0.24 -0.53 0.00 0.00 176.83 175.97 2yuj h MET 27 N 0.01 0.04 -5.35 2.24 2.07 -1.40 -3.08 114.93 109.45 2yuj h MET 27 Ca 0.16 -0.03 -0.07 0.00 -2.07 0.00 0.00 59.70 57.69 2yuj h MET 27 Cb 0.62 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.35 2yuj h MET 27 CO -0.00 0.60 0.28 -0.11 1.07 0.00 0.00 176.91 178.75 2yuj n LEU 28 N -3.87 1.70 0.00 1.22 7.94 0.11 -4.37 117.00 119.73 2yuj n LEU 28 Ca -0.01 -1.34 0.00 0.00 -1.11 0.00 0.00 56.01 53.54 2yuj n LEU 28 Cb 0.58 -1.60 0.00 0.00 0.53 0.00 0.00 43.42 42.93 2yuj n LEU 28 CO 0.42 -2.47 0.00 0.00 -1.11 0.00 0.00 177.39 174.23 2yuj n ALA 29 N 17.84 0.00 -2.57 1.96 0.00 -1.26 -4.68 120.51 131.80 2yuj n ALA 29 Ca 0.47 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.65 2yuj n ALA 29 Cb 0.43 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 2yuj n ALA 29 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2yuj s GLY 30 N 0.00 2.51 0.18 0.00 0.00 -1.26 -5.06 107.32 103.69 2yuj s GLY 30 Ca 0.00 -1.56 -0.06 0.00 0.00 0.00 0.00 44.72 43.11 2yuj s GLY 30 CO 0.00 -1.97 1.52 -0.56 0.00 0.00 0.00 173.10 172.09 2yuj h PRO 31 N 1.79 0.71 -5.28 2.90 0.13 -1.81 -3.39 132.00 127.05 2yuj h PRO 31 Ca -0.41 -0.40 -0.63 0.00 -0.87 0.00 0.00 66.00 63.69 2yuj h PRO 31 Cb 1.27 0.02 -0.20 0.00 0.13 0.00 0.00 31.00 32.21 2yuj h PRO 31 CO 0.70 1.01 -0.64 -0.80 -0.23 0.00 0.00 178.00 178.04 2yuj s ASN 32 N -6.88 4.97 0.07 1.44 0.01 -1.26 -4.39 114.94 108.90 2yuj s ASN 32 Ca -0.09 -0.09 0.00 0.00 -0.71 0.00 0.00 52.86 51.97 2yuj s ASN 32 Cb 0.11 -1.82 0.00 0.00 0.41 0.00 0.00 41.25 39.95 2yuj s ASN 32 CO 0.85 0.16 0.00 -0.67 -1.51 0.00 0.00 177.10 175.94 2yuj n ASP 33 N 3.57 -0.53 -4.66 -1.22 2.03 -1.26 -5.11 116.55 109.37 2yuj n ASP 33 Ca -0.17 0.13 -0.26 0.00 0.52 0.00 0.00 54.79 55.00 2yuj n ASP 33 Cb 0.52 0.83 -0.08 0.00 -0.72 0.00 0.00 41.12 41.68 2yuj n ASP 33 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2yuj s ARG 34 N -1.15 2.37 -0.11 -0.67 1.81 -1.26 -5.04 118.95 114.91 2yuj s ARG 34 Ca 0.00 -1.14 0.17 0.00 -1.72 0.00 0.00 55.73 53.04 2yuj s ARG 34 Cb 0.00 -2.33 0.40 0.00 -0.45 0.00 0.00 34.95 32.57 2yuj s ARG 34 CO 0.00 0.45 1.18 0.45 -0.68 0.00 0.00 175.30 176.70 2yuj n SER 35 N -0.16 1.36 -0.02 0.23 2.88 -1.26 -4.76 113.62 111.89 2yuj n SER 35 Ca -0.10 -2.95 -0.02 0.00 -1.33 0.00 0.00 58.87 54.47 2yuj n SER 35 Cb 0.55 -0.41 -0.02 0.00 -0.75 0.00 0.00 64.21 63.59 2yuj n SER 35 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2yuj n ASP 36 N -0.39 3.90 -0.36 -3.46 2.03 -1.26 -4.35 116.55 112.65 2yuj n ASP 36 Ca 0.12 -0.01 0.03 0.00 0.52 0.00 0.00 54.79 55.45 2yuj n ASP 36 Cb 0.88 0.11 0.18 0.00 -0.72 0.00 0.00 41.12 41.58 2yuj n ASP 36 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2yuj h VAL 37 N 0.00 1.05 0.01 5.18 -1.51 -1.85 0.86 116.25 120.00 2yuj h VAL 37 Ca -0.07 -0.39 -0.20 0.00 -1.23 0.00 0.00 66.70 64.81 2yuj h VAL 37 Cb 1.13 -0.17 -0.02 0.00 -2.13 0.00 0.00 31.29 30.10 2yuj h VAL 37 CO -0.01 0.21 -0.94 -0.33 -1.23 0.00 0.00 177.57 175.27 2yuj h GLU 38 N 1.13 0.07 0.02 5.19 5.08 -1.89 -3.26 114.58 120.92 2yuj h GLU 38 Ca 0.44 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.50 2yuj h GLU 38 Cb 0.23 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2yuj h GLU 38 CO -0.19 0.95 -0.98 0.87 -1.00 0.00 0.00 179.01 178.67 2yuj h LYS 39 N 0.03 0.07 0.00 2.33 1.57 -1.51 -3.46 116.57 115.60 2yuj h LYS 39 Ca -0.03 -0.11 -0.52 0.00 -1.87 0.00 0.00 60.65 58.12 2yuj h LYS 39 Cb 1.63 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.93 2yuj h LYS 39 CO 0.13 0.99 -0.28 0.41 -0.57 0.00 0.00 179.45 180.13 2yuj n GLY 40 N 1.18 2.93 2.76 3.86 0.00 0.29 -4.81 105.19 111.41 2yuj n GLY 40 Ca -0.02 -2.30 -0.36 0.00 0.00 0.00 0.00 46.02 43.34 2yuj n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuj n GLY 41 N -0.77 5.78 3.66 -0.02 0.00 -1.23 -4.75 105.19 107.86 2yuj n GLY 41 Ca -0.05 -2.60 -0.24 0.00 0.00 0.00 0.00 46.02 43.13 2yuj n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuj s LYS 42 N -3.95 2.17 0.33 1.61 -0.14 -1.26 -3.46 119.74 115.04 2yuj s LYS 42 Ca 0.48 -1.69 0.03 0.00 -1.36 0.00 0.00 55.97 53.43 2yuj s LYS 42 Cb 0.36 -2.00 -0.04 0.00 -1.68 0.00 0.00 37.83 34.47 2yuj s LYS 42 CO -0.27 0.12 0.14 0.96 -0.76 0.00 0.00 175.35 175.53 2yuj s ILE 43 N -2.49 0.52 -0.35 2.17 -4.36 -1.04 -4.36 121.20 111.28 2yuj s ILE 43 Ca 0.36 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.77 2yuj s ILE 43 Cb -0.01 -2.52 0.11 0.00 1.25 0.00 0.00 42.46 41.29 2yuj s ILE 43 CO 0.20 0.00 0.10 -0.63 0.24 0.00 0.00 174.94 174.85 2yuj s ILE 44 N -3.48 1.68 0.19 8.37 1.01 -1.00 -1.87 121.20 126.10 2yuj s ILE 44 Ca 0.33 -2.07 0.01 0.00 0.00 0.00 0.00 60.65 58.93 2yuj s ILE 44 Cb 0.05 -2.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 2yuj s ILE 44 CO 0.16 -0.67 0.34 -0.04 0.00 0.00 0.00 174.94 174.74 2yuj s MET 45 N 1.05 3.47 0.78 2.79 -1.94 -0.95 -2.00 119.30 122.50 2yuj s MET 45 Ca 0.12 -0.50 -0.14 0.00 -1.71 0.00 0.00 55.69 53.45 2yuj s MET 45 Cb -0.19 -2.90 0.05 0.00 2.01 0.00 0.00 34.83 33.80 2yuj s MET 45 CO -0.13 0.45 1.12 -0.35 -0.01 0.00 0.00 175.02 176.09 2yuj n PRO 46 N -0.73 0.32 -0.00 2.03 -0.04 -1.26 -3.52 135.00 131.80 2yuj n PRO 46 Ca -0.06 0.18 0.23 0.00 -0.04 0.00 0.00 63.50 63.81 2yuj n PRO 46 Cb 0.54 -2.37 0.70 0.00 -0.04 0.00 0.00 33.50 32.34 2yuj n PRO 46 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2yuj h PRO 47 N -0.65 0.00 -0.23 0.54 0.11 -1.68 0.12 132.00 130.21 2yuj h PRO 47 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.68 2yuj h PRO 47 Cb 1.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 2yuj h PRO 47 CO 0.46 0.00 0.16 0.66 -0.21 0.00 0.00 178.00 179.07 2yuj h SER 48 N 0.00 0.13 0.38 -2.05 4.64 -1.91 -0.73 113.55 114.02 2yuj h SER 48 Ca 0.28 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 2yuj h SER 48 Cb 1.46 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.50 2yuj h SER 48 CO -0.00 0.09 -0.40 0.00 -0.87 0.00 0.00 176.83 175.65 2yuj h ALA 49 N 1.88 1.31 -0.00 5.18 0.00 -1.08 0.15 119.26 126.69 2yuj h ALA 49 Ca 0.10 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.48 2yuj h ALA 49 Cb 0.20 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2yuj h ALA 49 CO -0.02 0.51 -0.74 1.25 0.00 0.00 0.00 179.25 180.26 2yuj h LEU 50 N 0.02 0.01 0.07 0.00 5.85 -1.26 -1.04 115.31 118.97 2yuj h LEU 50 Ca -0.00 -0.01 -0.30 0.00 0.84 0.00 0.00 57.88 58.41 2yuj h LEU 50 Cb 0.72 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 2yuj h LEU 50 CO 0.05 0.74 -1.63 -0.78 -0.34 0.00 0.00 178.44 176.48 2yuj h ASP 51 N 0.01 0.22 0.02 1.25 3.58 -1.24 -3.32 116.42 116.93 2yuj h ASP 51 Ca -0.01 -0.37 -0.24 0.00 0.42 0.00 0.00 57.03 56.83 2yuj h ASP 51 Cb 1.30 -0.07 0.01 0.00 1.72 0.00 0.00 39.33 42.30 2yuj h ASP 51 CO 0.10 1.32 -0.90 -0.61 -2.88 0.00 0.00 179.24 176.27 2yuj h GLN 52 N 0.04 0.67 -0.35 0.28 4.15 -0.74 -1.81 115.11 117.35 2yuj h GLN 52 Ca -0.27 -0.63 0.03 0.00 0.77 0.00 0.00 58.65 58.54 2yuj h GLN 52 Cb 2.00 0.16 -0.02 0.00 0.21 0.00 0.00 27.48 29.83 2yuj h GLN 52 CO 0.11 1.24 0.24 -0.07 -1.93 0.00 0.00 178.83 178.42 2yuj h LEU 53 N 0.42 0.32 0.00 -2.39 3.38 -1.33 -0.89 115.31 114.81 2yuj h LEU 53 Ca -0.08 -0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.61 2yuj h LEU 53 Cb 1.53 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 42.17 2yuj h LEU 53 CO 0.18 0.22 -1.49 0.28 0.09 0.00 0.00 178.44 177.72 2yuj h SER 54 N 0.37 0.00 0.97 -0.43 0.02 -1.64 -2.50 113.55 110.34 2yuj h SER 54 Ca 0.14 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2yuj h SER 54 Cb 0.11 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 2yuj h SER 54 CO -0.03 1.00 -0.15 0.03 -1.14 0.00 0.00 176.83 176.55 2yuj h ARG 55 N 0.00 0.00 -0.69 3.45 3.08 -0.54 -2.70 114.38 116.98 2yuj h ARG 55 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.85 2yuj h ARG 55 Cb 1.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.99 2yuj h ARG 55 CO 0.10 0.15 0.00 1.28 -1.07 0.00 0.00 179.97 180.42 2yuj n LEU 56 N -3.30 4.21 -2.49 3.04 4.77 -0.41 -4.89 117.00 117.93 2yuj n LEU 56 Ca 0.00 -2.13 -0.16 0.00 -0.03 0.00 0.00 56.01 53.68 2yuj n LEU 56 Cb 0.39 -0.61 -0.01 0.00 -2.33 0.00 0.00 43.42 40.86 2yuj n LEU 56 CO 0.31 0.53 -0.19 -3.20 -1.33 0.00 0.00 177.39 173.52 2yuj n ASN 57 N 0.49 -4.78 -4.60 -1.43 2.85 -1.02 -4.49 115.26 102.28 2yuj n ASN 57 Ca 0.19 0.07 -0.38 0.00 -0.11 0.00 0.00 54.58 54.35 2yuj n ASN 57 Cb 0.88 -4.00 -0.10 0.00 1.24 0.00 0.00 39.78 37.79 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2yuj s ILE 58 N -2.82 5.29 0.39 -1.44 1.01 -0.94 -5.06 121.20 117.63 2yuj s ILE 58 Ca 0.03 0.26 0.08 0.00 0.00 0.00 0.00 60.65 61.02 2yuj s ILE 58 Cb -0.01 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.86 2yuj s ILE 58 CO 0.04 0.25 0.27 0.28 0.00 0.00 0.00 174.94 175.77 2yuj s THR 59 N 1.71 2.75 0.50 2.92 -1.32 -1.26 -4.37 115.64 116.58 2yuj s THR 59 Ca 0.09 -1.51 -0.23 0.00 -1.21 0.00 0.00 61.69 58.82 2yuj s THR 59 Cb -0.16 -3.02 -0.06 0.00 -1.51 0.00 0.00 72.50 67.75 2yuj s THR 59 CO 0.10 -0.06 1.40 -0.47 -2.21 0.00 0.00 174.62 173.38 2yuj s TYR 60 N -2.48 2.34 0.63 9.09 5.04 -1.26 -4.30 117.35 126.42 2yuj s TYR 60 Ca 0.43 1.31 -0.13 0.00 -2.44 0.00 0.00 57.07 56.24 2yuj s TYR 60 Cb -0.02 -3.89 -0.02 0.00 0.35 0.00 0.00 41.96 38.38 2yuj s TYR 60 CO 0.25 -3.00 1.04 -1.25 -1.34 0.00 0.00 175.55 171.25 2yuj s PRO 61 N -2.69 3.32 -0.62 4.97 0.04 -1.26 -5.14 135.00 133.63 2yuj s PRO 61 Ca 0.67 0.95 0.06 0.00 0.04 0.00 0.00 61.00 62.71 2yuj s PRO 61 Cb -0.43 -2.04 0.22 0.00 0.04 0.00 0.00 34.50 32.29 2yuj s PRO 61 CO 0.53 -0.79 0.62 -1.33 0.04 0.00 0.00 177.00 176.07 2yuj n MET 62 N -2.61 1.97 -3.33 4.56 2.81 -1.26 -4.94 117.12 114.31 2yuj n MET 62 Ca 0.07 -4.35 -0.38 0.00 -1.81 0.00 0.00 57.70 51.23 2yuj n MET 62 Cb 0.54 -2.10 -0.06 0.00 -0.71 0.00 0.00 33.22 30.88 2yuj n MET 62 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2yuj s LEU 63 N -1.88 4.39 -0.08 4.03 1.43 -1.26 -3.99 118.68 121.31 2yuj s LEU 63 Ca 0.35 0.98 -0.04 0.00 -1.03 0.00 0.00 54.13 54.39 2yuj s LEU 63 Cb 0.09 -2.74 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 2yuj s LEU 63 CO -0.08 0.14 0.09 -0.36 0.23 0.00 0.00 176.35 176.37 2yuj s PHE 64 N -0.21 3.41 -0.66 0.29 0.08 0.30 -2.57 117.98 118.62 2yuj s PHE 64 Ca 0.27 0.36 -0.18 0.00 0.12 0.00 0.00 56.93 57.50 2yuj s PHE 64 Cb -0.17 -1.85 0.12 0.00 -0.57 0.00 0.00 43.02 40.55 2yuj s PHE 64 CO 0.14 0.62 0.76 0.21 -0.10 0.00 0.00 175.22 176.84 2yuj s LYS 65 N -1.16 3.18 -1.26 0.44 2.20 0.51 -1.70 119.74 121.95 2yuj s LYS 65 Ca 0.17 -1.53 -0.18 0.00 -0.36 0.00 0.00 55.97 54.06 2yuj s LYS 65 Cb -0.12 -4.36 0.01 0.00 -1.51 0.00 0.00 37.83 31.85 2yuj s LYS 65 CO 0.06 -1.53 1.90 1.28 -0.36 0.00 0.00 175.35 176.70 2yuj n LEU 66 N 6.03 4.90 -4.52 5.43 4.77 -1.24 -3.90 117.00 128.47 2yuj n LEU 66 Ca -0.03 -3.72 -0.42 0.00 -0.03 0.00 0.00 56.01 51.82 2yuj n LEU 66 Cb 0.44 -1.67 -0.03 0.00 -2.33 0.00 0.00 43.42 39.83 2yuj n LEU 66 CO 0.54 -0.09 1.14 -0.89 -1.33 0.00 0.00 177.39 176.76 2yuj s THR 67 N 5.46 4.06 0.04 -5.08 2.01 -1.22 -3.51 115.64 117.41 2yuj s THR 67 Ca 0.56 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.85 2yuj s THR 67 Cb 0.06 -4.89 -0.05 0.00 0.01 0.00 0.00 72.50 67.63 2yuj s THR 67 CO 0.06 -1.75 1.18 0.21 -0.69 0.00 0.00 174.62 173.64 2yuj s ASN 68 N 4.08 7.10 -0.52 3.53 2.47 0.12 -3.73 114.94 128.00 2yuj s ASN 68 Ca 0.35 1.96 0.01 0.00 0.42 0.00 0.00 52.86 55.60 2yuj s ASN 68 Cb -0.07 -2.58 0.50 0.00 -1.45 0.00 0.00 41.25 37.65 2yuj s ASN 68 CO 0.03 -0.47 1.95 0.29 -3.72 0.00 0.00 177.10 175.18 2yuj n LYS 69 N 4.08 2.36 -0.05 0.43 5.02 -1.26 -3.01 118.16 125.72 2yuj n LYS 69 Ca 0.09 -2.87 -0.06 0.00 -2.02 0.00 0.00 58.31 53.45 2yuj n LYS 69 Cb 0.47 -2.13 -0.06 0.00 -0.02 0.00 0.00 35.03 33.29 2yuj n LYS 69 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2yuj n ASN 70 N -0.83 3.05 -1.18 4.39 2.85 -1.26 -4.83 115.26 117.45 2yuj n ASN 70 Ca 0.56 -0.03 -0.02 0.00 -0.11 0.00 0.00 54.58 54.97 2yuj n ASN 70 Cb 1.05 0.21 -0.03 0.00 1.24 0.00 0.00 39.78 42.25 2yuj n ASN 70 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2yuj n SER 71 N -2.60 -0.19 -3.14 1.20 2.88 -1.26 -4.99 113.62 105.53 2yuj n SER 71 Ca -0.17 -1.98 -0.23 0.00 -1.33 0.00 0.00 58.87 55.16 2yuj n SER 71 Cb 0.74 0.05 0.04 0.00 -0.75 0.00 0.00 64.21 64.29 2yuj n SER 71 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2yuj n ASP 72 N 0.20 -5.92 -4.78 -3.46 9.92 -1.20 -4.96 116.55 106.34 2yuj n ASP 72 Ca -0.14 -0.34 -0.37 0.00 -0.53 0.00 0.00 54.79 53.41 2yuj n ASP 72 Cb 0.87 -4.77 -0.06 0.00 -0.64 0.00 0.00 41.12 36.52 2yuj n ASP 72 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2yuj s ARG 73 N -5.82 4.54 -0.07 -1.24 1.81 -1.17 -4.92 118.95 112.08 2yuj s ARG 73 Ca 0.35 1.22 -0.04 0.00 -1.72 0.00 0.00 55.73 55.54 2yuj s ARG 73 Cb -0.16 -2.94 0.03 0.00 -0.45 0.00 0.00 34.95 31.43 2yuj s ARG 73 CO 0.44 0.37 0.16 1.41 -0.68 0.00 0.00 175.30 177.00 2yuj s MET 74 N -1.81 0.15 -0.35 3.54 -2.45 -1.26 -0.70 119.30 116.42 2yuj s MET 74 Ca 0.46 0.31 0.07 0.00 -1.25 0.00 0.00 55.69 55.27 2yuj s MET 74 Cb -0.20 -0.04 0.19 0.00 1.25 0.00 0.00 34.83 36.03 2yuj s MET 74 CO 0.24 -0.09 0.61 -0.08 1.05 0.00 0.00 175.02 176.75 2yuj s THR 75 N 0.64 -1.00 -0.12 10.11 -1.32 -1.23 -4.97 115.64 117.75 2yuj s THR 75 Ca -0.05 -0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.14 2yuj s THR 75 Cb -0.06 -0.53 -0.06 0.00 -1.51 0.00 0.00 72.50 70.35 2yuj s THR 75 CO -0.03 -0.00 1.90 -1.00 -2.21 0.00 0.00 174.62 173.28 2yuj s HIS 76 N 2.36 1.56 0.14 9.09 3.76 -1.26 -3.84 115.29 127.10 2yuj s HIS 76 Ca 0.13 0.17 0.10 0.00 -0.15 0.00 0.00 55.06 55.31 2yuj s HIS 76 Cb -0.07 -4.05 -0.04 0.00 1.11 0.00 0.00 32.58 29.53 2yuj s HIS 76 CO -0.17 -4.22 -0.24 0.00 -0.85 0.00 0.00 174.74 169.26 2yuj s GLY 78 N -2.19 1.74 0.44 0.00 0.00 -1.22 -0.54 107.32 105.54 2yuj s GLY 78 Ca 0.13 -0.86 -0.23 0.00 0.00 0.00 0.00 44.72 43.76 2yuj s GLY 78 CO 0.06 -0.58 1.11 0.54 0.00 0.00 0.00 173.10 174.23 2yuj s VAL 79 N -0.70 3.41 0.14 1.40 0.11 -1.26 -2.51 120.40 120.99 2yuj s VAL 79 Ca 0.11 1.03 0.00 0.00 -2.93 0.00 0.00 61.98 60.19 2yuj s VAL 79 Cb -0.11 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 2yuj s VAL 79 CO 0.02 -0.04 0.00 -0.11 -3.33 0.00 0.00 175.10 171.64 2yuj n LEU 80 N -0.43 0.25 -4.84 2.54 7.94 -0.78 -4.81 117.00 116.87 2yuj n LEU 80 Ca 0.07 0.23 -0.36 0.00 -1.11 0.00 0.00 56.01 54.84 2yuj n LEU 80 Cb 0.49 0.06 -0.06 0.00 0.53 0.00 0.00 43.42 44.45 2yuj n LEU 80 CO 0.45 -0.61 0.17 -1.61 -1.11 0.00 0.00 177.39 174.68 2yuj s GLU 81 N -2.00 3.95 -0.45 1.96 0.41 -1.08 -5.02 118.70 116.48 2yuj s GLU 81 Ca 0.00 0.44 0.09 0.00 -0.41 0.00 0.00 54.97 55.09 2yuj s GLU 81 Cb 0.00 -3.07 0.38 0.00 -1.78 0.00 0.00 34.13 29.66 2yuj s GLU 81 CO 0.00 0.58 0.94 1.19 -0.49 0.00 0.00 175.26 177.48 2yuj n PHE 82 N 1.24 2.47 -2.55 1.61 3.01 -1.26 -2.24 117.46 119.74 2yuj n PHE 82 Ca -0.09 -3.51 0.00 0.00 1.01 0.00 0.00 57.45 54.86 2yuj n PHE 82 Cb 0.52 -0.35 0.05 0.00 -0.01 0.00 0.00 39.48 39.69 2yuj n PHE 82 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 2yuj n VAL 83 N -0.15 0.92 -3.51 -4.37 0.24 -1.23 -3.91 118.33 106.32 2yuj n VAL 83 Ca 0.28 -2.27 -0.22 0.00 -2.04 0.00 0.00 64.34 60.09 2yuj n VAL 83 Cb 0.60 0.89 -0.01 0.00 -1.47 0.00 0.00 33.84 33.85 2yuj n VAL 83 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yuj s ALA 84 N -2.22 3.89 0.62 2.33 0.00 -1.23 -4.94 121.76 120.21 2yuj s ALA 84 Ca 0.32 -1.15 -0.15 0.00 0.00 0.00 0.00 51.96 50.98 2yuj s ALA 84 Cb 0.36 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2yuj s ALA 84 CO -0.09 -0.01 1.07 -0.51 0.00 0.00 0.00 175.76 176.22 2yuj s ASP 85 N -4.08 5.61 0.11 0.00 1.11 -1.26 -3.85 116.67 114.32 2yuj s ASP 85 Ca 0.41 1.82 -0.31 0.00 0.18 0.00 0.00 52.55 54.64 2yuj s ASP 85 Cb -0.09 -2.53 -0.09 0.00 1.07 0.00 0.00 42.92 41.27 2yuj s ASP 85 CO 0.33 -1.28 1.62 -1.61 1.18 0.00 0.00 175.17 175.40 2yuj s GLU 86 N -4.22 4.20 -0.54 8.23 8.01 -1.26 -2.18 118.70 130.95 2yuj s GLU 86 Ca 0.63 2.35 0.00 0.00 0.01 0.00 0.00 54.97 57.96 2yuj s GLU 86 Cb -0.16 -3.39 0.00 0.00 -4.31 0.00 0.00 34.13 26.26 2yuj s GLU 86 CO 0.40 -0.68 0.00 0.41 0.01 0.00 0.00 175.26 175.41 2yuj n GLY 87 N 3.89 0.29 2.81 -1.39 0.00 -1.26 -5.01 105.19 104.51 2yuj n GLY 87 Ca 0.15 -0.67 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 2yuj n GLY 87 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yuj s ILE 88 N -2.28 -0.47 -0.16 -0.61 1.01 -0.92 -4.31 121.20 113.46 2yuj s ILE 88 Ca 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 60.65 60.10 2yuj s ILE 88 Cb 0.00 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.47 2yuj s ILE 88 CO 0.00 -0.42 0.12 0.00 0.00 0.00 0.00 174.94 174.63 2yuj s TYR 90 N -0.31 3.43 0.04 0.00 2.02 -0.85 -1.01 117.35 120.68 2yuj s TYR 90 Ca 0.11 0.17 -0.07 0.00 -0.37 0.00 0.00 57.07 56.91 2yuj s TYR 90 Cb -0.12 -1.70 -0.00 0.00 -0.40 0.00 0.00 41.96 39.74 2yuj s TYR 90 CO 0.01 0.56 0.15 -0.51 -1.57 0.00 0.00 175.55 174.18 2yuj s LEU 91 N -2.68 1.59 0.00 -1.29 1.02 -0.46 -2.36 118.68 114.50 2yuj s LEU 91 Ca 0.34 -0.49 -0.09 0.00 0.02 0.00 0.00 54.13 53.90 2yuj s LEU 91 Cb -0.12 0.79 0.14 0.00 0.02 0.00 0.00 46.19 47.03 2yuj s LEU 91 CO 0.27 -0.56 0.33 -2.65 0.02 0.00 0.00 176.35 173.76 2yuj n PRO 92 N 0.61 -1.56 -0.09 1.29 -0.02 -1.26 -3.96 135.00 130.01 2yuj n PRO 92 Ca -0.18 -0.55 -0.19 0.00 -2.02 0.00 0.00 63.50 60.56 2yuj n PRO 92 Cb 0.59 -0.95 -0.11 0.00 -0.02 0.00 0.00 33.50 33.01 2yuj n PRO 92 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2yuj h HIS 93 N -2.47 0.00 -0.67 6.00 2.76 -1.89 -3.25 115.15 115.63 2yuj h HIS 93 Ca -0.15 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.00 2yuj h HIS 93 Cb 0.50 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.43 2yuj h HIS 93 CO 0.00 1.28 0.32 0.11 -1.30 0.00 0.00 177.93 178.34 2yuj h TRP 94 N -1.00 0.94 -0.64 5.26 5.08 -1.93 -1.99 115.95 121.67 2yuj h TRP 94 Ca -0.25 -0.03 -0.05 0.00 1.08 0.00 0.00 58.89 59.63 2yuj h TRP 94 Cb 1.18 -0.29 -0.03 0.00 -3.00 0.00 0.00 29.16 27.01 2yuj h TRP 94 CO 0.12 0.68 0.19 1.98 -1.28 0.00 0.00 178.44 180.13 2yuj h MET 95 N 0.94 0.98 -0.15 0.12 4.05 -1.89 0.27 114.93 119.25 2yuj h MET 95 Ca 0.23 -0.20 -0.03 0.00 -0.28 0.00 0.00 59.70 59.42 2yuj h MET 95 Cb 0.10 -0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 30.74 2yuj h MET 95 CO -0.03 0.85 -0.04 0.52 0.23 0.00 0.00 176.91 178.44 2yuj h MET 96 N 0.94 0.29 -0.57 0.39 2.86 -1.46 -2.84 114.93 114.55 2yuj h MET 96 Ca 0.21 -0.11 -0.07 0.00 -2.06 0.00 0.00 59.70 57.67 2yuj h MET 96 Cb 0.29 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 2yuj h MET 96 CO -0.01 0.57 0.07 1.96 1.06 0.00 0.00 176.91 180.57 2yuj h GLN 97 N -0.02 0.92 -0.17 1.72 7.50 -1.23 0.32 115.11 124.16 2yuj h GLN 97 Ca 0.04 -0.23 0.01 0.00 0.50 0.00 0.00 58.65 58.97 2yuj h GLN 97 Cb 0.47 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.88 2yuj h GLN 97 CO 0.02 0.87 0.11 -0.97 -1.50 0.00 0.00 178.83 177.36 2yuj h ASN 98 N 0.87 0.15 0.09 1.46 -1.24 -0.88 -1.79 115.58 114.23 2yuj h ASN 98 Ca 0.17 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.18 2yuj h ASN 98 Cb 0.41 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.43 2yuj h ASN 98 CO 0.01 0.10 -1.43 0.18 -1.29 0.00 0.00 177.43 175.00 2yuj n LEU 99 N -4.51 0.50 -3.32 0.34 4.77 -0.92 -4.98 117.00 108.87 2yuj n LEU 99 Ca -0.00 -0.19 -0.21 0.00 -0.03 0.00 0.00 56.01 55.58 2yuj n LEU 99 Cb 0.12 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.27 2yuj n LEU 99 CO 0.34 0.10 0.21 0.18 -1.33 0.00 0.00 177.39 176.90 2yuj n LEU 100 N -1.92 -3.36 -4.86 2.23 4.77 0.11 -4.90 117.00 109.06 2yuj n LEU 100 Ca 0.00 -0.50 -0.31 0.00 -0.03 0.00 0.00 56.01 55.17 2yuj n LEU 100 Cb 0.45 -2.83 0.01 0.00 -2.33 0.00 0.00 43.42 38.72 2yuj n LEU 100 CO 0.44 0.57 0.71 -0.76 -1.33 0.00 0.00 177.39 177.02 2yuj s LEU 101 N -6.68 3.29 0.00 2.23 1.43 -1.04 -5.04 118.68 112.86 2yuj s LEU 101 Ca 0.47 1.47 0.04 0.00 -1.03 0.00 0.00 54.13 55.08 2yuj s LEU 101 Cb -0.21 -4.48 0.04 0.00 0.03 0.00 0.00 46.19 41.57 2yuj s LEU 101 CO 0.67 -0.90 0.33 1.21 0.23 0.00 0.00 176.35 177.89 2yuj n GLU 102 N -2.60 0.76 -1.81 1.70 2.13 -1.26 -4.93 120.64 114.63 2yuj n GLU 102 Ca 0.06 -3.21 -0.41 0.00 0.66 0.00 0.00 57.16 54.27 2yuj n GLU 102 Cb 0.54 0.41 -0.03 0.00 0.27 0.00 0.00 31.44 32.63 2yuj n GLU 102 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2yuj s GLU 103 N -4.03 2.92 0.00 5.31 0.41 -1.26 -1.96 118.70 120.08 2yuj s GLU 103 Ca 0.25 1.46 0.00 0.00 -0.41 0.00 0.00 54.97 56.27 2yuj s GLU 103 Cb -0.02 -4.35 0.00 0.00 -1.78 0.00 0.00 34.13 27.98 2yuj s GLU 103 CO 0.16 -2.35 0.00 0.41 -0.49 0.00 0.00 175.26 172.99 2yuj n GLY 104 N 5.68 0.89 3.74 -1.39 0.00 -1.17 -5.04 105.19 107.89 2yuj n GLY 104 Ca 0.27 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2yuj n GLY 104 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yuj s GLY 105 N -2.71 2.95 -0.10 -0.02 0.00 -0.83 -4.67 107.32 101.94 2yuj s GLY 105 Ca 0.00 0.70 -0.21 0.00 0.00 0.00 0.00 44.72 45.21 2yuj s GLY 105 CO 0.00 1.52 0.62 1.08 0.00 0.00 0.00 173.10 176.32 2yuj s LEU 106 N -0.37 4.27 0.06 0.66 1.43 -1.26 -0.17 118.68 123.30 2yuj s LEU 106 Ca 0.47 1.02 0.06 0.00 -1.03 0.00 0.00 54.13 54.65 2yuj s LEU 106 Cb -0.27 -2.93 -0.03 0.00 0.03 0.00 0.00 46.19 42.99 2yuj s LEU 106 CO 0.33 -0.11 -0.17 -0.69 0.23 0.00 0.00 176.35 175.94 2yuj s VAL 107 N 0.94 1.34 0.09 -1.59 1.01 -0.87 -4.84 120.40 116.48 2yuj s VAL 107 Ca 0.33 -1.19 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 2yuj s VAL 107 Cb -0.17 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.93 2yuj s VAL 107 CO 0.14 0.00 1.40 -1.10 0.00 0.00 0.00 175.10 175.55 2yuj s GLN 108 N -1.38 4.31 -0.36 2.72 -1.52 -1.24 -2.58 119.66 119.61 2yuj s GLN 108 Ca 0.03 2.07 0.04 0.00 -1.95 0.00 0.00 55.36 55.55 2yuj s GLN 108 Cb -0.09 -3.33 0.10 0.00 -0.22 0.00 0.00 33.01 29.48 2yuj s GLN 108 CO 0.02 -0.48 0.07 0.08 -0.25 0.00 0.00 175.29 174.73 2yuj s VAL 109 N 1.42 2.29 -0.09 1.09 1.01 -0.82 -3.38 120.40 121.92 2yuj s VAL 109 Ca 0.65 -2.43 0.03 0.00 0.00 0.00 0.00 61.98 60.22 2yuj s VAL 109 Cb -0.36 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.34 2yuj s VAL 109 CO 0.30 -0.62 -0.18 -1.61 0.00 0.00 0.00 175.10 172.99 2yuj s GLU 110 N 0.79 2.41 -0.64 2.72 2.02 -1.25 -3.35 118.70 121.40 2yuj s GLU 110 Ca 0.12 -0.65 -0.22 0.00 0.02 0.00 0.00 54.97 54.23 2yuj s GLU 110 Cb -0.20 -1.92 0.07 0.00 0.10 0.00 0.00 34.13 32.18 2yuj s GLU 110 CO -0.07 0.06 0.93 -1.54 0.02 0.00 0.00 175.26 174.65 2yuj s SER 111 N 0.64 6.18 0.28 -0.19 1.04 -1.23 -0.36 113.70 120.07 2yuj s SER 111 Ca -0.14 -0.99 0.07 0.00 0.48 0.00 0.00 55.95 55.37 2yuj s SER 111 Cb -0.16 -2.40 -0.03 0.00 0.10 0.00 0.00 66.02 63.52 2yuj s SER 111 CO 0.04 -1.38 0.31 0.68 0.98 0.00 0.00 173.24 173.86 2yuj s VAL 112 N 3.89 4.37 -0.33 5.02 -7.23 -1.06 -4.79 120.40 120.28 2yuj s VAL 112 Ca 0.21 -1.22 -0.15 0.00 -1.81 0.00 0.00 61.98 59.01 2yuj s VAL 112 Cb -0.17 -3.47 -0.02 0.00 0.56 0.00 0.00 36.38 33.28 2yuj s VAL 112 CO 0.10 -0.27 0.35 0.21 -0.31 0.00 0.00 175.10 175.19 2yuj s ASN 113 N -3.97 6.18 0.42 4.85 3.84 -1.26 -4.35 114.94 120.65 2yuj s ASN 113 Ca 0.37 -0.12 0.07 0.00 0.21 0.00 0.00 52.86 53.39 2yuj s ASN 113 Cb -0.08 -2.19 -0.05 0.00 -0.55 0.00 0.00 41.25 38.37 2yuj s ASN 113 CO 0.27 -0.29 0.14 -0.76 -2.79 0.00 0.00 177.10 173.67 2yuj s LEU 114 N 2.01 3.01 0.26 3.21 1.43 -1.26 -5.12 118.68 122.22 2yuj s LEU 114 Ca 0.12 -1.18 0.06 0.00 -1.03 0.00 0.00 54.13 52.10 2yuj s LEU 114 Cb -0.16 -1.27 -0.05 0.00 0.03 0.00 0.00 46.19 44.73 2yuj s LEU 114 CO 0.11 -0.56 -0.05 0.00 0.23 0.00 0.00 176.35 176.08 2yuj s GLN 115 N -3.88 1.46 0.37 1.70 0.00 -1.26 -4.76 119.66 113.30 2yuj s GLN 115 Ca 0.38 -1.73 -0.28 0.00 -0.00 0.00 0.00 55.36 53.72 2yuj s GLN 115 Cb 0.05 -0.99 -0.10 0.00 0.00 0.00 0.00 33.01 31.97 2yuj s GLN 115 CO 0.21 0.01 1.42 0.14 0.00 0.00 0.00 175.29 177.06 2yuj s VAL 116 N -3.13 2.28 0.43 3.63 -7.23 -1.22 -0.90 120.40 114.25 2yuj s VAL 116 Ca 0.28 0.27 -0.22 0.00 -1.81 0.00 0.00 61.98 60.50 2yuj s VAL 116 Cb 0.04 -3.17 -0.09 0.00 0.56 0.00 0.00 36.38 33.71 2yuj s VAL 116 CO 0.10 0.06 1.01 0.00 -0.31 0.00 0.00 175.10 175.97 2yuj s ALA 117 N -1.14 3.01 -0.18 1.32 0.00 -1.26 -4.68 121.76 118.83 2yuj s ALA 117 Ca 0.53 0.59 0.06 0.00 0.00 0.00 0.00 51.96 53.14 2yuj s ALA 117 Cb -0.44 -3.23 -0.15 0.00 0.00 0.00 0.00 23.12 19.30 2yuj s ALA 117 CO 0.59 -0.14 -0.08 0.25 0.00 0.00 0.00 175.76 176.38 2yuj n THR 118 N -0.45 1.09 -3.89 0.00 -2.24 -0.99 -4.58 114.28 103.21 2yuj n THR 118 Ca 0.07 -0.51 -0.30 0.00 -2.27 0.00 0.00 64.05 61.04 2yuj n THR 118 Cb 0.52 -0.96 -0.16 0.00 -2.10 0.00 0.00 70.33 67.63 2yuj n THR 118 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2yuj s TYR 119 N -2.38 2.11 -0.18 4.78 5.04 -1.26 -0.05 117.35 125.41 2yuj s TYR 119 Ca -0.19 -1.58 -0.04 0.00 -2.44 0.00 0.00 57.07 52.81 2yuj s TYR 119 Cb 0.06 -1.48 -0.02 0.00 0.35 0.00 0.00 41.96 40.86 2yuj s TYR 119 CO 0.52 -0.75 -0.02 -1.12 -1.34 0.00 0.00 175.55 172.85 2yuj s SER 120 N 1.49 4.79 -0.05 4.32 0.01 -1.14 -1.01 113.70 122.10 2yuj s SER 120 Ca -0.04 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.08 2yuj s SER 120 Cb -0.18 -1.80 -0.00 0.00 0.21 0.00 0.00 66.02 64.24 2yuj s SER 120 CO -0.07 0.10 -0.19 -0.75 0.41 0.00 0.00 173.24 172.74 2yuj s LYS 121 N 0.76 2.07 0.18 12.44 2.20 -0.11 0.34 119.74 137.62 2yuj s LYS 121 Ca -0.01 -0.68 0.07 0.00 -0.36 0.00 0.00 55.97 55.00 2yuj s LYS 121 Cb -0.14 -1.74 -0.05 0.00 -1.51 0.00 0.00 37.83 34.39 2yuj s LYS 121 CO 0.02 0.24 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.06 2yuj s PHE 122 N 0.10 1.59 -0.33 4.03 0.40 -1.22 -1.25 117.98 121.28 2yuj s PHE 122 Ca -0.07 -0.61 -0.01 0.00 -0.60 0.00 0.00 56.93 55.64 2yuj s PHE 122 Cb -0.13 -0.76 0.12 0.00 0.51 0.00 0.00 43.02 42.76 2yuj s PHE 122 CO 0.03 0.28 0.16 -1.14 0.70 0.00 0.00 175.22 175.25 2yuj s GLN 123 N -3.55 0.55 -0.47 0.44 0.74 0.25 -2.76 119.66 114.87 2yuj s GLN 123 Ca 0.20 -1.10 -0.34 0.00 0.05 0.00 0.00 55.36 54.17 2yuj s GLN 123 Cb -0.01 -1.52 -0.13 0.00 1.10 0.00 0.00 33.01 32.45 2yuj s GLN 123 CO 0.05 -1.10 2.29 -2.30 -0.55 0.00 0.00 175.29 173.68 2yuj n PRO 124 N 4.54 0.82 0.15 1.67 -0.02 -1.26 -2.64 135.00 138.27 2yuj n PRO 124 Ca 0.03 0.19 0.08 0.00 -2.02 0.00 0.00 63.50 61.78 2yuj n PRO 124 Cb 0.39 -2.37 0.58 0.00 -0.02 0.00 0.00 33.50 32.09 2yuj n PRO 124 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2yuj h GLN 125 N 12.97 0.16 -6.45 -0.52 1.08 -1.82 -3.42 115.11 117.11 2yuj h GLN 125 Ca -0.22 -0.01 -0.67 0.00 -1.45 0.00 0.00 58.65 56.30 2yuj h GLN 125 Cb 1.32 -0.04 -0.18 0.00 -0.05 0.00 0.00 27.48 28.54 2yuj h GLN 125 CO 1.09 0.10 -0.74 0.45 -0.95 0.00 0.00 178.83 178.79 2yuj s SER 126 N -6.84 4.35 0.32 1.46 0.15 -1.25 -5.02 113.70 106.87 2yuj s SER 126 Ca -0.06 -0.30 0.26 0.00 0.70 0.00 0.00 55.95 56.55 2yuj s SER 126 Cb 0.18 -0.88 0.99 0.00 -1.71 0.00 0.00 66.02 64.59 2yuj s SER 126 CO 0.70 0.24 1.77 1.55 1.20 0.00 0.00 173.24 178.69 2yuj h PRO 127 N 4.18 0.00 -0.81 5.44 0.13 -1.95 -3.22 132.00 135.77 2yuj h PRO 127 Ca -0.48 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.74 2yuj h PRO 127 Cb 1.16 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.22 2yuj h PRO 127 CO 0.52 0.00 0.46 -0.44 -0.23 0.00 0.00 178.00 178.31 2yuj h ASP 128 N 0.00 0.65 -0.90 1.44 5.19 -1.95 -1.36 116.42 119.49 2yuj h ASP 128 Ca 0.00 0.05 0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2yuj h ASP 128 Cb 0.50 -0.08 -0.04 0.00 0.18 0.00 0.00 39.33 39.89 2yuj h ASP 128 CO 0.00 0.37 0.59 0.15 -3.12 0.00 0.00 179.24 177.23 2yuj h PHE 129 N 0.77 1.15 0.00 4.55 3.57 -1.91 -1.55 116.94 123.52 2yuj h PHE 129 Ca 0.39 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.89 2yuj h PHE 129 Cb 0.35 -0.39 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 2yuj h PHE 129 CO -0.07 0.73 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.57 2yuj h LEU 130 N 1.23 0.00 -2.47 0.59 3.38 -1.45 -1.57 115.31 115.02 2yuj h LEU 130 Ca 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 2yuj h LEU 130 Cb -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2yuj h LEU 130 CO -0.07 0.10 -0.01 -0.78 0.09 0.00 0.00 178.44 177.77 2yuj h ASP 131 N 0.00 0.00 -3.56 -0.43 3.58 -0.85 -3.43 116.42 111.73 2yuj h ASP 131 Ca -0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2yuj h ASP 131 Cb 0.20 0.00 0.08 0.00 1.72 0.00 0.00 39.33 41.33 2yuj h ASP 131 CO 0.01 0.01 0.79 -0.63 -2.88 0.00 0.00 179.24 176.55 2yuj s ILE 132 N -4.50 2.32 0.25 2.25 1.01 -0.59 -4.91 121.20 117.03 2yuj s ILE 132 Ca -0.05 0.28 -0.05 0.00 0.00 0.00 0.00 60.65 60.84 2yuj s ILE 132 Cb 0.15 -3.18 0.26 0.00 0.01 0.00 0.00 42.46 39.69 2yuj s ILE 132 CO 0.53 0.05 1.91 0.74 0.00 0.00 0.00 174.94 178.17 2yuj h THR 133 N 3.29 1.20 -2.84 2.92 2.02 -1.88 -3.34 112.91 114.27 2yuj h THR 133 Ca -0.48 -0.44 -0.60 0.00 0.77 0.00 0.00 66.41 65.66 2yuj h THR 133 Cb 1.22 -0.20 -0.40 0.00 -1.74 0.00 0.00 68.15 67.04 2yuj h THR 133 CO 0.73 0.23 -0.77 0.20 0.37 0.00 0.00 175.52 176.28 2yuj s ASN 134 N -6.03 3.31 0.37 4.18 -0.87 -1.26 -4.96 114.94 109.69 2yuj s ASN 134 Ca -0.13 -2.80 0.16 0.00 -1.57 0.00 0.00 52.86 48.52 2yuj s ASN 134 Cb 0.19 -0.92 0.72 0.00 -0.02 0.00 0.00 41.25 41.21 2yuj s ASN 134 CO 0.82 -0.23 1.78 1.55 -2.57 0.00 0.00 177.10 178.44 2yuj h PRO 135 N 6.41 0.00 -0.09 -0.60 0.13 -1.85 -2.91 132.00 133.08 2yuj h PRO 135 Ca 0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.16 2yuj h PRO 135 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2yuj h PRO 135 CO 0.46 0.39 -0.11 -0.22 -0.23 0.00 0.00 178.00 178.29 2yuj h LYS 136 N 0.00 0.14 0.04 0.86 3.64 -1.95 0.46 116.57 119.76 2yuj h LYS 136 Ca -0.00 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.13 2yuj h LYS 136 Cb 0.79 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 2yuj h LYS 136 CO 0.05 0.26 -1.02 0.00 -2.27 0.00 0.00 179.45 176.47 2yuj h ALA 137 N 1.76 0.34 0.02 5.00 0.00 -1.94 -2.62 119.26 121.81 2yuj h ALA 137 Ca 0.03 -0.82 -0.25 0.00 0.00 0.00 0.00 54.91 53.87 2yuj h ALA 137 Cb 0.29 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2yuj h ALA 137 CO 0.02 1.02 -1.27 0.28 0.00 0.00 0.00 179.25 179.30 2yuj h VAL 138 N 0.07 1.40 -0.00 0.00 2.07 -1.39 -2.21 116.25 116.18 2yuj h VAL 138 Ca -0.06 -3.14 -0.16 0.00 0.82 0.00 0.00 66.70 64.16 2yuj h VAL 138 Cb 1.72 2.72 -0.02 0.00 -1.52 0.00 0.00 31.29 34.19 2yuj h VAL 138 CO 0.15 0.82 -0.77 0.25 0.02 0.00 0.00 177.57 178.05 2yuj h LEU 139 N 0.01 0.04 0.17 2.57 5.85 -0.17 -2.84 115.31 120.93 2yuj h LEU 139 Ca -0.12 -0.03 -0.34 0.00 0.84 0.00 0.00 57.88 58.23 2yuj h LEU 139 Cb 1.87 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.90 2yuj h LEU 139 CO 0.12 0.79 -1.72 -0.33 -0.34 0.00 0.00 178.44 176.96 2yuj h GLU 140 N 0.02 0.35 0.00 1.25 5.08 -1.56 -3.31 114.58 116.41 2yuj h GLU 140 Ca -0.01 -0.60 -0.02 0.00 -1.00 0.00 0.00 59.36 57.73 2yuj h GLU 140 Cb 1.35 0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.82 2yuj h GLU 140 CO 0.10 1.25 -0.11 -0.91 -1.00 0.00 0.00 179.01 178.35 2yuj h ASN 141 N 0.10 0.00 0.49 1.42 2.35 -1.46 -2.41 115.58 116.06 2yuj h ASN 141 Ca -0.33 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.23 2yuj h ASN 141 Cb 2.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.44 2yuj h ASN 141 CO 0.17 0.11 -0.83 0.00 -1.65 0.00 0.00 177.43 175.22 2yuj h ALA 142 N 1.89 0.55 0.00 -0.83 0.00 -1.60 -3.11 119.26 116.16 2yuj h ALA 142 Ca -0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 2yuj h ALA 142 Cb 0.35 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2yuj h ALA 142 CO 0.01 0.86 -0.05 -0.07 0.00 0.00 0.00 179.25 180.00 2yuj h LEU 143 N 0.15 0.00 -2.01 0.00 3.38 -1.52 -2.48 115.31 112.83 2yuj h LEU 143 Ca -0.04 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.09 2yuj h LEU 143 Cb 1.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.17 2yuj h LEU 143 CO 0.13 0.05 0.43 0.03 0.09 0.00 0.00 178.44 179.17 2yuj h ARG 144 N 0.00 0.00 0.00 1.13 2.47 -1.59 0.63 114.38 117.03 2yuj h ARG 144 Ca -0.00 0.00 -0.26 0.00 -1.26 0.00 0.00 59.98 58.46 2yuj h ARG 144 Cb 0.22 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.50 2yuj h ARG 144 CO 0.01 0.00 -1.47 -0.91 0.56 0.00 0.00 179.97 178.16 2yuj h ASN 145 N 0.00 0.00 -3.31 7.04 4.21 -1.66 -3.46 115.58 118.40 2yuj h ASN 145 Ca 0.27 0.00 -0.56 0.00 1.21 0.00 0.00 56.30 57.22 2yuj h ASN 145 Cb 1.13 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 38.29 2yuj h ASN 145 CO -0.00 0.97 0.01 -0.36 -1.29 0.00 0.00 177.43 176.75 2yuj s PHE 146 N -2.65 3.80 -0.17 1.19 0.40 0.21 -3.49 117.98 117.28 2yuj s PHE 146 Ca -0.03 1.33 0.14 0.00 -0.60 0.00 0.00 56.93 57.77 2yuj s PHE 146 Cb 0.09 -2.54 -0.20 0.00 0.51 0.00 0.00 43.02 40.87 2yuj s PHE 146 CO 0.82 0.55 0.05 0.00 0.70 0.00 0.00 175.22 177.34 2yuj n ALA 147 N 1.58 1.58 -2.29 5.36 0.00 -1.26 -4.87 120.51 120.61 2yuj n ALA 147 Ca -0.09 -1.10 -0.16 0.00 0.00 0.00 0.00 53.44 52.09 2yuj n ALA 147 Cb 0.50 -0.10 -0.10 0.00 0.00 0.00 0.00 19.45 19.75 2yuj n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuj s LEU 149 N -3.25 1.72 -0.14 0.00 1.43 -0.97 -4.93 118.68 112.54 2yuj s LEU 149 Ca 0.24 -1.14 -0.07 0.00 -1.03 0.00 0.00 54.13 52.13 2yuj s LEU 149 Cb 0.05 0.42 0.06 0.00 0.03 0.00 0.00 46.19 46.74 2yuj s LEU 149 CO 0.05 -0.74 0.33 -0.89 0.23 0.00 0.00 176.35 175.34 2yuj s THR 150 N -4.02 -0.08 -0.22 5.49 2.01 -1.24 -3.14 115.64 114.44 2yuj s THR 150 Ca 0.21 0.13 -0.28 0.00 0.31 0.00 0.00 61.69 62.06 2yuj s THR 150 Cb 0.07 -0.51 -0.05 0.00 0.01 0.00 0.00 72.50 72.02 2yuj s THR 150 CO 0.00 0.05 2.23 0.41 -0.69 0.00 0.00 174.62 176.63 2yuj n THR 151 N 4.35 0.34 -0.15 -0.82 -1.04 -1.23 -2.95 114.28 112.78 2yuj n THR 151 Ca -0.23 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.31 2yuj n THR 151 Cb 0.54 -2.57 0.00 0.00 -1.82 0.00 0.00 70.33 66.47 2yuj n THR 151 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2yuj n GLY 152 N 5.78 0.56 2.81 3.41 0.00 0.68 -5.02 105.19 113.42 2yuj n GLY 152 Ca 0.30 -0.16 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 2yuj n GLY 152 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yuj s ASP 153 N -1.31 0.34 -0.55 1.61 1.11 -1.15 -4.96 116.67 111.76 2yuj s ASP 153 Ca 0.00 -0.01 -0.27 0.00 0.18 0.00 0.00 52.55 52.44 2yuj s ASP 153 Cb 0.00 -0.18 0.03 0.00 1.07 0.00 0.00 42.92 43.84 2yuj s ASP 153 CO 0.00 -0.10 1.12 -0.69 1.18 0.00 0.00 175.17 176.68 2yuj s VAL 154 N 0.99 4.15 -0.42 -1.27 1.01 -1.26 -3.02 120.40 120.58 2yuj s VAL 154 Ca -0.10 0.84 -0.11 0.00 0.00 0.00 0.00 61.98 62.62 2yuj s VAL 154 Cb -0.13 -4.65 0.07 0.00 0.00 0.00 0.00 36.38 31.66 2yuj s VAL 154 CO -0.02 -1.21 0.27 0.27 0.00 0.00 0.00 175.10 174.41 2yuj s ILE 155 N 4.60 4.47 -0.08 2.22 -4.36 -0.82 -4.83 121.20 122.40 2yuj s ILE 155 Ca 0.41 -1.23 -0.28 0.00 -0.26 0.00 0.00 60.65 59.29 2yuj s ILE 155 Cb -0.08 -3.67 -0.02 0.00 1.25 0.00 0.00 42.46 39.93 2yuj s ILE 155 CO 0.26 -0.46 0.94 0.00 0.24 0.00 0.00 174.94 175.91 2yuj s ALA 156 N 1.49 3.34 0.10 2.27 0.00 -1.26 -3.58 121.76 124.12 2yuj s ALA 156 Ca 0.03 0.35 0.10 0.00 0.00 0.00 0.00 51.96 52.43 2yuj s ALA 156 Cb -0.22 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2yuj s ALA 156 CO 0.04 -0.44 -0.24 0.96 0.00 0.00 0.00 175.76 176.08 2yuj s ILE 157 N 1.59 2.42 -0.10 0.00 -4.36 -1.11 -4.81 121.20 114.83 2yuj s ILE 157 Ca 0.47 -1.57 -0.07 0.00 -0.26 0.00 0.00 60.65 59.22 2yuj s ILE 157 Cb -0.19 -2.05 0.04 0.00 1.25 0.00 0.00 42.46 41.51 2yuj s ILE 157 CO 0.20 0.17 0.25 0.21 0.24 0.00 0.00 174.94 176.01 2yuj s ASN 158 N -1.85 -0.26 0.00 4.36 3.84 -1.26 -0.55 114.94 119.22 2yuj s ASN 158 Ca 0.14 0.51 0.00 0.00 0.21 0.00 0.00 52.86 53.73 2yuj s ASN 158 Cb -0.10 0.45 0.00 0.00 -0.55 0.00 0.00 41.25 41.05 2yuj s ASN 158 CO 0.06 -0.13 0.00 0.00 -2.79 0.00 0.00 177.10 174.24 2yuj n TYR 159 N 3.65 -0.90 -1.60 0.43 4.11 -1.26 -4.92 117.16 116.67 2yuj n TYR 159 Ca -0.20 0.00 -0.37 0.00 -0.00 0.00 0.00 57.90 57.34 2yuj n TYR 159 Cb 0.55 0.37 0.06 0.00 -0.00 0.00 0.00 39.34 40.33 2yuj n TYR 159 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 2yuj n ASN 160 N -2.24 7.58 -2.44 9.48 5.15 -1.26 -4.81 115.26 126.72 2yuj n ASN 160 Ca 0.00 -3.81 -0.21 0.00 -0.60 0.00 0.00 54.58 49.96 2yuj n ASN 160 Cb 0.00 -1.01 -0.01 0.00 -0.53 0.00 0.00 39.78 38.24 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2yuj n GLU 161 N -0.75 -1.92 -3.63 1.20 1.02 -1.26 -4.97 120.64 110.33 2yuj n GLU 161 Ca 0.59 1.01 -0.20 0.00 -0.02 0.00 0.00 57.16 58.53 2yuj n GLU 161 Cb 0.48 -5.69 -0.16 0.00 -0.02 0.00 0.00 31.44 26.05 2yuj n GLU 161 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2yuj s LYS 162 N -5.10 0.03 -1.11 3.49 -0.14 -1.26 -5.08 119.74 110.58 2yuj s LYS 162 Ca 0.02 0.29 -0.21 0.00 -1.36 0.00 0.00 55.97 54.72 2yuj s LYS 162 Cb -0.01 -0.88 0.07 0.00 -1.68 0.00 0.00 37.83 35.33 2yuj s LYS 162 CO 0.03 -0.46 1.51 0.42 -0.76 0.00 0.00 175.35 176.09 2yuj s ILE 163 N 2.23 4.09 0.78 2.17 1.09 -1.26 -4.12 121.20 126.18 2yuj s ILE 163 Ca 0.04 -1.25 -0.12 0.00 -1.10 0.00 0.00 60.65 58.22 2yuj s ILE 163 Cb -0.14 -5.07 0.06 0.00 -1.06 0.00 0.00 42.46 36.25 2yuj s ILE 163 CO -0.07 -1.92 1.12 -0.31 -0.10 0.00 0.00 174.94 173.66 2yuj s TYR 164 N 4.44 2.31 -0.09 3.97 1.51 0.29 -4.82 117.35 124.96 2yuj s TYR 164 Ca 0.47 1.61 0.00 0.00 -1.01 0.00 0.00 57.07 58.15 2yuj s TYR 164 Cb 0.01 -3.18 -0.03 0.00 -0.11 0.00 0.00 41.96 38.65 2yuj s TYR 164 CO -0.04 -2.09 -0.09 -1.21 -1.11 0.00 0.00 175.55 171.01 2yuj s GLU 165 N -4.58 3.01 0.03 -0.62 8.01 -1.26 -2.73 118.70 120.55 2yuj s GLU 165 Ca 0.65 -0.59 -0.08 0.00 0.01 0.00 0.00 54.97 54.96 2yuj s GLU 165 Cb -0.20 -2.63 -0.00 0.00 -4.31 0.00 0.00 34.13 26.99 2yuj s GLU 165 CO 0.52 0.49 0.16 -0.51 0.01 0.00 0.00 175.26 175.94 2yuj s LEU 166 N -0.36 1.52 -0.08 1.80 1.43 -1.23 -2.74 118.68 119.01 2yuj s LEU 166 Ca 0.05 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.72 2yuj s LEU 166 Cb -0.12 0.82 0.05 0.00 0.03 0.00 0.00 46.19 46.96 2yuj s LEU 166 CO 0.02 -0.52 0.18 -0.60 0.23 0.00 0.00 176.35 175.66 2yuj s ARG 167 N -2.43 0.09 -0.48 1.70 3.52 -1.08 -1.95 118.95 118.31 2yuj s ARG 167 Ca -0.06 0.50 -0.27 0.00 -0.13 0.00 0.00 55.73 55.77 2yuj s ARG 167 Cb -0.02 -0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.16 2yuj s ARG 167 CO -0.03 -0.23 1.85 0.08 -0.81 0.00 0.00 175.30 176.15 2yuj s VAL 168 N 1.74 3.41 0.00 7.11 1.01 -1.17 0.84 120.40 133.35 2yuj s VAL 168 Ca -0.04 0.34 -0.25 0.00 0.00 0.00 0.00 61.98 62.03 2yuj s VAL 168 Cb -0.12 -3.77 -0.18 0.00 0.00 0.00 0.00 36.38 32.31 2yuj s VAL 168 CO -0.06 -0.65 1.32 0.24 0.00 0.00 0.00 175.10 175.95 2yuj h MET 169 N 14.20 -0.12 -3.58 2.72 2.86 -1.45 0.20 114.93 129.75 2yuj h MET 169 Ca -0.29 0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.30 2yuj h MET 169 Cb 1.17 0.03 -0.12 0.00 0.06 0.00 0.00 31.60 32.74 2yuj h MET 169 CO 1.13 0.23 -0.15 -2.00 1.06 0.00 0.00 176.91 177.19 2yuj s GLU 170 N -4.66 1.23 -0.22 1.72 2.12 -1.13 -4.57 118.70 113.19 2yuj s GLU 170 Ca -0.15 -0.98 -0.26 0.00 0.36 0.00 0.00 54.97 53.93 2yuj s GLU 170 Cb 0.02 0.45 0.07 0.00 0.26 0.00 0.00 34.13 34.93 2yuj s GLU 170 CO 0.63 -0.49 0.71 0.95 -0.54 0.00 0.00 175.26 176.52 2yuj s THR 171 N -3.91 0.00 0.24 -1.70 -4.23 -1.26 -0.94 115.64 103.85 2yuj s THR 171 Ca 0.12 -0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.74 2yuj s THR 171 Cb 0.01 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.81 2yuj s THR 171 CO -0.03 -0.00 -0.18 -0.54 -0.54 0.00 0.00 174.62 173.33 2yuj s LYS 172 N 0.04 1.74 0.28 3.99 1.02 -0.18 -3.97 119.74 122.66 2yuj s LYS 172 Ca -0.02 -1.59 0.14 0.00 0.02 0.00 0.00 55.97 54.51 2yuj s LYS 172 Cb -0.04 -1.88 0.27 0.00 -0.52 0.00 0.00 37.83 35.65 2yuj s LYS 172 CO 0.03 0.37 1.54 -1.00 -0.92 0.00 0.00 175.35 175.36 2yuj h PRO 173 N 2.60 0.00 -5.26 -1.68 0.13 -1.90 -2.63 132.00 123.26 2yuj h PRO 173 Ca -0.43 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.12 2yuj h PRO 173 Cb 1.24 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.23 2yuj h PRO 173 CO 0.55 0.57 -0.56 0.34 -0.23 0.00 0.00 178.00 178.68 2yuj s ASP 174 N -6.55 3.21 0.18 1.44 -1.08 -1.25 -5.05 116.67 107.57 2yuj s ASP 174 Ca 0.01 -1.52 -0.12 0.00 -0.52 0.00 0.00 52.55 50.40 2yuj s ASP 174 Cb 0.10 0.15 0.14 0.00 -1.46 0.00 0.00 42.92 41.86 2yuj s ASP 174 CO 0.74 -0.72 1.80 0.07 0.52 0.00 0.00 175.17 177.58 2yuj h LYS 175 N 1.77 0.56 -5.33 4.34 2.10 -1.93 -3.38 116.57 114.70 2yuj h LYS 175 Ca -0.41 -0.03 -0.65 0.00 -2.00 0.00 0.00 60.65 57.56 2yuj h LYS 175 Cb 1.27 -0.13 -0.15 0.00 -0.90 0.00 0.00 32.23 32.32 2yuj h LYS 175 CO 0.70 0.37 0.06 0.00 -2.00 0.00 0.00 179.45 178.58 2yuj s ALA 176 N -6.13 3.39 -0.00 0.07 0.00 -1.26 -3.48 121.76 114.35 2yuj s ALA 176 Ca -0.13 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 50.72 2yuj s ALA 176 Cb 0.14 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 2yuj s ALA 176 CO 0.74 -1.60 -0.15 0.14 0.00 0.00 0.00 175.76 174.89 2yuj s VAL 177 N 2.66 1.18 -0.92 0.00 -7.23 -1.19 -4.67 120.40 110.23 2yuj s VAL 177 Ca 0.21 -0.68 -0.14 0.00 -1.81 0.00 0.00 61.98 59.56 2yuj s VAL 177 Cb -0.15 -0.99 0.21 0.00 0.56 0.00 0.00 36.38 36.02 2yuj s VAL 177 CO 0.17 0.30 0.93 -0.55 -0.31 0.00 0.00 175.10 175.63 2yuj s SER 178 N -0.45 6.87 -1.18 4.85 0.15 -0.08 -2.28 113.70 121.57 2yuj s SER 178 Ca 0.05 -2.77 -0.18 0.00 0.70 0.00 0.00 55.95 53.75 2yuj s SER 178 Cb -0.06 -2.25 0.10 0.00 -1.71 0.00 0.00 66.02 62.10 2yuj s SER 178 CO -0.00 -0.61 1.54 0.27 1.20 0.00 0.00 173.24 175.64 2yuj s ILE 179 N 0.38 4.40 -0.57 6.45 -4.36 0.24 -3.46 121.20 124.27 2yuj s ILE 179 Ca 0.24 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 58.79 2yuj s ILE 179 Cb -0.09 -5.05 0.14 0.00 1.25 0.00 0.00 42.46 38.71 2yuj s ILE 179 CO -0.08 -1.85 0.33 -0.63 0.24 0.00 0.00 174.94 172.95 2yuj s ILE 180 N 3.48 2.92 -0.32 8.37 1.01 -1.26 -4.56 121.20 130.85 2yuj s ILE 180 Ca 0.47 -3.31 -0.03 0.00 0.00 0.00 0.00 60.65 57.79 2yuj s ILE 180 Cb 0.00 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.50 2yuj s ILE 180 CO 0.01 -0.84 0.09 -0.62 0.00 0.00 0.00 174.94 173.58 2yuj n GLU 181 N 3.11 -3.21 -3.82 2.79 4.71 -1.26 -5.07 120.64 117.89 2yuj n GLU 181 Ca 0.07 2.61 -0.05 0.00 -0.01 0.00 0.00 57.16 59.78 2yuj n GLU 181 Cb 0.34 -5.28 -0.00 0.00 -1.01 0.00 0.00 31.44 25.49 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2yuj s ASP 183 N -3.06 3.94 0.30 0.00 1.11 -1.26 -5.10 116.67 112.60 2yuj s ASP 183 Ca 0.15 -0.47 0.03 0.00 0.18 0.00 0.00 52.55 52.44 2yuj s ASP 183 Cb -0.03 -1.66 -0.04 0.00 1.07 0.00 0.00 42.92 42.26 2yuj s ASP 183 CO 0.06 -0.01 0.15 0.00 1.18 0.00 0.00 175.17 176.55 2yuj s MET 184 N 1.41 1.59 -0.55 8.23 0.23 -1.26 -4.93 119.30 124.02 2yuj s MET 184 Ca 0.05 -1.91 -0.10 0.00 -1.03 0.00 0.00 55.69 52.70 2yuj s MET 184 Cb -0.14 -0.15 0.14 0.00 -1.53 0.00 0.00 34.83 33.15 2yuj s MET 184 CO -0.06 -0.43 0.44 1.21 -2.03 0.00 0.00 175.02 174.15 2yuj s ASN 185 N -3.38 5.89 0.33 -1.18 2.47 0.93 -5.00 114.94 114.99 2yuj s ASN 185 Ca 0.35 -2.09 -0.24 0.00 0.42 0.00 0.00 52.86 51.30 2yuj s ASN 185 Cb 0.05 -2.06 -0.10 0.00 -1.45 0.00 0.00 41.25 37.70 2yuj s ASN 185 CO 0.17 -0.68 0.91 -0.69 -3.72 0.00 0.00 177.10 173.09 2yuj s VAL 186 N 1.10 4.30 0.33 -5.21 1.01 -1.26 -2.89 120.40 117.78 2yuj s VAL 186 Ca 0.08 1.67 0.04 0.00 0.00 0.00 0.00 61.98 63.77 2yuj s VAL 186 Cb -0.24 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 2yuj s VAL 186 CO -0.01 0.07 0.05 -0.62 0.00 0.00 0.00 175.10 174.58 2yuj s ASP 187 N -1.73 2.50 0.02 3.32 -1.08 0.15 -4.91 116.67 114.94 2yuj s ASP 187 Ca 0.51 -1.37 0.06 0.00 -0.52 0.00 0.00 52.55 51.23 2yuj s ASP 187 Cb -0.17 -0.11 -0.02 0.00 -1.46 0.00 0.00 42.92 41.16 2yuj s ASP 187 CO 0.21 -0.58 -0.17 -0.36 0.52 0.00 0.00 175.17 174.79 2yuj s PHE 188 N -3.24 1.49 -0.32 -5.34 0.08 -1.26 -3.45 117.98 105.94 2yuj s PHE 188 Ca 0.36 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 57.07 2yuj s PHE 188 Cb 0.09 -0.92 0.11 0.00 -0.57 0.00 0.00 43.02 41.73 2yuj s PHE 188 CO 0.16 0.03 0.14 0.34 -0.10 0.00 0.00 175.22 175.78 2yuj s ASP 189 N -0.84 3.73 0.00 1.36 2.15 -1.11 -4.98 116.67 116.98 2yuj s ASP 189 Ca 0.05 -1.71 0.00 0.00 0.43 0.00 0.00 52.55 51.32 2yuj s ASP 189 Cb -0.07 -0.68 0.00 0.00 -0.30 0.00 0.00 42.92 41.86 2yuj s ASP 189 CO 0.01 -0.39 0.00 0.00 -0.17 0.00 0.00 175.17 174.61