#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 2.32 -2.45 1.61 7.64 -1.26 -4.57 113.62 116.92 2yuj n SER 2 Ca 0.00 -2.05 -0.02 0.00 1.01 0.00 0.00 58.87 57.81 2yuj n SER 2 Cb 0.00 0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 2yuj n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yuj n SER 3 N -1.52 -5.72 0.00 6.43 7.64 -1.26 -4.73 113.62 114.46 2yuj n SER 3 Ca -0.06 1.66 0.00 0.00 1.01 0.00 0.00 58.87 61.47 2yuj n SER 3 Cb 0.32 -5.25 0.00 0.00 -1.01 0.00 0.00 64.21 58.27 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 1.78 1.63 3.65 0.23 0.00 -1.26 -4.89 105.19 106.34 2yuj n GLY 4 Ca -0.18 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 2yuj n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuj s SER 5 N -4.00 1.21 -0.30 1.61 0.01 -1.26 -5.09 113.70 105.88 2yuj s SER 5 Ca 0.00 0.53 -0.14 0.00 1.31 0.00 0.00 55.95 57.65 2yuj s SER 5 Cb 0.00 -0.71 0.16 0.00 0.21 0.00 0.00 66.02 65.68 2yuj s SER 5 CO 0.00 -3.93 0.93 -0.55 0.41 0.00 0.00 173.24 170.10 2yuj s SER 6 N -4.10 -0.66 0.65 2.44 0.15 -1.26 -4.53 113.70 106.38 2yuj s SER 6 Ca 0.72 0.92 0.00 0.00 0.70 0.00 0.00 55.95 58.29 2yuj s SER 6 Cb -0.08 1.71 0.00 0.00 -1.71 0.00 0.00 66.02 65.94 2yuj s SER 6 CO 0.55 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.47 2yuj n GLY 7 N 4.92 0.56 2.49 9.45 0.00 -1.26 -4.60 105.19 116.75 2yuj n GLY 7 Ca -0.10 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 0.07 0.09 -0.61 -4.36 -1.26 -5.11 121.20 110.02 2yuj s ILE 8 Ca 0.00 -1.50 -0.31 0.00 -0.26 0.00 0.00 60.65 58.58 2yuj s ILE 8 Cb 0.00 -1.07 -0.08 0.00 1.25 0.00 0.00 42.46 42.56 2yuj s ILE 8 CO 0.00 -0.92 1.46 -2.16 0.24 0.00 0.00 174.94 173.56 2yuj s PRO 9 N 1.28 4.28 -0.31 0.37 0.04 -1.26 -5.00 135.00 134.38 2yuj s PRO 9 Ca 0.16 2.13 -0.08 0.00 0.04 0.00 0.00 61.00 63.25 2yuj s PRO 9 Cb -0.21 -3.37 0.01 0.00 0.04 0.00 0.00 34.50 30.96 2yuj s PRO 9 CO -0.06 -0.54 0.12 0.50 0.04 0.00 0.00 177.00 177.06 2yuj s ARG 10 N 1.69 3.09 0.03 4.56 6.06 -1.26 -5.08 118.95 128.03 2yuj s ARG 10 Ca 0.67 -0.87 0.01 0.00 -2.50 0.00 0.00 55.73 53.03 2yuj s ARG 10 Cb -0.37 -3.49 -0.02 0.00 0.06 0.00 0.00 34.95 31.13 2yuj s ARG 10 CO 0.30 -0.49 -0.05 0.14 -2.50 0.00 0.00 175.30 172.70 2yuj s VAL 11 N 1.53 0.27 0.00 7.11 -7.23 -1.26 -5.05 120.40 115.77 2yuj s VAL 11 Ca 0.03 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 2yuj s VAL 11 Cb -0.18 -0.38 0.00 0.00 0.56 0.00 0.00 36.38 36.38 2yuj s VAL 11 CO 0.04 -0.42 0.00 0.33 -0.31 0.00 0.00 175.10 174.75 2yuj n PHE 12 N 1.66 0.00 -3.54 2.82 7.35 -1.26 -5.08 117.46 119.41 2yuj n PHE 12 Ca -0.23 0.00 -0.38 0.00 -0.76 0.00 0.00 57.45 56.08 2yuj n PHE 12 Cb 0.55 0.21 -0.06 0.00 0.35 0.00 0.00 39.48 40.53 2yuj n PHE 12 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2yuj s GLN 13 N -1.80 3.88 0.35 -4.13 -1.52 -1.26 -5.09 119.66 110.08 2yuj s GLN 13 Ca 0.00 0.34 0.03 0.00 -1.95 0.00 0.00 55.36 53.78 2yuj s GLN 13 Cb 0.00 -3.23 -0.01 0.00 -0.22 0.00 0.00 33.01 29.55 2yuj s GLN 13 CO 0.00 0.68 0.12 0.09 -0.25 0.00 0.00 175.29 175.93 2yuj n ASN 14 N 1.93 1.19 -1.21 5.90 4.13 -1.26 -5.11 115.26 120.83 2yuj n ASN 14 Ca -0.14 -2.84 0.15 0.00 1.68 0.00 0.00 54.58 53.43 2yuj n ASN 14 Cb 0.53 0.87 -0.06 0.00 -1.54 0.00 0.00 39.78 39.57 2yuj n ASN 14 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2yuj n ARG 15 N -0.78 -2.69 -4.22 3.52 1.74 -1.26 -4.89 116.66 108.08 2yuj n ARG 15 Ca -0.05 2.07 -0.35 0.00 -0.77 0.00 0.00 57.85 58.75 2yuj n ARG 15 Cb 0.52 -3.19 -0.08 0.00 -1.02 0.00 0.00 32.46 28.69 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 -3.36 3.25 -0.30 -1.55 5.36 -1.26 -4.98 117.98 115.14 2yuj s PHE 16 Ca 0.00 0.24 -0.09 0.00 -0.96 0.00 0.00 56.93 56.13 2yuj s PHE 16 Cb 0.00 -1.79 0.14 0.00 -0.34 0.00 0.00 43.02 41.03 2yuj s PHE 16 CO 0.00 0.53 0.64 -1.54 -1.46 0.00 0.00 175.22 173.39 2yuj s SER 17 N -1.17 -1.19 -0.19 6.13 1.04 -1.26 -2.88 113.70 114.18 2yuj s SER 17 Ca 0.16 1.47 -0.35 0.00 0.48 0.00 0.00 55.95 57.71 2yuj s SER 17 Cb -0.12 2.29 0.14 0.00 0.10 0.00 0.00 66.02 68.43 2yuj s SER 17 CO 0.06 -0.23 1.26 0.28 0.98 0.00 0.00 173.24 175.59 2yuj s THR 18 N 2.89 0.00 0.12 2.02 -1.32 -1.24 -5.02 115.64 113.09 2yuj s THR 18 Ca -0.02 -0.02 -0.15 0.00 -1.21 0.00 0.00 61.69 60.29 2yuj s THR 18 Cb -0.12 -1.12 -0.07 0.00 -1.51 0.00 0.00 72.50 69.67 2yuj s THR 18 CO -0.19 0.00 0.55 -1.10 -2.21 0.00 0.00 174.62 171.67 2yuj s GLN 19 N -2.32 4.03 -0.07 7.08 -0.21 -1.26 -1.19 119.66 125.72 2yuj s GLN 19 Ca 0.11 0.55 -0.05 0.00 0.02 0.00 0.00 55.36 55.99 2yuj s GLN 19 Cb -0.00 -3.01 0.02 0.00 1.00 0.00 0.00 33.01 31.02 2yuj s GLN 19 CO -0.04 0.52 0.16 0.71 -2.12 0.00 0.00 175.29 174.53 2yuj s TYR 20 N -1.37 -0.19 0.70 0.91 2.02 -0.17 -4.87 117.35 114.38 2yuj s TYR 20 Ca 0.35 0.48 -0.13 0.00 -0.37 0.00 0.00 57.07 57.40 2yuj s TYR 20 Cb -0.16 0.02 0.02 0.00 -0.40 0.00 0.00 41.96 41.44 2yuj s TYR 20 CO 0.19 -0.12 1.08 1.03 -1.57 0.00 0.00 175.55 176.16 2yuj s ARG 21 N 0.49 2.71 -0.09 -0.62 0.52 -1.26 0.15 118.95 120.84 2yuj s ARG 21 Ca -0.03 1.19 0.04 0.00 -0.52 0.00 0.00 55.73 56.41 2yuj s ARG 21 Cb -0.05 -1.95 -0.00 0.00 0.52 0.00 0.00 34.95 33.47 2yuj s ARG 21 CO -0.02 -1.30 -0.24 0.00 0.02 0.00 0.00 175.30 173.76 2yuj s PHE 23 N 0.27 1.24 0.21 0.00 0.08 0.64 -2.47 117.98 117.95 2yuj s PHE 23 Ca -0.17 -1.14 -0.30 0.00 0.12 0.00 0.00 56.93 55.44 2yuj s PHE 23 Cb -0.17 -0.70 -0.08 0.00 -0.57 0.00 0.00 43.02 41.49 2yuj s PHE 23 CO 0.08 -0.35 0.97 -1.12 -0.10 0.00 0.00 175.22 174.71 2yuj s SER 24 N -3.19 7.55 0.59 1.36 0.01 -1.26 -1.05 113.70 117.71 2yuj s SER 24 Ca 0.30 1.96 0.39 0.00 1.31 0.00 0.00 55.95 59.90 2yuj s SER 24 Cb 0.07 -2.61 1.95 0.00 0.21 0.00 0.00 66.02 65.64 2yuj s SER 24 CO 0.07 0.06 2.17 -0.37 0.41 0.00 0.00 173.24 175.58 2yuj h VAL 25 N 3.37 0.00 0.00 3.43 -1.51 -1.87 -1.73 116.25 117.94 2yuj h VAL 25 Ca -0.45 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.86 2yuj h VAL 25 Cb 1.20 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 2yuj h VAL 25 CO 0.69 0.00 0.00 -1.20 -1.23 0.00 0.00 177.57 175.83 2yuj n SER 26 N -2.98 0.34 -1.34 4.19 7.64 -1.26 -2.16 113.62 118.06 2yuj n SER 26 Ca -0.02 0.60 0.04 0.00 1.01 0.00 0.00 58.87 60.50 2yuj n SER 26 Cb 0.15 -0.67 0.24 0.00 -1.01 0.00 0.00 64.21 62.92 2yuj n SER 26 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2yuj n MET 27 N -1.90 3.31 -3.25 1.43 2.00 -0.65 -4.47 117.12 113.59 2yuj n MET 27 Ca 0.02 -1.87 -0.24 0.00 0.00 0.00 0.00 57.70 55.60 2yuj n MET 27 Cb 0.16 -1.96 -0.08 0.00 0.00 0.00 0.00 33.22 31.35 2yuj n MET 27 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2yuj n LEU 28 N 0.36 -0.36 0.00 4.03 -0.00 -0.92 -5.08 117.00 115.03 2yuj n LEU 28 Ca 0.17 -4.44 -0.02 0.00 -0.00 0.00 0.00 56.01 51.72 2yuj n LEU 28 Cb 0.82 0.61 0.01 0.00 -0.00 0.00 0.00 43.42 44.86 2yuj n LEU 28 CO 0.20 1.97 0.04 0.00 -0.00 0.00 0.00 177.39 179.59 2yuj n ALA 29 N 2.13 -0.01 0.00 1.96 0.00 -1.26 -5.08 120.51 118.25 2yuj n ALA 29 Ca 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2yuj n ALA 29 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2yuj n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yuj n GLY 30 N 4.49 -0.58 0.44 0.00 0.00 -1.26 -4.97 105.19 103.31 2yuj n GLY 30 Ca 0.01 -0.71 0.26 0.00 0.00 0.00 0.00 46.02 45.58 2yuj n GLY 30 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2yuj h PRO 31 N 0.00 0.00 -4.72 1.61 0.11 -2.08 -3.42 132.00 123.50 2yuj h PRO 31 Ca 0.00 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.83 2yuj h PRO 31 Cb 0.00 -0.00 -0.15 0.00 0.11 0.00 0.00 31.00 30.96 2yuj h PRO 31 CO 0.00 0.00 -0.63 -0.80 -0.21 0.00 0.00 178.00 176.36 2yuj s ASN 32 N -5.82 0.80 -0.21 -2.05 0.01 -1.26 -5.09 114.94 101.32 2yuj s ASN 32 Ca -0.05 -1.31 -0.14 0.00 -0.71 0.00 0.00 52.86 50.66 2yuj s ASN 32 Cb 0.21 0.23 -0.09 0.00 0.41 0.00 0.00 41.25 42.01 2yuj s ASN 32 CO 0.76 -0.72 -0.32 -0.67 -1.51 0.00 0.00 177.10 174.64 2yuj n ASP 33 N -0.31 1.78 -2.38 -1.22 2.03 -1.26 -4.93 116.55 110.27 2yuj n ASP 33 Ca -0.02 0.30 -0.01 0.00 0.52 0.00 0.00 54.79 55.59 2yuj n ASP 33 Cb 0.65 -0.72 -0.00 0.00 -0.72 0.00 0.00 41.12 40.33 2yuj n ASP 33 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2yuj n ARG 34 N -4.20 -5.17 -0.85 -0.67 5.12 -1.26 -4.86 116.66 104.77 2yuj n ARG 34 Ca -0.36 3.76 -0.03 0.00 -1.93 0.00 0.00 57.85 59.29 2yuj n ARG 34 Cb 0.71 -4.78 0.27 0.00 -1.16 0.00 0.00 32.46 27.51 2yuj n ARG 34 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 2yuj n SER 35 N 1.83 4.51 -0.02 0.55 7.64 -1.26 -4.15 113.62 122.72 2yuj n SER 35 Ca -0.04 -2.98 -0.07 0.00 1.01 0.00 0.00 58.87 56.79 2yuj n SER 35 Cb 0.06 -0.70 -0.13 0.00 -1.01 0.00 0.00 64.21 62.43 2yuj n SER 35 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2yuj n ASP 36 N 0.04 0.78 -0.14 6.43 5.68 -1.26 -3.93 116.55 124.15 2yuj n ASP 36 Ca 0.33 0.37 0.03 0.00 -0.50 0.00 0.00 54.79 55.02 2yuj n ASP 36 Cb 1.20 0.09 0.33 0.00 -1.14 0.00 0.00 41.12 41.60 2yuj n ASP 36 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 2yuj h VAL 37 N 0.00 1.12 -0.22 2.12 2.07 -1.93 -2.13 116.25 117.28 2yuj h VAL 37 Ca -0.29 -0.27 -0.19 0.00 0.82 0.00 0.00 66.70 66.77 2yuj h VAL 37 Cb 1.95 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2yuj h VAL 37 CO 0.07 0.15 -0.61 -0.33 0.02 0.00 0.00 177.57 176.87 2yuj h GLU 38 N 0.80 0.75 -5.31 1.57 5.08 -1.86 -3.37 114.58 112.24 2yuj h GLU 38 Ca 0.25 -0.51 -0.71 0.00 -1.00 0.00 0.00 59.36 57.39 2yuj h GLU 38 Cb 0.01 0.07 -0.12 0.00 0.50 0.00 0.00 28.75 29.21 2yuj h GLU 38 CO -0.06 1.14 1.89 1.63 -1.00 0.00 0.00 179.01 182.60 2yuj n LYS 39 N -3.97 3.27 0.00 2.33 5.02 -0.80 -4.85 118.16 119.16 2yuj n LYS 39 Ca -0.05 -3.50 0.00 0.00 -2.02 0.00 0.00 58.31 52.74 2yuj n LYS 39 Cb 0.65 -3.30 0.00 0.00 -0.02 0.00 0.00 35.03 32.37 2yuj n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2yuj n GLY 40 N 4.77 -0.38 2.04 0.72 0.00 -1.26 -4.93 105.19 106.15 2yuj n GLY 40 Ca 0.44 -1.37 -0.26 0.00 0.00 0.00 0.00 46.02 44.83 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 -1.11 5.84 3.79 -0.02 0.00 -1.22 -4.94 105.19 107.53 2yuj n GLY 41 Ca 0.00 -2.20 -0.27 0.00 0.00 0.00 0.00 46.02 43.55 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 -3.63 2.91 0.34 1.61 3.01 -1.26 -2.56 119.74 120.16 2yuj s LYS 42 Ca 0.56 -0.81 0.08 0.00 -1.01 0.00 0.00 55.97 54.79 2yuj s LYS 42 Cb 0.46 -2.67 -0.03 0.00 -1.01 0.00 0.00 37.83 34.57 2yuj s LYS 42 CO 0.02 0.51 0.28 0.96 0.51 0.00 0.00 175.35 177.63 2yuj s ILE 43 N -1.65 0.02 -0.05 2.17 -4.36 -0.88 -4.69 121.20 111.76 2yuj s ILE 43 Ca 0.31 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.75 2yuj s ILE 43 Cb -0.11 -2.49 -0.01 0.00 1.25 0.00 0.00 42.46 41.10 2yuj s ILE 43 CO 0.23 0.00 -0.22 -0.63 0.24 0.00 0.00 174.94 174.56 2yuj s ILE 44 N -3.39 1.79 0.10 8.37 1.01 -1.19 -2.31 121.20 125.58 2yuj s ILE 44 Ca 0.40 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2yuj s ILE 44 Cb 0.02 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 2yuj s ILE 44 CO 0.28 0.50 -0.02 -0.04 0.00 0.00 0.00 174.94 175.66 2yuj s MET 45 N -0.16 0.81 0.50 2.79 -1.94 -1.08 -2.33 119.30 117.89 2yuj s MET 45 Ca -0.02 -1.34 -0.22 0.00 -1.71 0.00 0.00 55.69 52.41 2yuj s MET 45 Cb -0.12 -0.00 -0.09 0.00 2.01 0.00 0.00 34.83 36.63 2yuj s MET 45 CO 0.02 -0.10 0.91 -2.30 -0.01 0.00 0.00 175.02 173.54 2yuj n PRO 46 N -0.03 1.07 0.08 2.03 -0.02 -1.26 -3.02 135.00 133.86 2yuj n PRO 46 Ca -0.11 0.40 0.20 0.00 -2.02 0.00 0.00 63.50 61.97 2yuj n PRO 46 Cb 0.62 -2.02 0.75 0.00 -0.02 0.00 0.00 33.50 32.82 2yuj n PRO 46 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2yuj h PRO 47 N 1.02 0.00 -0.92 0.52 0.11 -1.70 -0.84 132.00 130.18 2yuj h PRO 47 Ca -0.46 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.69 2yuj h PRO 47 Cb 1.36 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.41 2yuj h PRO 47 CO 0.53 0.00 0.61 1.03 -0.21 0.00 0.00 178.00 179.96 2yuj h SER 48 N 0.00 0.99 -0.06 -2.05 0.87 -1.90 -1.19 113.55 110.21 2yuj h SER 48 Ca 0.20 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2yuj h SER 48 Cb 1.00 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 2yuj h SER 48 CO -0.00 0.67 0.02 0.00 -0.53 0.00 0.00 176.83 176.99 2yuj h ALA 49 N 1.47 1.85 0.10 6.23 0.00 -1.48 0.12 119.26 127.54 2yuj h ALA 49 Ca 0.37 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2yuj h ALA 49 Cb 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2yuj h ALA 49 CO -0.12 0.12 -0.05 1.25 0.00 0.00 0.00 179.25 180.45 2yuj h LEU 50 N 0.14 -0.12 -0.76 0.00 5.85 -1.32 -2.45 115.31 116.66 2yuj h LEU 50 Ca 0.04 -0.20 -0.13 0.00 0.84 0.00 0.00 57.88 58.43 2yuj h LEU 50 Cb 0.06 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 2yuj h LEU 50 CO -0.00 0.14 -0.60 -0.78 -0.34 0.00 0.00 178.44 176.85 2yuj h ASP 51 N -0.37 0.00 0.02 1.25 1.82 -1.40 -3.23 116.42 114.51 2yuj h ASP 51 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 2yuj h ASP 51 Cb 0.31 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.32 2yuj h ASP 51 CO 0.02 0.60 -0.02 -0.61 -1.61 0.00 0.00 179.24 177.62 2yuj h GLN 52 N 0.00 -0.04 -0.90 0.28 5.75 -0.67 0.12 115.11 119.64 2yuj h GLN 52 Ca -0.01 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.58 2yuj h GLN 52 Cb 1.09 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.59 2yuj h GLN 52 CO 0.08 -0.03 0.58 -0.07 -2.65 0.00 0.00 178.83 176.74 2yuj h LEU 53 N -0.05 0.84 -0.50 -2.39 3.38 -1.46 0.24 115.31 115.37 2yuj h LEU 53 Ca 0.00 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2yuj h LEU 53 Cb 0.05 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2yuj h LEU 53 CO -0.01 0.51 -0.58 -1.28 0.09 0.00 0.00 178.44 177.17 2yuj h SER 54 N 0.94 0.00 1.38 -0.43 0.87 -1.48 0.24 113.55 115.07 2yuj h SER 54 Ca 0.40 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.85 2yuj h SER 54 Cb 0.32 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 2yuj h SER 54 CO -0.17 0.58 -0.63 0.03 -0.53 0.00 0.00 176.83 176.11 2yuj h ARG 55 N 0.00 0.00 -0.67 2.24 2.47 0.88 -3.23 114.38 116.07 2yuj h ARG 55 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2yuj h ARG 55 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 2yuj h ARG 55 CO 0.08 0.47 0.00 1.28 0.56 0.00 0.00 179.97 182.35 2yuj n LEU 56 N -3.17 4.68 -3.79 3.04 4.77 0.68 -4.91 117.00 118.29 2yuj n LEU 56 Ca 0.00 -2.37 -0.26 0.00 -0.03 0.00 0.00 56.01 53.35 2yuj n LEU 56 Cb 0.75 -0.64 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2yuj n LEU 56 CO 0.41 0.55 0.03 0.59 -1.33 0.00 0.00 177.39 177.64 2yuj n ASN 57 N 0.51 -3.13 -4.55 -1.43 3.02 -1.20 -4.60 115.26 103.88 2yuj n ASN 57 Ca 0.22 -0.79 -0.34 0.00 -0.03 0.00 0.00 54.58 53.64 2yuj n ASN 57 Cb 0.98 -4.03 -0.11 0.00 -0.61 0.00 0.00 39.78 36.01 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2yuj s ILE 58 N -3.48 4.18 0.43 2.41 1.01 0.83 -5.04 121.20 121.54 2yuj s ILE 58 Ca 0.34 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.80 2yuj s ILE 58 Cb -0.17 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 2yuj s ILE 58 CO 0.82 0.49 0.20 0.42 0.00 0.00 0.00 174.94 176.87 2yuj s THR 59 N 0.31 2.25 0.38 2.92 -4.23 -1.26 -4.39 115.64 111.61 2yuj s THR 59 Ca -0.01 -1.67 -0.28 0.00 -1.18 0.00 0.00 61.69 58.55 2yuj s THR 59 Cb -0.13 -2.92 -0.11 0.00 1.34 0.00 0.00 72.50 70.68 2yuj s THR 59 CO 0.02 0.00 1.46 -0.47 -0.54 0.00 0.00 174.62 175.09 2yuj s TYR 60 N -2.61 2.62 0.90 3.99 5.04 -1.26 -4.25 117.35 121.77 2yuj s TYR 60 Ca 0.40 1.20 -0.13 0.00 -2.44 0.00 0.00 57.07 56.10 2yuj s TYR 60 Cb 0.03 -3.98 0.13 0.00 0.35 0.00 0.00 41.96 38.50 2yuj s TYR 60 CO 0.22 -2.87 1.17 -1.25 -1.34 0.00 0.00 175.55 171.48 2yuj s PRO 61 N -2.11 1.21 -0.30 4.97 0.04 -1.26 -5.12 135.00 132.43 2yuj s PRO 61 Ca 0.53 0.13 0.12 0.00 0.04 0.00 0.00 61.00 61.82 2yuj s PRO 61 Cb -0.45 -1.86 0.47 0.00 0.04 0.00 0.00 34.50 32.69 2yuj s PRO 61 CO 0.61 -2.12 1.15 -1.33 0.04 0.00 0.00 177.00 175.35 2yuj n MET 62 N -3.68 2.97 -1.16 4.56 2.81 -1.26 -4.98 117.12 116.38 2yuj n MET 62 Ca 0.08 -3.99 -0.30 0.00 -1.81 0.00 0.00 57.70 51.69 2yuj n MET 62 Cb 0.60 -2.04 0.13 0.00 -0.71 0.00 0.00 33.22 31.20 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 -3.62 2.38 0.11 4.03 1.43 -1.26 -4.14 118.68 117.61 2yuj s LEU 63 Ca 0.43 1.59 0.05 0.00 -1.03 0.00 0.00 54.13 55.17 2yuj s LEU 63 Cb 0.39 -4.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2yuj s LEU 63 CO -0.01 -2.61 -0.13 -0.36 0.23 0.00 0.00 176.35 173.47 2yuj s PHE 64 N -2.90 1.30 -0.78 0.29 0.08 -0.60 -2.78 117.98 112.59 2yuj s PHE 64 Ca 0.63 -0.56 -0.14 0.00 0.12 0.00 0.00 56.93 56.98 2yuj s PHE 64 Cb -0.18 -0.69 0.20 0.00 -0.57 0.00 0.00 43.02 41.78 2yuj s PHE 64 CO 0.57 0.10 0.72 0.21 -0.10 0.00 0.00 175.22 176.72 2yuj s LYS 65 N -2.52 3.49 -1.24 0.44 2.20 0.24 -2.97 119.74 119.38 2yuj s LYS 65 Ca 0.06 -2.31 -0.20 0.00 -0.36 0.00 0.00 55.97 53.16 2yuj s LYS 65 Cb -0.05 -4.41 -0.01 0.00 -1.51 0.00 0.00 37.83 31.85 2yuj s LYS 65 CO 0.02 -1.31 1.85 1.28 -0.36 0.00 0.00 175.35 176.84 2yuj n LEU 66 N 4.25 4.26 -4.53 5.43 4.77 0.04 -4.05 117.00 127.16 2yuj n LEU 66 Ca 0.09 -3.59 -0.41 0.00 -0.03 0.00 0.00 56.01 52.07 2yuj n LEU 66 Cb 0.46 -1.71 -0.03 0.00 -2.33 0.00 0.00 43.42 39.80 2yuj n LEU 66 CO 0.37 -0.61 1.11 -0.89 -1.33 0.00 0.00 177.39 176.04 2yuj s THR 67 N 6.94 3.86 -0.11 -5.08 2.01 -1.22 -2.64 115.64 119.40 2yuj s THR 67 Ca 0.60 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.46 2yuj s THR 67 Cb 0.03 -4.88 -0.03 0.00 0.01 0.00 0.00 72.50 67.62 2yuj s THR 67 CO 0.10 -1.79 1.45 0.21 -0.69 0.00 0.00 174.62 173.90 2yuj s ASN 68 N 3.81 6.81 -0.43 3.53 2.47 -1.08 -4.06 114.94 126.00 2yuj s ASN 68 Ca 0.33 1.96 0.03 0.00 0.42 0.00 0.00 52.86 55.60 2yuj s ASN 68 Cb -0.09 -2.54 0.61 0.00 -1.45 0.00 0.00 41.25 37.78 2yuj s ASN 68 CO 0.12 -0.83 1.86 0.29 -3.72 0.00 0.00 177.10 174.82 2yuj n LYS 69 N 6.79 2.18 -0.04 0.43 5.02 -1.26 -2.62 118.16 128.66 2yuj n LYS 69 Ca 0.15 -2.79 -0.06 0.00 -2.02 0.00 0.00 58.31 53.59 2yuj n LYS 69 Cb 0.44 -2.09 -0.05 0.00 -0.02 0.00 0.00 35.03 33.31 2yuj n LYS 69 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2yuj n ASN 70 N -1.01 3.27 -0.62 4.39 4.13 -1.26 -4.76 115.26 119.40 2yuj n ASN 70 Ca 0.56 -0.04 0.04 0.00 1.68 0.00 0.00 54.58 56.82 2yuj n ASN 70 Cb 1.54 0.07 0.07 0.00 -1.54 0.00 0.00 39.78 39.91 2yuj n ASN 70 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2yuj n SER 71 N -2.64 1.04 -3.74 6.41 7.64 -1.26 -4.99 113.62 116.08 2yuj n SER 71 Ca -0.15 -2.54 -0.28 0.00 1.01 0.00 0.00 58.87 56.91 2yuj n SER 71 Cb 0.69 -0.32 0.04 0.00 -1.01 0.00 0.00 64.21 63.60 2yuj n SER 71 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2yuj n ASP 72 N -0.41 -5.23 -4.92 6.43 2.03 -1.21 -4.98 116.55 108.27 2yuj n ASP 72 Ca 0.08 -0.66 -0.21 0.00 0.52 0.00 0.00 54.79 54.52 2yuj n ASP 72 Cb 0.78 -4.17 0.05 0.00 -0.72 0.00 0.00 41.12 37.07 2yuj n ASP 72 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2yuj s ARG 73 N -6.45 2.36 -0.26 -0.67 0.52 -1.08 -4.99 118.95 108.38 2yuj s ARG 73 Ca 0.61 -0.98 -0.12 0.00 -0.52 0.00 0.00 55.73 54.72 2yuj s ARG 73 Cb -0.30 -2.50 0.10 0.00 0.52 0.00 0.00 34.95 32.77 2yuj s ARG 73 CO 0.75 -0.84 0.60 1.41 0.02 0.00 0.00 175.30 177.24 2yuj s MET 74 N -4.79 0.57 0.04 3.54 -2.45 -1.26 -2.62 119.30 112.32 2yuj s MET 74 Ca 0.59 1.23 -0.01 0.00 -1.25 0.00 0.00 55.69 56.26 2yuj s MET 74 Cb -0.09 0.42 -0.03 0.00 1.25 0.00 0.00 34.83 36.38 2yuj s MET 74 CO 0.39 -0.18 -0.02 0.99 1.05 0.00 0.00 175.02 177.24 2yuj s THR 75 N 2.21 0.17 -0.23 10.11 2.01 -1.08 -4.87 115.64 123.96 2yuj s THR 75 Ca -0.07 -1.41 -0.01 0.00 0.31 0.00 0.00 61.69 60.51 2yuj s THR 75 Cb -0.09 -0.98 0.06 0.00 0.01 0.00 0.00 72.50 71.50 2yuj s THR 75 CO -0.18 -0.78 -0.00 -1.00 -0.69 0.00 0.00 174.62 171.97 2yuj s HIS 76 N -2.87 1.83 0.12 4.92 3.76 -1.26 -0.78 115.29 121.01 2yuj s HIS 76 Ca -0.03 -1.44 0.09 0.00 -0.15 0.00 0.00 55.06 53.54 2yuj s HIS 76 Cb 0.00 -1.41 -0.04 0.00 1.11 0.00 0.00 32.58 32.25 2yuj s HIS 76 CO -0.06 -0.72 -0.19 0.00 -0.85 0.00 0.00 174.74 172.92 2yuj s GLY 78 N -2.12 1.93 0.06 0.00 0.00 -1.06 -1.56 107.32 104.58 2yuj s GLY 78 Ca 0.18 -0.76 -0.26 0.00 0.00 0.00 0.00 44.72 43.88 2yuj s GLY 78 CO 0.10 -0.39 0.80 0.54 0.00 0.00 0.00 173.10 174.15 2yuj s VAL 79 N -0.63 4.67 0.05 1.40 0.11 -1.26 -2.07 120.40 122.66 2yuj s VAL 79 Ca 0.11 1.72 -0.02 0.00 -2.93 0.00 0.00 61.98 60.86 2yuj s VAL 79 Cb -0.12 -4.16 -0.01 0.00 -1.53 0.00 0.00 36.38 30.57 2yuj s VAL 79 CO 0.02 0.36 -0.04 -0.11 -3.33 0.00 0.00 175.10 172.01 2yuj n LEU 80 N 2.73 1.00 -4.90 2.54 7.94 -0.98 -4.87 117.00 120.47 2yuj n LEU 80 Ca -0.02 0.13 -0.31 0.00 -1.11 0.00 0.00 56.01 54.71 2yuj n LEU 80 Cb 0.50 -0.32 -0.04 0.00 0.53 0.00 0.00 43.42 44.08 2yuj n LEU 80 CO 0.48 -0.56 0.04 -1.61 -1.11 0.00 0.00 177.39 174.64 2yuj s GLU 81 N -2.09 3.61 -0.45 1.96 0.41 -1.16 -5.05 118.70 115.94 2yuj s GLU 81 Ca -0.03 -0.10 0.09 0.00 -0.41 0.00 0.00 54.97 54.52 2yuj s GLU 81 Cb 0.01 -2.83 0.32 0.00 -1.78 0.00 0.00 34.13 29.85 2yuj s GLU 81 CO 0.05 0.44 0.75 1.19 -0.49 0.00 0.00 175.26 177.19 2yuj n PHE 82 N -0.06 1.40 -2.42 1.61 3.01 -1.26 -2.63 117.46 117.11 2yuj n PHE 82 Ca -0.02 -3.85 0.02 0.00 1.01 0.00 0.00 57.45 54.61 2yuj n PHE 82 Cb 0.52 -0.44 0.05 0.00 -0.01 0.00 0.00 39.48 39.61 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 0.41 0.70 -3.48 -4.37 0.24 -1.18 -3.77 118.33 106.87 2yuj n VAL 83 Ca 0.26 -1.87 -0.24 0.00 -2.04 0.00 0.00 64.34 60.45 2yuj n VAL 83 Cb 0.54 0.78 -0.02 0.00 -1.47 0.00 0.00 33.84 33.68 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 -1.42 3.73 0.80 2.33 0.00 -1.17 -4.95 121.76 121.09 2yuj s ALA 84 Ca 0.34 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 51.29 2yuj s ALA 84 Cb 0.37 -2.07 0.07 0.00 0.00 0.00 0.00 23.12 21.50 2yuj s ALA 84 CO -0.12 0.09 1.10 0.34 0.00 0.00 0.00 175.76 177.17 2yuj s ASP 85 N -3.83 4.22 0.26 0.00 -1.08 -1.26 -4.02 116.67 110.96 2yuj s ASP 85 Ca 0.39 1.85 -0.30 0.00 -0.52 0.00 0.00 52.55 53.98 2yuj s ASP 85 Cb -0.10 -2.51 -0.10 0.00 -1.46 0.00 0.00 42.92 38.76 2yuj s ASP 85 CO 0.34 -2.22 1.37 -1.61 0.52 0.00 0.00 175.17 173.57 2yuj s GLU 86 N -4.87 4.33 -1.37 4.34 0.41 -1.26 -2.59 118.70 117.68 2yuj s GLU 86 Ca 0.62 2.21 0.00 0.00 -0.41 0.00 0.00 54.97 57.39 2yuj s GLU 86 Cb -0.18 -3.12 0.00 0.00 -1.78 0.00 0.00 34.13 29.05 2yuj s GLU 86 CO 0.56 -0.31 0.00 0.41 -0.49 0.00 0.00 175.26 175.43 2yuj n GLY 87 N 1.89 -0.03 2.88 -1.39 0.00 -1.26 -4.98 105.19 102.29 2yuj n GLY 87 Ca 0.05 -0.24 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.75 -0.45 -0.12 -0.61 1.01 -1.07 -4.30 121.20 112.91 2yuj s ILE 88 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.65 2yuj s ILE 88 Cb 0.00 -0.67 -0.01 0.00 0.01 0.00 0.00 42.46 41.78 2yuj s ILE 88 CO 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 174.94 174.69 2yuj s TYR 90 N 0.29 3.65 0.02 0.00 2.02 -0.98 -0.26 117.35 122.08 2yuj s TYR 90 Ca -0.11 0.96 0.00 0.00 -0.37 0.00 0.00 57.07 57.56 2yuj s TYR 90 Cb -0.16 -2.28 -0.02 0.00 -0.40 0.00 0.00 41.96 39.10 2yuj s TYR 90 CO 0.06 0.53 -0.03 -0.51 -1.57 0.00 0.00 175.55 174.03 2yuj s LEU 91 N -1.63 2.19 1.13 -1.29 1.43 -0.22 -3.15 118.68 117.14 2yuj s LEU 91 Ca 0.31 -0.39 -0.19 0.00 -1.03 0.00 0.00 54.13 52.83 2yuj s LEU 91 Cb -0.15 0.03 0.12 0.00 0.03 0.00 0.00 46.19 46.21 2yuj s LEU 91 CO 0.17 -0.21 0.05 -2.65 0.23 0.00 0.00 176.35 173.93 2yuj n PRO 92 N 1.92 -1.70 -0.09 1.29 -0.02 -1.26 -3.08 135.00 132.06 2yuj n PRO 92 Ca -0.21 -0.48 -0.11 0.00 -2.02 0.00 0.00 63.50 60.68 2yuj n PRO 92 Cb 0.56 -1.72 0.02 0.00 -0.02 0.00 0.00 33.50 32.34 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 -2.12 0.99 -0.03 6.00 2.76 -1.96 -1.72 115.15 119.06 2yuj h HIS 93 Ca -0.55 -0.29 -0.14 0.00 -2.20 0.00 0.00 60.37 57.19 2yuj h HIS 93 Cb 1.36 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 30.09 2yuj h HIS 93 CO 0.15 1.08 -0.64 0.11 -1.30 0.00 0.00 177.93 177.33 2yuj h TRP 94 N 0.68 0.16 -0.01 5.26 5.08 -1.94 -2.17 115.95 123.02 2yuj h TRP 94 Ca 0.06 -0.07 -0.17 0.00 1.08 0.00 0.00 58.89 59.80 2yuj h TRP 94 Cb 0.94 -0.03 -0.02 0.00 -3.00 0.00 0.00 29.16 27.06 2yuj h TRP 94 CO 0.05 0.73 -0.76 1.98 -1.28 0.00 0.00 178.44 179.16 2yuj h MET 95 N 0.09 0.09 0.03 0.12 4.05 -1.87 -0.23 114.93 117.20 2yuj h MET 95 Ca -0.01 -0.08 -0.27 0.00 -0.28 0.00 0.00 59.70 59.06 2yuj h MET 95 Cb 1.14 0.02 0.02 0.00 -0.80 0.00 0.00 31.60 31.98 2yuj h MET 95 CO 0.09 0.80 -1.07 0.52 0.23 0.00 0.00 176.91 177.48 2yuj h MET 96 N 0.05 0.63 0.04 0.39 2.86 -1.22 -2.85 114.93 114.83 2yuj h MET 96 Ca -0.02 -0.71 -0.27 0.00 -2.06 0.00 0.00 59.70 56.64 2yuj h MET 96 Cb 1.33 0.21 0.02 0.00 0.06 0.00 0.00 31.60 33.22 2yuj h MET 96 CO 0.11 1.30 -1.09 1.96 1.06 0.00 0.00 176.91 180.24 2yuj h GLN 97 N 0.34 0.60 0.33 1.72 7.50 -1.41 -1.90 115.11 122.28 2yuj h GLN 97 Ca -0.13 -0.70 -0.01 0.00 0.50 0.00 0.00 58.65 58.31 2yuj h GLN 97 Cb 1.73 0.21 0.00 0.00 0.05 0.00 0.00 27.48 29.47 2yuj h GLN 97 CO 0.20 1.29 -0.17 -0.97 -1.50 0.00 0.00 178.83 177.68 2yuj h ASN 98 N 0.31 -0.42 1.02 1.46 -1.24 -1.12 -2.46 115.58 113.13 2yuj h ASN 98 Ca -0.14 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 56.87 2yuj h ASN 98 Cb 1.75 0.12 -0.00 0.00 0.73 0.00 0.00 38.32 40.91 2yuj h ASN 98 CO 0.21 -0.29 -0.10 -0.07 -1.29 0.00 0.00 177.43 175.89 2yuj h LEU 99 N -0.47 0.00 -1.39 0.34 3.38 -1.61 -3.47 115.31 112.09 2yuj h LEU 99 Ca -0.04 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 2yuj h LEU 99 Cb 0.37 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.22 2yuj h LEU 99 CO 0.06 0.10 -0.48 0.18 0.09 0.00 0.00 178.44 178.40 2yuj n LEU 100 N -3.23 -3.15 -4.90 1.67 4.77 -0.75 -4.93 117.00 106.48 2yuj n LEU 100 Ca 0.01 -0.38 -0.32 0.00 -0.03 0.00 0.00 56.01 55.29 2yuj n LEU 100 Cb 0.37 -2.19 -0.05 0.00 -2.33 0.00 0.00 43.42 39.23 2yuj n LEU 100 CO 0.30 0.33 -0.02 -0.76 -1.33 0.00 0.00 177.39 175.91 2yuj s LEU 101 N -4.96 4.30 0.00 2.23 1.43 -0.97 -5.05 118.68 115.66 2yuj s LEU 101 Ca 0.17 0.51 0.08 0.00 -1.03 0.00 0.00 54.13 53.86 2yuj s LEU 101 Cb -0.07 -3.14 0.08 0.00 0.03 0.00 0.00 46.19 43.08 2yuj s LEU 101 CO 0.47 0.11 0.63 -0.62 0.23 0.00 0.00 176.35 177.17 2yuj n GLU 102 N 0.28 0.66 -1.64 1.70 1.02 -1.26 -4.87 120.64 116.53 2yuj n GLU 102 Ca -0.04 -3.07 -0.43 0.00 -0.02 0.00 0.00 57.16 53.60 2yuj n GLU 102 Cb 0.52 -0.03 -0.03 0.00 -0.02 0.00 0.00 31.44 31.88 2yuj n GLU 102 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2yuj s GLU 103 N -4.37 3.48 0.00 3.49 -1.05 -1.26 -2.09 118.70 116.90 2yuj s GLU 103 Ca 0.48 2.22 0.00 0.00 -0.15 0.00 0.00 54.97 57.51 2yuj s GLU 103 Cb -0.04 -4.30 0.00 0.00 -0.44 0.00 0.00 34.13 29.35 2yuj s GLU 103 CO 0.30 -1.71 0.00 0.41 0.95 0.00 0.00 175.26 175.21 2yuj n GLY 104 N 5.34 0.85 3.52 -3.83 0.00 -1.03 -5.01 105.19 105.02 2yuj n GLY 104 Ca 0.26 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.86 1.67 0.11 -0.02 0.00 -0.89 -4.68 107.32 100.66 2yuj s GLY 105 Ca 0.00 -1.20 -0.30 0.00 0.00 0.00 0.00 44.72 43.22 2yuj s GLY 105 CO 0.00 1.62 1.21 1.08 0.00 0.00 0.00 173.10 177.01 2yuj s LEU 106 N 2.98 4.40 0.08 0.66 1.43 -1.26 -0.33 118.68 126.65 2yuj s LEU 106 Ca 0.24 2.12 0.01 0.00 -1.03 0.00 0.00 54.13 55.47 2yuj s LEU 106 Cb -0.14 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 2yuj s LEU 106 CO 0.19 -0.44 -0.06 -0.69 0.23 0.00 0.00 176.35 175.58 2yuj s VAL 107 N 0.65 0.54 -0.10 -1.59 1.01 0.12 -4.84 120.40 116.19 2yuj s VAL 107 Ca 0.57 -1.80 -0.30 0.00 0.00 0.00 0.00 61.98 60.45 2yuj s VAL 107 Cb -0.31 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2yuj s VAL 107 CO 0.32 -0.85 1.26 -1.10 0.00 0.00 0.00 175.10 174.73 2yuj s GLN 108 N -3.59 4.28 -0.61 2.72 -1.52 -1.26 -1.00 119.66 118.69 2yuj s GLN 108 Ca 0.08 1.71 0.03 0.00 -1.95 0.00 0.00 55.36 55.22 2yuj s GLN 108 Cb 0.04 -3.67 0.15 0.00 -0.22 0.00 0.00 33.01 29.31 2yuj s GLN 108 CO -0.06 -0.60 0.39 0.08 -0.25 0.00 0.00 175.29 174.86 2yuj s VAL 109 N 2.92 3.00 -0.12 1.09 1.01 -0.33 -3.40 120.40 124.56 2yuj s VAL 109 Ca 0.57 -3.55 -0.03 0.00 0.00 0.00 0.00 61.98 58.97 2yuj s VAL 109 Cb -0.24 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2yuj s VAL 109 CO 0.19 -0.89 -0.01 -1.61 0.00 0.00 0.00 175.10 172.78 2yuj s GLU 110 N -0.63 3.34 -0.65 2.72 8.01 -1.26 -3.73 118.70 126.50 2yuj s GLU 110 Ca 0.20 -0.45 -0.27 0.00 0.01 0.00 0.00 54.97 54.46 2yuj s GLU 110 Cb -0.18 -2.87 0.01 0.00 -4.31 0.00 0.00 34.13 26.77 2yuj s GLU 110 CO -0.06 0.49 1.50 -1.54 0.01 0.00 0.00 175.26 175.66 2yuj s SER 111 N -0.28 5.87 0.10 -0.19 1.04 -1.14 -0.60 113.70 118.50 2yuj s SER 111 Ca 0.06 0.01 0.07 0.00 0.48 0.00 0.00 55.95 56.57 2yuj s SER 111 Cb -0.12 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.41 2yuj s SER 111 CO 0.02 -1.97 -0.12 0.68 0.98 0.00 0.00 173.24 172.83 2yuj s VAL 112 N 6.87 3.21 -0.19 5.02 -7.23 -1.12 -4.56 120.40 122.40 2yuj s VAL 112 Ca 0.50 -1.30 0.01 0.00 -1.81 0.00 0.00 61.98 59.39 2yuj s VAL 112 Cb -0.10 -2.48 0.03 0.00 0.56 0.00 0.00 36.38 34.39 2yuj s VAL 112 CO 0.20 0.14 -0.15 0.54 -0.31 0.00 0.00 175.10 175.51 2yuj s ASN 113 N -2.10 3.31 0.48 4.85 2.20 -1.26 -4.35 114.94 118.08 2yuj s ASN 113 Ca 0.20 -0.79 0.07 0.00 -0.94 0.00 0.00 52.86 51.40 2yuj s ASN 113 Cb -0.11 -1.38 0.01 0.00 -2.00 0.00 0.00 41.25 37.78 2yuj s ASN 113 CO 0.12 -0.07 0.42 -0.76 -2.94 0.00 0.00 177.10 173.86 2yuj s LEU 114 N 1.32 3.07 0.32 3.54 1.43 -1.26 -5.08 118.68 122.03 2yuj s LEU 114 Ca 0.01 -0.98 0.08 0.00 -1.03 0.00 0.00 54.13 52.22 2yuj s LEU 114 Cb -0.15 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 2yuj s LEU 114 CO -0.10 -0.89 0.21 0.00 0.23 0.00 0.00 176.35 175.79 2yuj s GLN 115 N -4.23 2.60 0.25 1.70 0.00 -1.26 -4.47 119.66 114.26 2yuj s GLN 115 Ca 0.43 -1.36 -0.30 0.00 -0.00 0.00 0.00 55.36 54.14 2yuj s GLN 115 Cb -0.03 -2.36 -0.10 0.00 0.00 0.00 0.00 33.01 30.52 2yuj s GLN 115 CO 0.26 0.16 1.46 0.14 0.00 0.00 0.00 175.29 177.31 2yuj s VAL 116 N -2.32 2.58 0.51 3.63 -7.23 -1.21 -1.38 120.40 114.98 2yuj s VAL 116 Ca 0.38 0.49 -0.18 0.00 -1.81 0.00 0.00 61.98 60.86 2yuj s VAL 116 Cb -0.05 -3.31 -0.08 0.00 0.56 0.00 0.00 36.38 33.50 2yuj s VAL 116 CO 0.25 0.08 1.01 0.00 -0.31 0.00 0.00 175.10 176.12 2yuj s ALA 117 N -0.01 2.95 -0.11 1.32 0.00 -1.26 -4.77 121.76 119.88 2yuj s ALA 117 Ca 0.60 0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.99 2yuj s ALA 117 Cb -0.43 -3.18 -0.12 0.00 0.00 0.00 0.00 23.12 19.39 2yuj s ALA 117 CO 0.44 -0.32 0.01 -2.37 0.00 0.00 0.00 175.76 173.52 2yuj n THR 118 N -1.40 0.74 -3.71 0.00 5.66 -1.19 -4.61 114.28 109.76 2yuj n THR 118 Ca 0.08 -0.42 -0.28 0.00 -3.05 0.00 0.00 64.05 60.37 2yuj n THR 118 Cb 0.53 -0.76 -0.16 0.00 -1.55 0.00 0.00 70.33 68.39 2yuj n THR 118 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 2yuj s TYR 119 N -2.26 1.06 -0.22 1.09 6.14 -1.26 0.04 117.35 121.95 2yuj s TYR 119 Ca -0.08 -1.03 0.01 0.00 0.64 0.00 0.00 57.07 56.62 2yuj s TYR 119 Cb 0.03 -1.15 0.05 0.00 0.42 0.00 0.00 41.96 41.31 2yuj s TYR 119 CO 0.41 -0.69 -0.11 -1.12 0.64 0.00 0.00 175.55 174.68 2yuj s SER 120 N 1.84 3.70 0.06 4.32 0.01 -0.82 -0.69 113.70 122.12 2yuj s SER 120 Ca 0.03 -1.03 -0.14 0.00 1.31 0.00 0.00 55.95 56.11 2yuj s SER 120 Cb -0.17 -1.33 -0.06 0.00 0.21 0.00 0.00 66.02 64.67 2yuj s SER 120 CO -0.15 -0.15 0.46 -0.75 0.41 0.00 0.00 173.24 173.05 2yuj s LYS 121 N 1.31 3.92 0.07 12.44 2.20 0.13 -1.76 119.74 138.05 2yuj s LYS 121 Ca -0.03 0.40 0.05 0.00 -0.36 0.00 0.00 55.97 56.03 2yuj s LYS 121 Cb -0.17 -3.09 -0.03 0.00 -1.51 0.00 0.00 37.83 33.03 2yuj s LYS 121 CO -0.08 0.60 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.31 2yuj s PHE 122 N -1.26 1.24 -0.36 4.03 0.40 -0.70 -2.04 117.98 119.30 2yuj s PHE 122 Ca 0.30 -0.46 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 2yuj s PHE 122 Cb -0.16 -0.70 0.11 0.00 0.51 0.00 0.00 43.02 42.79 2yuj s PHE 122 CO 0.17 0.07 0.15 -1.14 0.70 0.00 0.00 175.22 175.16 2yuj s GLN 123 N -1.79 0.89 -0.37 0.44 0.74 -0.54 -1.37 119.66 117.66 2yuj s GLN 123 Ca -0.01 -1.40 -0.36 0.00 0.05 0.00 0.00 55.36 53.64 2yuj s GLN 123 Cb -0.10 -2.05 -0.12 0.00 1.10 0.00 0.00 33.01 31.84 2yuj s GLN 123 CO 0.02 -1.06 2.19 -2.30 -0.55 0.00 0.00 175.29 173.59 2yuj n PRO 124 N 4.36 0.96 0.13 1.67 -0.02 -1.26 -3.50 135.00 137.34 2yuj n PRO 124 Ca 0.03 0.26 0.07 0.00 -2.02 0.00 0.00 63.50 61.83 2yuj n PRO 124 Cb 0.39 -2.36 0.55 0.00 -0.02 0.00 0.00 33.50 32.06 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 12.06 0.23 -6.49 -0.52 1.08 -1.74 -3.42 115.11 116.32 2yuj h GLN 125 Ca -0.25 -0.01 -0.67 0.00 -1.45 0.00 0.00 58.65 56.26 2yuj h GLN 125 Cb 1.33 -0.05 -0.18 0.00 -0.05 0.00 0.00 27.48 28.53 2yuj h GLN 125 CO 1.03 0.15 -0.75 -1.54 -0.95 0.00 0.00 178.83 176.77 2yuj s SER 126 N -6.85 4.27 0.41 1.46 1.04 -1.21 -5.02 113.70 107.81 2yuj s SER 126 Ca -0.06 -0.33 0.28 0.00 0.48 0.00 0.00 55.95 56.32 2yuj s SER 126 Cb 0.17 -0.83 1.03 0.00 0.10 0.00 0.00 66.02 66.49 2yuj s SER 126 CO 0.70 0.23 1.82 1.55 0.98 0.00 0.00 173.24 178.52 2yuj h PRO 127 N 4.16 0.00 -1.00 4.02 0.13 -1.95 -3.21 132.00 134.16 2yuj h PRO 127 Ca -0.48 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.76 2yuj h PRO 127 Cb 1.16 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 2yuj h PRO 127 CO 0.51 0.00 0.63 0.22 -0.23 0.00 0.00 178.00 179.13 2yuj h ASP 128 N 0.00 0.94 -0.19 1.44 1.82 -1.96 -0.88 116.42 117.60 2yuj h ASP 128 Ca 0.00 0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 2yuj h ASP 128 Cb 0.57 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.43 2yuj h ASP 128 CO 0.00 0.52 -0.01 0.15 -1.61 0.00 0.00 179.24 178.29 2yuj h PHE 129 N 1.02 0.37 -0.07 0.28 3.04 -1.94 -2.87 116.94 116.78 2yuj h PHE 129 Ca 0.48 -0.07 -0.00 0.00 3.98 0.00 0.00 57.97 62.36 2yuj h PHE 129 Cb 0.43 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 38.85 2yuj h PHE 129 CO -0.00 0.55 0.03 -0.07 -2.02 0.00 0.00 178.31 176.79 2yuj h LEU 130 N 0.08 0.08 -2.33 0.59 3.38 -1.53 -0.90 115.31 114.67 2yuj h LEU 130 Ca 0.05 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2yuj h LEU 130 Cb 0.40 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2yuj h LEU 130 CO 0.01 0.07 -0.03 0.44 0.09 0.00 0.00 178.44 179.02 2yuj h ASP 131 N 0.09 0.00 -3.56 -0.43 5.19 -0.95 -3.43 116.42 113.33 2yuj h ASP 131 Ca 0.02 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.90 2yuj h ASP 131 Cb 0.02 0.00 0.08 0.00 0.18 0.00 0.00 39.33 39.61 2yuj h ASP 131 CO -0.00 0.03 0.80 -0.63 -3.12 0.00 0.00 179.24 176.32 2yuj s ILE 132 N -4.51 2.26 0.27 0.35 1.01 -0.34 -4.90 121.20 115.34 2yuj s ILE 132 Ca -0.04 0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.81 2yuj s ILE 132 Cb 0.15 -3.15 0.27 0.00 0.01 0.00 0.00 42.46 39.73 2yuj s ILE 132 CO 0.55 0.04 1.91 0.74 0.00 0.00 0.00 174.94 178.19 2yuj h THR 133 N 3.27 1.14 -2.90 2.92 2.02 -1.88 -3.30 112.91 114.19 2yuj h THR 133 Ca -0.48 -0.41 -0.61 0.00 0.77 0.00 0.00 66.41 65.67 2yuj h THR 133 Cb 1.23 -0.17 -0.41 0.00 -1.74 0.00 0.00 68.15 67.06 2yuj h THR 133 CO 0.73 0.22 -0.68 0.20 0.37 0.00 0.00 175.52 176.36 2yuj s ASN 134 N -6.01 3.89 0.33 4.18 -0.87 -1.26 -4.93 114.94 110.27 2yuj s ASN 134 Ca -0.12 -3.60 0.14 0.00 -1.57 0.00 0.00 52.86 47.71 2yuj s ASN 134 Cb 0.19 -1.30 0.57 0.00 -0.02 0.00 0.00 41.25 40.69 2yuj s ASN 134 CO 0.81 -0.11 1.71 1.55 -2.57 0.00 0.00 177.10 178.49 2yuj h PRO 135 N 5.52 0.00 -0.29 -0.60 0.13 -1.83 -2.94 132.00 131.98 2yuj h PRO 135 Ca 0.17 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.24 2yuj h PRO 135 Cb 0.80 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 2yuj h PRO 135 CO 0.62 0.47 -0.03 0.87 -0.23 0.00 0.00 178.00 179.70 2yuj h LYS 136 N 0.00 0.54 -0.68 0.86 1.57 -1.93 -1.61 116.57 115.32 2yuj h LYS 136 Ca -0.00 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 2yuj h LYS 136 Cb 0.92 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 2yuj h LYS 136 CO 0.06 0.71 0.11 0.00 -0.57 0.00 0.00 179.45 179.76 2yuj h ALA 137 N 0.81 0.92 -0.36 3.86 0.00 -1.97 0.01 119.26 122.53 2yuj h ALA 137 Ca 0.08 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2yuj h ALA 137 Cb 0.48 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2yuj h ALA 137 CO 0.02 0.67 0.11 0.28 0.00 0.00 0.00 179.25 180.33 2yuj h VAL 138 N 1.05 1.21 -0.33 0.00 2.07 -1.44 -0.58 116.25 118.23 2yuj h VAL 138 Ca 0.21 -0.69 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 2yuj h VAL 138 Cb 0.44 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2yuj h VAL 138 CO 0.01 0.24 -0.12 0.25 0.02 0.00 0.00 177.57 177.97 2yuj h LEU 139 N 0.43 0.68 -1.19 2.57 5.85 -1.17 -2.52 115.31 119.96 2yuj h LEU 139 Ca 0.11 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 2yuj h LEU 139 Cb 0.26 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 2yuj h LEU 139 CO -0.00 0.92 0.22 -0.33 -0.34 0.00 0.00 178.44 178.90 2yuj h GLU 140 N 0.45 0.79 0.00 1.25 5.08 -0.91 -1.88 114.58 119.36 2yuj h GLU 140 Ca 0.08 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2yuj h GLU 140 Cb 0.64 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2yuj h GLU 140 CO 0.04 0.65 -0.43 -0.91 -1.00 0.00 0.00 179.01 177.35 2yuj h ASN 141 N 0.78 0.00 0.29 1.42 4.21 -0.97 -2.86 115.58 118.46 2yuj h ASN 141 Ca 0.19 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.56 2yuj h ASN 141 Cb 0.15 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.34 2yuj h ASN 141 CO -0.02 0.43 -0.56 0.00 -1.29 0.00 0.00 177.43 175.99 2yuj h ALA 142 N 1.57 0.87 0.00 -0.83 0.00 -0.91 -2.93 119.26 117.03 2yuj h ALA 142 Ca -0.00 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2yuj h ALA 142 Cb 0.77 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2yuj h ALA 142 CO 0.06 0.70 -0.01 -0.07 0.00 0.00 0.00 179.25 179.92 2yuj h LEU 143 N 0.22 0.00 -1.96 0.00 3.38 -1.23 -1.80 115.31 113.92 2yuj h LEU 143 Ca 0.00 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.11 2yuj h LEU 143 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2yuj h LEU 143 CO 0.09 0.01 0.36 0.03 0.09 0.00 0.00 178.44 179.02 2yuj h ARG 144 N 0.00 0.04 0.12 1.13 3.08 -1.58 -1.84 114.38 115.32 2yuj h ARG 144 Ca -0.00 -0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.69 2yuj h ARG 144 Cb 0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2yuj h ARG 144 CO 0.00 0.02 -1.91 -0.91 -1.07 0.00 0.00 179.97 176.11 2yuj h ASN 145 N 0.04 0.40 -3.97 7.04 4.21 -1.52 -3.47 115.58 118.31 2yuj h ASN 145 Ca 0.24 -0.83 -0.51 0.00 1.21 0.00 0.00 56.30 56.40 2yuj h ASN 145 Cb 0.91 -0.13 0.06 0.00 -1.12 0.00 0.00 38.32 38.04 2yuj h ASN 145 CO -0.01 1.74 0.52 -0.36 -1.29 0.00 0.00 177.43 178.03 2yuj s PHE 146 N -2.57 2.93 -0.07 1.19 0.08 -0.69 -3.42 117.98 115.43 2yuj s PHE 146 Ca -0.19 1.52 0.10 0.00 0.12 0.00 0.00 56.93 58.48 2yuj s PHE 146 Cb 0.07 -3.45 -0.15 0.00 -0.57 0.00 0.00 43.02 38.91 2yuj s PHE 146 CO 0.79 -1.57 0.12 0.00 -0.10 0.00 0.00 175.22 174.47 2yuj n ALA 147 N -0.14 2.00 -2.17 5.36 0.00 -1.26 -4.73 120.51 119.58 2yuj n ALA 147 Ca 0.05 -0.54 -0.10 0.00 0.00 0.00 0.00 53.44 52.85 2yuj n ALA 147 Cb 0.46 -0.14 -0.10 0.00 0.00 0.00 0.00 19.45 19.68 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 -3.04 0.59 0.06 0.00 1.43 -0.18 -4.84 118.68 112.70 2yuj s LEU 149 Ca 0.23 0.36 0.09 0.00 -1.03 0.00 0.00 54.13 53.79 2yuj s LEU 149 Cb 0.07 0.46 -0.03 0.00 0.03 0.00 0.00 46.19 46.72 2yuj s LEU 149 CO 0.01 -0.16 -0.26 -0.89 0.23 0.00 0.00 176.35 175.29 2yuj s THR 150 N 1.27 2.24 -0.04 5.49 2.01 -1.25 -1.90 115.64 123.46 2yuj s THR 150 Ca -0.09 -1.43 -0.30 0.00 0.31 0.00 0.00 61.69 60.18 2yuj s THR 150 Cb -0.11 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.45 2yuj s THR 150 CO -0.07 0.31 1.39 -0.89 -0.69 0.00 0.00 174.62 174.68 2yuj s THR 151 N -0.87 3.85 0.00 -0.82 2.01 -1.08 -2.96 115.64 115.77 2yuj s THR 151 Ca 0.13 1.17 0.00 0.00 0.31 0.00 0.00 61.69 63.30 2yuj s THR 151 Cb -0.10 -3.75 0.00 0.00 0.01 0.00 0.00 72.50 68.66 2yuj s THR 151 CO 0.03 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 2yuj n GLY 152 N 3.68 1.05 3.54 4.40 0.00 -0.92 -4.98 105.19 111.95 2yuj n GLY 152 Ca 0.14 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.51 4.86 -0.93 1.61 1.11 -1.16 -4.95 116.67 114.70 2yuj s ASP 153 Ca 0.00 -0.07 -0.18 0.00 0.18 0.00 0.00 52.55 52.48 2yuj s ASP 153 Cb 0.00 -1.66 0.14 0.00 1.07 0.00 0.00 42.92 42.47 2yuj s ASP 153 CO 0.00 0.22 1.10 -0.69 1.18 0.00 0.00 175.17 176.98 2yuj s VAL 154 N 0.03 4.83 -0.01 -1.27 1.01 -1.26 -2.33 120.40 121.41 2yuj s VAL 154 Ca 0.01 -1.70 -0.25 0.00 0.00 0.00 0.00 61.98 60.04 2yuj s VAL 154 Cb -0.13 -4.75 -0.04 0.00 0.00 0.00 0.00 36.38 31.45 2yuj s VAL 154 CO 0.03 -1.46 0.75 0.27 0.00 0.00 0.00 175.10 174.69 2yuj s ILE 155 N 2.39 4.88 -0.07 2.22 -4.36 0.22 -4.85 121.20 121.63 2yuj s ILE 155 Ca 0.32 1.58 -0.01 0.00 -0.26 0.00 0.00 60.65 62.28 2yuj s ILE 155 Cb -0.05 -4.10 -0.03 0.00 1.25 0.00 0.00 42.46 39.53 2yuj s ILE 155 CO -0.09 0.30 -0.02 0.00 0.24 0.00 0.00 174.94 175.37 2yuj s ALA 156 N 0.38 3.20 0.29 2.27 0.00 -1.26 -2.19 121.76 124.46 2yuj s ALA 156 Ca 0.39 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.57 2yuj s ALA 156 Cb -0.19 -1.39 -0.06 0.00 0.00 0.00 0.00 23.12 21.48 2yuj s ALA 156 CO 0.21 0.59 -0.05 0.96 0.00 0.00 0.00 175.76 177.47 2yuj s ILE 157 N -0.90 1.68 -0.03 0.00 -4.36 -1.11 -4.94 121.20 111.54 2yuj s ILE 157 Ca 0.14 -2.12 -0.27 0.00 -0.26 0.00 0.00 60.65 58.14 2yuj s ILE 157 Cb -0.11 -2.51 0.06 0.00 1.25 0.00 0.00 42.46 41.15 2yuj s ILE 157 CO 0.03 -0.26 0.60 0.21 0.24 0.00 0.00 174.94 175.76 2yuj s ASN 158 N -3.47 -0.56 0.00 4.36 3.84 -1.26 -1.87 114.94 115.99 2yuj s ASN 158 Ca 0.30 0.56 0.00 0.00 0.21 0.00 0.00 52.86 53.93 2yuj s ASN 158 Cb 0.04 0.49 0.00 0.00 -0.55 0.00 0.00 41.25 41.24 2yuj s ASN 158 CO 0.13 -0.59 0.00 0.00 -2.79 0.00 0.00 177.10 173.85 2yuj n TYR 159 N 0.93 -0.76 -1.32 0.43 4.11 -1.26 -4.97 117.16 114.33 2yuj n TYR 159 Ca -0.19 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.39 2yuj n TYR 159 Cb 0.57 0.15 0.06 0.00 -0.00 0.00 0.00 39.34 40.13 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 -1.96 7.42 -2.38 9.48 5.15 -1.26 -4.81 115.26 126.90 2yuj n ASN 160 Ca 0.00 -3.64 -0.20 0.00 -0.60 0.00 0.00 54.58 50.15 2yuj n ASN 160 Cb 0.00 -1.01 -0.01 0.00 -0.53 0.00 0.00 39.78 38.22 2yuj n ASN 160 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2yuj n GLU 161 N -0.57 -1.74 -3.73 1.20 0.00 -1.26 -4.96 120.64 109.58 2yuj n GLU 161 Ca 0.55 0.97 -0.14 0.00 0.00 0.00 0.00 57.16 58.55 2yuj n GLU 161 Cb 0.59 -5.62 -0.14 0.00 0.00 0.00 0.00 31.44 26.27 2yuj n GLU 161 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2yuj s LYS 162 N -5.00 0.12 -0.55 5.31 -0.14 -1.26 -5.12 119.74 113.10 2yuj s LYS 162 Ca 0.00 0.47 -0.23 0.00 -1.36 0.00 0.00 55.97 54.84 2yuj s LYS 162 Cb 0.00 -0.17 0.05 0.00 -1.68 0.00 0.00 37.83 36.03 2yuj s LYS 162 CO 0.00 -0.19 0.89 0.42 -0.76 0.00 0.00 175.35 175.71 2yuj s ILE 163 N 1.42 4.46 0.14 2.17 1.09 -1.26 -4.12 121.20 125.10 2yuj s ILE 163 Ca -0.07 0.09 -0.27 0.00 -1.10 0.00 0.00 60.65 59.30 2yuj s ILE 163 Cb -0.11 -4.51 -0.07 0.00 -1.06 0.00 0.00 42.46 36.70 2yuj s ILE 163 CO -0.07 -1.09 0.84 -0.31 -0.10 0.00 0.00 174.94 174.21 2yuj s TYR 164 N 3.74 3.86 -0.23 3.97 1.51 -0.78 -4.91 117.35 124.50 2yuj s TYR 164 Ca 0.27 1.68 -0.20 0.00 -1.01 0.00 0.00 57.07 57.81 2yuj s TYR 164 Cb -0.14 -2.88 -0.02 0.00 -0.11 0.00 0.00 41.96 38.81 2yuj s TYR 164 CO 0.17 0.38 0.60 -1.21 -1.11 0.00 0.00 175.55 174.38 2yuj s GLU 165 N -0.63 4.15 0.00 -0.62 2.02 -1.26 -2.76 118.70 119.61 2yuj s GLU 165 Ca 0.40 0.52 0.03 0.00 0.02 0.00 0.00 54.97 55.94 2yuj s GLU 165 Cb -0.23 -3.61 -0.01 0.00 0.10 0.00 0.00 34.13 30.38 2yuj s GLU 165 CO 0.27 -0.31 -0.10 -0.51 0.02 0.00 0.00 175.26 174.63 2yuj s LEU 166 N 2.16 2.06 -0.03 1.80 1.43 -0.93 -1.99 118.68 123.18 2yuj s LEU 166 Ca 0.26 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2yuj s LEU 166 Cb -0.16 -0.50 0.03 0.00 0.03 0.00 0.00 46.19 45.59 2yuj s LEU 166 CO 0.09 0.09 -0.00 -0.60 0.23 0.00 0.00 176.35 176.16 2yuj s ARG 167 N -0.46 0.38 0.09 1.70 3.52 -1.23 -0.61 118.95 122.35 2yuj s ARG 167 Ca 0.03 0.06 -0.30 0.00 -0.13 0.00 0.00 55.73 55.38 2yuj s ARG 167 Cb -0.05 -0.56 -0.06 0.00 -1.56 0.00 0.00 34.95 32.73 2yuj s ARG 167 CO -0.00 -0.14 1.09 0.08 -0.81 0.00 0.00 175.30 175.52 2yuj s VAL 168 N 1.08 4.21 -0.02 7.11 1.01 -0.98 -1.47 120.40 131.34 2yuj s VAL 168 Ca -0.09 1.71 -0.02 0.00 0.00 0.00 0.00 61.98 63.59 2yuj s VAL 168 Cb -0.14 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 2yuj s VAL 168 CO -0.02 0.20 -0.04 0.23 0.00 0.00 0.00 175.10 175.48 2yuj n MET 169 N 3.27 0.07 -4.34 2.72 2.81 -0.86 -2.17 117.12 118.62 2yuj n MET 169 Ca 0.05 0.19 -0.24 0.00 -1.81 0.00 0.00 57.70 55.89 2yuj n MET 169 Cb 0.48 -0.79 -0.12 0.00 -0.71 0.00 0.00 33.22 32.08 2yuj n MET 169 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2yuj s GLU 170 N -1.22 1.28 -0.00 0.03 2.12 -1.21 -4.42 118.70 115.28 2yuj s GLU 170 Ca -0.03 -1.34 -0.11 0.00 0.36 0.00 0.00 54.97 53.85 2yuj s GLU 170 Cb 0.00 -1.48 0.01 0.00 0.26 0.00 0.00 34.13 32.92 2yuj s GLU 170 CO 0.04 0.32 0.23 0.95 -0.54 0.00 0.00 175.26 176.26 2yuj s THR 171 N -1.61 0.07 0.11 -1.70 -4.23 -1.26 0.18 115.64 107.19 2yuj s THR 171 Ca 0.13 -0.61 0.05 0.00 -1.18 0.00 0.00 61.69 60.09 2yuj s THR 171 Cb -0.08 -0.57 -0.04 0.00 1.34 0.00 0.00 72.50 73.16 2yuj s THR 171 CO 0.06 -0.33 -0.13 -0.54 -0.54 0.00 0.00 174.62 173.14 2yuj s LYS 172 N -1.48 0.93 0.16 3.99 1.02 0.13 -4.28 119.74 120.21 2yuj s LYS 172 Ca -0.13 -1.16 0.04 0.00 0.02 0.00 0.00 55.97 54.74 2yuj s LYS 172 Cb -0.06 -0.78 -0.02 0.00 -0.52 0.00 0.00 37.83 36.45 2yuj s LYS 172 CO 0.02 0.15 1.37 -1.00 -0.92 0.00 0.00 175.35 174.97 2yuj h PRO 173 N 3.67 0.13 -5.87 -1.68 0.13 -1.89 -3.16 132.00 123.34 2yuj h PRO 173 Ca -0.39 -0.16 -0.57 0.00 -0.87 0.00 0.00 66.00 64.01 2yuj h PRO 173 Cb 1.19 0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.29 2yuj h PRO 173 CO 0.49 0.93 -0.47 -0.51 -0.23 0.00 0.00 178.00 178.22 2yuj s ASP 174 N -6.88 4.47 0.26 1.44 1.01 -1.26 -5.03 116.67 110.67 2yuj s ASP 174 Ca -0.02 -1.11 -0.03 0.00 0.71 0.00 0.00 52.55 52.09 2yuj s ASP 174 Cb 0.10 -0.32 0.40 0.00 1.01 0.00 0.00 42.92 44.11 2yuj s ASP 174 CO 0.82 -0.64 1.86 0.07 0.21 0.00 0.00 175.17 177.50 2yuj h LYS 175 N 1.32 1.04 -5.08 8.23 2.10 -1.92 -3.40 116.57 118.86 2yuj h LYS 175 Ca -0.42 -0.06 -0.63 0.00 -2.00 0.00 0.00 60.65 57.54 2yuj h LYS 175 Cb 1.26 -0.23 -0.17 0.00 -0.90 0.00 0.00 32.23 32.19 2yuj h LYS 175 CO 0.68 0.69 -0.55 0.00 -2.00 0.00 0.00 179.45 178.26 2yuj s ALA 176 N -6.04 3.42 0.05 0.07 0.00 -1.26 -2.64 121.76 115.37 2yuj s ALA 176 Ca -0.12 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 50.91 2yuj s ALA 176 Cb 0.20 -2.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.12 2yuj s ALA 176 CO 0.80 -0.21 -0.06 0.14 0.00 0.00 0.00 175.76 176.44 2yuj s VAL 177 N 1.10 0.42 -0.55 0.00 -7.23 -0.80 -4.76 120.40 108.58 2yuj s VAL 177 Ca 0.06 -1.34 -0.11 0.00 -1.81 0.00 0.00 61.98 58.78 2yuj s VAL 177 Cb -0.14 -0.89 0.14 0.00 0.56 0.00 0.00 36.38 36.04 2yuj s VAL 177 CO 0.04 -0.61 0.45 -0.55 -0.31 0.00 0.00 175.10 174.11 2yuj s SER 178 N -2.07 5.92 -1.10 4.85 0.15 -0.48 -1.01 113.70 119.96 2yuj s SER 178 Ca -0.04 -2.06 -0.16 0.00 0.70 0.00 0.00 55.95 54.39 2yuj s SER 178 Cb -0.04 -2.07 0.15 0.00 -1.71 0.00 0.00 66.02 62.34 2yuj s SER 178 CO -0.03 -0.70 1.34 0.27 1.20 0.00 0.00 173.24 175.33 2yuj s ILE 179 N 1.16 4.83 -0.88 6.45 -4.36 -0.11 -3.35 121.20 124.93 2yuj s ILE 179 Ca 0.07 -2.14 -0.01 0.00 -0.26 0.00 0.00 60.65 58.31 2yuj s ILE 179 Cb -0.25 -4.89 0.22 0.00 1.25 0.00 0.00 42.46 38.79 2yuj s ILE 179 CO -0.01 -1.62 0.76 -0.38 0.24 0.00 0.00 174.94 173.93 2yuj n ILE 180 N 5.12 2.88 -2.73 8.37 2.08 -1.26 -4.38 119.36 129.45 2yuj n ILE 180 Ca 0.33 -5.09 -0.01 0.00 0.56 0.00 0.00 62.75 58.54 2yuj n ILE 180 Cb 0.46 -2.36 -0.00 0.00 -0.75 0.00 0.00 39.64 36.98 2yuj n ILE 180 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2yuj n GLU 181 N 2.24 -3.51 -3.46 0.38 2.13 -1.26 -5.07 120.64 112.09 2yuj n GLU 181 Ca 0.22 2.80 -0.14 0.00 0.66 0.00 0.00 57.16 60.69 2yuj n GLU 181 Cb 0.37 -5.20 -0.04 0.00 0.27 0.00 0.00 31.44 26.84 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2yuj s ASP 183 N -2.15 6.21 0.35 0.00 1.11 -1.26 -5.03 116.67 115.90 2yuj s ASP 183 Ca -0.04 -1.08 0.04 0.00 0.18 0.00 0.00 52.55 51.65 2yuj s ASP 183 Cb -0.01 -2.30 -0.06 0.00 1.07 0.00 0.00 42.92 41.62 2yuj s ASP 183 CO -0.04 -0.98 0.05 0.00 1.18 0.00 0.00 175.17 175.38 2yuj s MET 184 N 2.69 1.74 -0.37 8.23 0.23 -1.26 -4.98 119.30 125.58 2yuj s MET 184 Ca 0.14 -1.98 -0.18 0.00 -1.03 0.00 0.00 55.69 52.64 2yuj s MET 184 Cb -0.21 -0.99 0.00 0.00 -1.53 0.00 0.00 34.83 32.10 2yuj s MET 184 CO 0.10 -0.19 0.50 1.21 -2.03 0.00 0.00 175.02 174.61 2yuj s ASN 185 N -3.54 6.29 -0.47 -1.18 2.47 0.11 -5.01 114.94 113.61 2yuj s ASN 185 Ca 0.34 -0.19 -0.17 0.00 0.42 0.00 0.00 52.86 53.27 2yuj s ASN 185 Cb 0.08 -2.26 0.05 0.00 -1.45 0.00 0.00 41.25 37.67 2yuj s ASN 185 CO 0.15 -0.52 0.47 -0.69 -3.72 0.00 0.00 177.10 172.79 2yuj s VAL 186 N 2.38 5.09 0.47 -5.21 1.01 -1.26 -1.95 120.40 120.92 2yuj s VAL 186 Ca 0.18 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 2yuj s VAL 186 Cb -0.16 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 2yuj s VAL 186 CO 0.14 -0.59 0.78 -0.62 0.00 0.00 0.00 175.10 174.81 2yuj s ASP 187 N 2.36 6.29 -0.03 3.32 -1.08 -0.72 -4.99 116.67 121.82 2yuj s ASP 187 Ca 0.10 0.95 0.02 0.00 -0.52 0.00 0.00 52.55 53.10 2yuj s ASP 187 Cb -0.20 -2.26 0.01 0.00 -1.46 0.00 0.00 42.92 39.01 2yuj s ASP 187 CO 0.10 -0.56 -0.07 -0.36 0.52 0.00 0.00 175.17 174.80 2yuj s PHE 188 N -2.70 0.87 -0.38 -5.34 0.40 -1.26 -1.73 117.98 107.84 2yuj s PHE 188 Ca 0.48 -0.24 0.04 0.00 -0.60 0.00 0.00 56.93 56.61 2yuj s PHE 188 Cb -0.10 -0.67 0.11 0.00 0.51 0.00 0.00 43.02 42.86 2yuj s PHE 188 CO 0.43 -0.14 0.11 0.34 0.70 0.00 0.00 175.22 176.66 2yuj s ASP 189 N 0.49 4.58 0.00 1.36 2.15 -0.47 -4.94 116.67 119.83 2yuj s ASP 189 Ca -0.07 -2.34 0.28 0.00 0.43 0.00 0.00 52.55 50.85 2yuj s ASP 189 Cb -0.11 -1.56 1.09 0.00 -0.30 0.00 0.00 42.92 42.04 2yuj s ASP 189 CO 0.01 -0.34 1.77 0.00 -0.17 0.00 0.00 175.17 176.43