#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 -5.98 0.02 1.61 7.64 -1.26 -4.96 113.62 110.70 2yuj n SER 2 Ca 0.00 1.66 -0.01 0.00 1.01 0.00 0.00 58.87 61.53 2yuj n SER 2 Cb 0.00 -5.22 -0.00 0.00 -1.01 0.00 0.00 64.21 57.97 2yuj n SER 2 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2yuj h SER 3 N 4.18 -0.05 0.00 6.43 4.64 -2.11 -3.48 113.55 123.17 2yuj h SER 3 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2yuj h SER 3 Cb 0.50 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2yuj h SER 3 CO 0.00 -0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 2yuj n GLY 4 N -0.36 1.41 2.85 -0.77 0.00 -1.26 -4.70 105.19 102.37 2yuj n GLY 4 Ca -0.01 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.24 2yuj n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yuj s SER 5 N -4.00 1.38 0.35 1.61 1.04 -1.26 -5.14 113.70 107.68 2yuj s SER 5 Ca 0.00 -0.14 0.06 0.00 0.48 0.00 0.00 55.95 56.35 2yuj s SER 5 Cb 0.00 -0.51 -0.03 0.00 0.10 0.00 0.00 66.02 65.58 2yuj s SER 5 CO 0.00 -0.11 0.22 -0.44 0.98 0.00 0.00 173.24 173.89 2yuj s SER 6 N 1.43 1.95 0.00 7.02 0.01 -1.26 -5.18 113.70 117.66 2yuj s SER 6 Ca -0.03 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 55.51 2yuj s SER 6 Cb -0.13 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2yuj s SER 6 CO -0.03 -1.01 0.00 0.61 0.41 0.00 0.00 173.24 173.22 2yuj n GLY 7 N -0.70 3.16 3.25 3.44 0.00 -1.26 -5.16 105.19 107.93 2yuj n GLY 7 Ca 0.03 -2.17 -0.12 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.02 0.08 -0.81 -0.61 -4.36 -1.26 -5.06 121.20 109.16 2yuj s ILE 8 Ca 0.00 -0.64 -0.10 0.00 -0.26 0.00 0.00 60.65 59.65 2yuj s ILE 8 Cb 0.00 -0.90 -0.08 0.00 1.25 0.00 0.00 42.46 42.73 2yuj s ILE 8 CO 0.00 -0.35 1.98 -0.81 0.24 0.00 0.00 174.94 176.00 2yuj n PRO 9 N 0.66 1.77 -4.36 0.37 -0.04 -1.26 -4.84 135.00 127.31 2yuj n PRO 9 Ca -0.19 -1.51 -0.20 0.00 -0.04 0.00 0.00 63.50 61.57 2yuj n PRO 9 Cb 0.59 -2.56 -0.10 0.00 -0.04 0.00 0.00 33.50 31.39 2yuj n PRO 9 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2yuj s ARG 10 N 4.00 1.37 -1.35 0.54 3.00 -1.26 -4.73 118.95 120.51 2yuj s ARG 10 Ca 0.42 -1.59 0.00 0.00 0.00 0.00 0.00 55.73 54.57 2yuj s ARG 10 Cb 0.11 -1.25 0.00 0.00 0.00 0.00 0.00 34.95 33.81 2yuj s ARG 10 CO 0.02 0.22 0.00 0.28 0.00 0.00 0.00 175.30 175.81 2yuj n VAL 11 N -0.32 -0.74 -3.78 3.52 0.31 -1.26 -4.95 118.33 111.11 2yuj n VAL 11 Ca -0.08 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.87 2yuj n VAL 11 Cb 0.60 -2.24 -0.06 0.00 -0.91 0.00 0.00 33.84 31.22 2yuj n VAL 11 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2yuj s PHE 12 N -2.78 3.63 0.00 3.52 0.08 -1.26 -4.82 117.98 116.35 2yuj s PHE 12 Ca 0.00 0.65 0.00 0.00 0.12 0.00 0.00 56.93 57.70 2yuj s PHE 12 Cb 0.00 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.41 2yuj s PHE 12 CO 0.00 0.71 0.00 0.94 -0.10 0.00 0.00 175.22 176.77 2yuj n GLN 13 N 1.96 0.00 -1.55 0.44 7.27 -1.26 -4.99 117.38 119.25 2yuj n GLN 13 Ca -0.18 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 56.60 2yuj n GLN 13 Cb 0.54 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.14 2yuj n GLN 13 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 2yuj n ASN 14 N -0.61 6.68 -3.60 1.69 6.94 -1.26 -4.81 115.26 120.29 2yuj n ASN 14 Ca 0.00 -3.17 -0.13 0.00 -0.02 0.00 0.00 54.58 51.26 2yuj n ASN 14 Cb 0.00 -1.26 -0.12 0.00 -2.36 0.00 0.00 39.78 36.04 2yuj n ASN 14 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2yuj s ARG 15 N -1.53 0.19 -0.28 -3.83 1.81 -1.26 -4.88 118.95 109.17 2yuj s ARG 15 Ca 0.59 0.67 -0.28 0.00 -1.72 0.00 0.00 55.73 54.99 2yuj s ARG 15 Cb 0.35 -0.23 -0.05 0.00 -0.45 0.00 0.00 34.95 34.56 2yuj s ARG 15 CO -0.20 -0.38 2.27 0.12 -0.68 0.00 0.00 175.30 176.43 2yuj s PHE 16 N 2.44 1.14 -0.24 -0.53 2.19 -1.26 -4.91 117.98 116.80 2yuj s PHE 16 Ca 0.03 0.79 -0.03 0.00 0.33 0.00 0.00 56.93 58.05 2yuj s PHE 16 Cb -0.13 -3.84 0.13 0.00 -1.31 0.00 0.00 43.02 37.87 2yuj s PHE 16 CO -0.10 -3.72 0.38 -1.54 1.83 0.00 0.00 175.22 172.07 2yuj s SER 17 N 9.26 0.23 0.12 6.13 1.04 -1.26 -2.45 113.70 126.78 2yuj s SER 17 Ca 1.00 0.26 -0.26 0.00 0.48 0.00 0.00 55.95 57.43 2yuj s SER 17 Cb -0.29 1.12 0.08 0.00 0.10 0.00 0.00 66.02 67.02 2yuj s SER 17 CO 0.33 -0.30 1.03 0.28 0.98 0.00 0.00 173.24 175.57 2yuj s THR 18 N 2.55 0.00 -0.19 2.02 -1.32 -1.15 -4.97 115.64 112.57 2yuj s THR 18 Ca 0.12 -0.57 -0.14 0.00 -1.21 0.00 0.00 61.69 59.88 2yuj s THR 18 Cb -0.15 -2.10 -0.04 0.00 -1.51 0.00 0.00 72.50 68.69 2yuj s THR 18 CO -0.16 0.00 0.33 -1.10 -2.21 0.00 0.00 174.62 171.49 2yuj s GLN 19 N -2.99 4.18 0.02 7.08 -0.21 -1.26 -1.33 119.66 125.16 2yuj s GLN 19 Ca 0.14 0.10 0.07 0.00 0.02 0.00 0.00 55.36 55.69 2yuj s GLN 19 Cb -0.00 -3.50 -0.02 0.00 1.00 0.00 0.00 33.01 30.48 2yuj s GLN 19 CO 0.01 0.06 -0.20 0.71 -2.12 0.00 0.00 175.29 173.75 2yuj s TYR 20 N 1.03 1.75 0.45 0.91 2.02 -1.11 -4.83 117.35 117.57 2yuj s TYR 20 Ca 0.17 -0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.27 2yuj s TYR 20 Cb -0.14 -1.08 -0.07 0.00 -0.40 0.00 0.00 41.96 40.27 2yuj s TYR 20 CO 0.06 0.04 1.25 1.03 -1.57 0.00 0.00 175.55 176.36 2yuj s ARG 21 N -0.90 3.75 -0.20 -0.62 0.52 -1.25 -2.03 118.95 118.23 2yuj s ARG 21 Ca 0.07 2.00 -0.02 0.00 -0.52 0.00 0.00 55.73 57.27 2yuj s ARG 21 Cb -0.08 -2.53 0.00 0.00 0.52 0.00 0.00 34.95 32.85 2yuj s ARG 21 CO 0.01 -0.62 -0.11 0.00 0.02 0.00 0.00 175.30 174.60 2yuj s PHE 23 N 1.31 1.84 0.28 0.00 0.08 -0.04 -2.51 117.98 118.93 2yuj s PHE 23 Ca 0.04 -1.16 -0.06 0.00 0.12 0.00 0.00 56.93 55.86 2yuj s PHE 23 Cb -0.14 -1.28 -0.06 0.00 -0.57 0.00 0.00 43.02 40.97 2yuj s PHE 23 CO -0.06 -0.14 0.56 -1.12 -0.10 0.00 0.00 175.22 174.37 2yuj s SER 24 N -3.65 6.50 0.39 1.36 0.01 -1.26 -1.41 113.70 115.64 2yuj s SER 24 Ca 0.22 0.79 0.16 0.00 1.31 0.00 0.00 55.95 58.43 2yuj s SER 24 Cb 0.03 -2.18 0.82 0.00 0.21 0.00 0.00 66.02 64.90 2yuj s SER 24 CO 0.12 -0.17 1.84 -0.37 0.41 0.00 0.00 173.24 175.07 2yuj h VAL 25 N 1.51 1.08 -0.28 3.43 -1.51 -1.87 -2.76 116.25 115.85 2yuj h VAL 25 Ca -0.47 -1.24 0.08 0.00 -1.23 0.00 0.00 66.70 63.83 2yuj h VAL 25 Cb 1.18 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 32.04 2yuj h VAL 25 CO 0.67 0.34 0.21 -1.28 -1.23 0.00 0.00 177.57 176.27 2yuj h SER 26 N 0.00 0.00 -0.24 4.19 0.87 -1.94 -0.41 113.55 116.02 2yuj h SER 26 Ca -0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2yuj h SER 26 Cb 0.68 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 2yuj h SER 26 CO 0.04 0.00 0.16 0.24 -0.53 0.00 0.00 176.83 176.74 2yuj h MET 27 N 0.00 0.22 -7.20 2.24 2.07 -1.90 -3.42 114.93 106.93 2yuj h MET 27 Ca 0.13 -0.01 -0.47 0.00 -2.07 0.00 0.00 59.70 57.28 2yuj h MET 27 Cb 0.55 -0.05 0.02 0.00 -1.87 0.00 0.00 31.60 30.25 2yuj h MET 27 CO -0.00 0.14 0.38 -1.17 1.07 0.00 0.00 176.91 177.33 2yuj s LEU 28 N -9.21 3.61 0.61 1.22 2.96 -0.17 -5.07 118.68 112.63 2yuj s LEU 28 Ca -0.06 1.57 -0.03 0.00 -0.22 0.00 0.00 54.13 55.38 2yuj s LEU 28 Cb 0.18 -4.51 0.04 0.00 0.50 0.00 0.00 46.19 42.40 2yuj s LEU 28 CO 0.70 -0.60 0.88 0.00 -1.32 0.00 0.00 176.35 176.01 2yuj s ALA 29 N -2.64 3.51 0.03 5.97 0.00 -1.26 -5.05 121.76 122.32 2yuj s ALA 29 Ca 0.59 -1.07 -0.28 0.00 0.00 0.00 0.00 51.96 51.20 2yuj s ALA 29 Cb -0.10 -2.36 0.09 0.00 0.00 0.00 0.00 23.12 20.75 2yuj s ALA 29 CO 0.32 -0.96 0.87 0.20 0.00 0.00 0.00 175.76 176.20 2yuj s GLY 30 N -4.44 -0.45 0.29 0.00 0.00 -1.26 -5.04 107.32 96.43 2yuj s GLY 30 Ca 0.57 0.86 0.04 0.00 0.00 0.00 0.00 44.72 46.19 2yuj s GLY 30 CO 0.42 0.28 1.79 -2.55 0.00 0.00 0.00 173.10 173.04 2yuj h PRO 31 N 2.00 0.78 0.00 2.90 0.11 -2.06 -3.44 132.00 132.30 2yuj h PRO 31 Ca -0.23 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2yuj h PRO 31 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2yuj h PRO 31 CO 0.31 0.52 0.00 0.09 -0.21 0.00 0.00 178.00 178.71 2yuj n ASN 32 N -4.74 0.00 -3.62 -2.05 3.02 -1.26 -5.16 115.26 101.45 2yuj n ASN 32 Ca 0.21 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.64 2yuj n ASN 32 Cb 0.50 0.23 -0.07 0.00 -0.61 0.00 0.00 39.78 39.83 2yuj n ASN 32 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2yuj s ASP 33 N 0.02 -0.61 -0.24 6.41 1.01 -1.26 -5.14 116.67 116.85 2yuj s ASP 33 Ca 0.00 1.09 -0.04 0.00 0.71 0.00 0.00 52.55 54.31 2yuj s ASP 33 Cb 0.00 1.08 0.08 0.00 1.01 0.00 0.00 42.92 45.09 2yuj s ASP 33 CO 0.00 -0.26 0.10 -0.13 0.21 0.00 0.00 175.17 175.09 2yuj s ARG 34 N 0.05 0.28 -0.52 8.23 1.81 -1.26 -5.00 118.95 122.53 2yuj s ARG 34 Ca -0.00 -0.44 0.00 0.00 -1.72 0.00 0.00 55.73 53.57 2yuj s ARG 34 Cb -0.04 -1.61 0.49 0.00 -0.45 0.00 0.00 34.95 33.35 2yuj s ARG 34 CO -0.00 -0.85 1.95 0.43 -0.68 0.00 0.00 175.30 176.14 2yuj n SER 35 N 5.18 5.89 -0.05 0.23 7.64 -1.26 -4.18 113.62 127.07 2yuj n SER 35 Ca -0.06 -3.58 -0.05 0.00 1.01 0.00 0.00 58.87 56.19 2yuj n SER 35 Cb 0.45 -0.92 -0.08 0.00 -1.01 0.00 0.00 64.21 62.65 2yuj n SER 35 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2yuj n ASP 36 N -0.83 2.52 0.11 6.43 9.92 -1.26 -4.40 116.55 129.05 2yuj n ASP 36 Ca 0.56 -0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.80 2yuj n ASP 36 Cb 1.04 0.73 0.04 0.00 -0.64 0.00 0.00 41.12 42.29 2yuj n ASP 36 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2yuj h VAL 37 N 0.00 1.36 -0.46 2.53 2.07 -1.96 -3.12 116.25 116.67 2yuj h VAL 37 Ca -0.27 -2.61 -0.01 0.00 0.82 0.00 0.00 66.70 64.63 2yuj h VAL 37 Cb 1.62 2.47 -0.00 0.00 -1.52 0.00 0.00 31.29 33.86 2yuj h VAL 37 CO 0.01 0.71 0.01 1.21 0.02 0.00 0.00 177.57 179.53 2yuj n GLU 38 N -3.45 4.09 -0.01 1.57 2.13 -1.26 -4.14 120.64 119.56 2yuj n GLU 38 Ca 0.00 -2.51 -0.01 0.00 0.66 0.00 0.00 57.16 55.29 2yuj n GLU 38 Cb 0.76 -2.11 -0.01 0.00 0.27 0.00 0.00 31.44 30.35 2yuj n GLU 38 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2yuj n LYS 39 N 0.48 0.77 0.00 5.31 5.02 -1.18 -4.66 118.16 123.89 2yuj n LYS 39 Ca 0.23 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 2yuj n LYS 39 Cb 1.02 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.98 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 3.29 2.20 3.05 0.72 0.00 -1.20 -4.77 105.19 108.47 2yuj n GLY 40 Ca -0.04 -1.96 -0.34 0.00 0.00 0.00 0.00 46.02 43.68 2yuj n GLY 40 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yuj s GLY 41 N -0.40 2.63 -0.02 -0.02 0.00 -1.16 -4.91 107.32 103.45 2yuj s GLY 41 Ca 0.00 -3.42 -0.15 0.00 0.00 0.00 0.00 44.72 41.14 2yuj s GLY 41 CO 0.00 1.10 0.33 0.54 0.00 0.00 0.00 173.10 175.06 2yuj s LYS 42 N -0.46 0.68 0.30 2.90 3.01 -1.25 -4.32 119.74 120.60 2yuj s LYS 42 Ca 0.19 -0.17 0.04 0.00 -1.01 0.00 0.00 55.97 55.02 2yuj s LYS 42 Cb -0.18 0.30 -0.03 0.00 -1.01 0.00 0.00 37.83 36.91 2yuj s LYS 42 CO -0.05 -0.19 0.20 0.96 0.51 0.00 0.00 175.35 176.78 2yuj s ILE 43 N -1.31 0.13 -0.20 2.17 -4.36 -0.68 -4.43 121.20 112.52 2yuj s ILE 43 Ca -0.13 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.25 2yuj s ILE 43 Cb -0.05 -2.50 0.06 0.00 1.25 0.00 0.00 42.46 41.22 2yuj s ILE 43 CO 0.04 0.00 -0.02 -0.63 0.24 0.00 0.00 174.94 174.57 2yuj s ILE 44 N -3.65 1.06 0.27 8.37 1.09 -1.02 -1.81 121.20 125.51 2yuj s ILE 44 Ca 0.38 -0.84 0.07 0.00 -1.10 0.00 0.00 60.65 59.16 2yuj s ILE 44 Cb 0.04 -1.39 -0.03 0.00 -1.06 0.00 0.00 42.46 40.02 2yuj s ILE 44 CO 0.20 -0.09 0.23 -0.04 -0.10 0.00 0.00 174.94 175.14 2yuj s MET 45 N 1.62 2.93 0.74 2.79 -1.94 -1.19 -1.78 119.30 122.47 2yuj s MET 45 Ca -0.03 -1.07 -0.16 0.00 -1.71 0.00 0.00 55.69 52.72 2yuj s MET 45 Cb -0.17 -2.58 -0.02 0.00 2.01 0.00 0.00 34.83 34.06 2yuj s MET 45 CO -0.07 0.34 0.62 -2.30 -0.01 0.00 0.00 175.02 173.60 2yuj n PRO 46 N -1.24 0.30 -0.22 2.03 -0.02 -1.26 -3.11 135.00 131.47 2yuj n PRO 46 Ca -0.07 0.15 0.17 0.00 -2.02 0.00 0.00 63.50 61.73 2yuj n PRO 46 Cb 0.58 -1.91 0.50 0.00 -0.02 0.00 0.00 33.50 32.65 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 -0.43 0.42 -0.02 0.52 0.11 -1.77 0.10 132.00 130.94 2yuj h PRO 47 Ca -0.46 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.63 2yuj h PRO 47 Cb 1.34 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 2yuj h PRO 47 CO 0.43 0.28 0.01 1.03 -0.21 0.00 0.00 178.00 179.54 2yuj h SER 48 N 0.43 0.00 -0.39 -2.05 0.87 -1.94 -2.36 113.55 108.12 2yuj h SER 48 Ca 0.44 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 61.02 2yuj h SER 48 Cb 1.03 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.96 2yuj h SER 48 CO -0.16 0.00 0.22 0.00 -0.53 0.00 0.00 176.83 176.36 2yuj h ALA 49 N 1.99 0.49 -0.65 6.23 0.00 -1.10 0.45 119.26 126.67 2yuj h ALA 49 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2yuj h ALA 49 Cb 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2yuj h ALA 49 CO -0.00 -0.13 0.34 1.25 0.00 0.00 0.00 179.25 180.71 2yuj h LEU 50 N 0.44 0.83 -0.44 0.00 5.85 -1.53 0.24 115.31 120.70 2yuj h LEU 50 Ca 0.16 -0.11 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 2yuj h LEU 50 Cb 0.03 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2yuj h LEU 50 CO -0.09 0.71 -0.42 0.44 -0.34 0.00 0.00 178.44 178.74 2yuj h ASP 51 N 0.90 0.90 0.39 1.25 5.19 -1.37 -3.00 116.42 120.68 2yuj h ASP 51 Ca 0.23 -0.42 -0.12 0.00 -0.62 0.00 0.00 57.03 56.09 2yuj h ASP 51 Cb 0.07 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 2yuj h ASP 51 CO -0.03 1.19 -0.52 -0.61 -3.12 0.00 0.00 179.24 176.15 2yuj h GLN 52 N 0.68 0.15 -0.60 3.56 4.15 0.18 -2.90 115.11 120.33 2yuj h GLN 52 Ca 0.05 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 2yuj h GLN 52 Cb 0.99 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.66 2yuj h GLN 52 CO 0.10 0.64 0.17 -0.07 -1.93 0.00 0.00 178.83 177.74 2yuj h LEU 53 N 0.12 0.85 -1.53 -2.39 3.38 -0.40 -1.65 115.31 113.68 2yuj h LEU 53 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2yuj h LEU 53 Cb 0.97 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2yuj h LEU 53 CO 0.08 0.81 0.00 -0.24 0.09 0.00 0.00 178.44 179.17 2yuj n SER 54 N -4.28 2.24 -0.02 -0.43 2.88 -1.14 -2.57 113.62 110.29 2yuj n SER 54 Ca 0.05 -2.03 -0.00 0.00 -1.33 0.00 0.00 58.87 55.55 2yuj n SER 54 Cb 0.22 -0.29 -0.06 0.00 -0.75 0.00 0.00 64.21 63.32 2yuj n SER 54 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2yuj n ARG 55 N 0.65 1.65 -0.66 -1.46 5.12 -0.70 -4.54 116.66 116.73 2yuj n ARG 55 Ca 0.13 -0.04 0.05 0.00 -1.93 0.00 0.00 57.85 56.07 2yuj n ARG 55 Cb 0.37 -1.20 0.29 0.00 -1.16 0.00 0.00 32.46 30.76 2yuj n ARG 55 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2yuj n LEU 56 N -2.06 4.49 -3.61 0.55 4.77 -0.75 -4.89 117.00 115.50 2yuj n LEU 56 Ca -0.08 -2.28 -0.24 0.00 -0.03 0.00 0.00 56.01 53.39 2yuj n LEU 56 Cb 0.51 -0.64 0.08 0.00 -2.33 0.00 0.00 43.42 41.04 2yuj n LEU 56 CO 0.17 0.53 0.25 0.59 -1.33 0.00 0.00 177.39 177.59 2yuj n ASN 57 N 0.44 -6.32 -4.70 -1.43 5.03 -1.26 -4.79 115.26 102.23 2yuj n ASN 57 Ca 0.21 -0.55 -0.37 0.00 0.87 0.00 0.00 54.58 54.74 2yuj n ASN 57 Cb 0.95 -5.01 -0.07 0.00 -1.02 0.00 0.00 39.78 34.63 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2yuj s ILE 58 N -3.32 5.25 0.25 2.41 -1.09 -1.06 -5.08 121.20 118.56 2yuj s ILE 58 Ca 0.59 0.64 0.10 0.00 -2.23 0.00 0.00 60.65 59.75 2yuj s ILE 58 Cb -0.26 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 2yuj s ILE 58 CO 0.73 0.32 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.79 2yuj s THR 59 N 0.91 3.09 0.41 2.92 2.01 -1.26 -4.66 115.64 119.06 2yuj s THR 59 Ca 0.18 -2.02 -0.26 0.00 0.31 0.00 0.00 61.69 59.91 2yuj s THR 59 Cb -0.14 -2.62 -0.08 0.00 0.01 0.00 0.00 72.50 69.66 2yuj s THR 59 CO 0.06 -0.33 1.28 -0.47 -0.69 0.00 0.00 174.62 174.47 2yuj s TYR 60 N -2.26 2.84 0.67 4.92 5.04 -1.26 -4.16 117.35 123.15 2yuj s TYR 60 Ca 0.30 1.43 -0.11 0.00 -2.44 0.00 0.00 57.07 56.25 2yuj s TYR 60 Cb -0.06 -3.63 -0.01 0.00 0.35 0.00 0.00 41.96 38.61 2yuj s TYR 60 CO 0.17 -1.98 1.05 -1.25 -1.34 0.00 0.00 175.55 172.20 2yuj s PRO 61 N -2.28 3.15 -0.65 4.97 0.04 -1.26 -5.11 135.00 133.86 2yuj s PRO 61 Ca 0.57 0.87 0.03 0.00 0.04 0.00 0.00 61.00 62.51 2yuj s PRO 61 Cb -0.37 -2.02 0.37 0.00 0.04 0.00 0.00 34.50 32.52 2yuj s PRO 61 CO 0.47 -0.93 1.39 -1.33 0.04 0.00 0.00 177.00 176.64 2yuj n MET 62 N -3.00 3.51 -2.40 4.56 2.81 -1.26 -4.93 117.12 116.40 2yuj n MET 62 Ca 0.07 -4.38 -0.43 0.00 -1.81 0.00 0.00 57.70 51.15 2yuj n MET 62 Cb 0.54 -2.28 -0.02 0.00 -0.71 0.00 0.00 33.22 30.74 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 -3.77 4.20 0.68 4.03 1.43 -1.26 -4.29 118.68 119.70 2yuj s LEU 63 Ca 0.48 1.75 -0.06 0.00 -1.03 0.00 0.00 54.13 55.26 2yuj s LEU 63 Cb 0.35 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 43.08 2yuj s LEU 63 CO -0.22 -0.75 0.99 -0.36 0.23 0.00 0.00 176.35 176.23 2yuj s PHE 64 N 3.36 3.00 -0.32 0.29 0.08 -0.84 -3.32 117.98 120.23 2yuj s PHE 64 Ca 0.56 0.50 0.03 0.00 0.12 0.00 0.00 56.93 58.14 2yuj s PHE 64 Cb -0.23 -3.08 0.09 0.00 -0.57 0.00 0.00 43.02 39.23 2yuj s PHE 64 CO 0.17 -1.26 0.03 0.21 -0.10 0.00 0.00 175.22 174.26 2yuj s LYS 65 N -5.18 1.51 -0.57 0.44 2.36 0.49 -3.42 119.74 115.36 2yuj s LYS 65 Ca 0.59 -1.65 -0.24 0.00 -2.55 0.00 0.00 55.97 52.11 2yuj s LYS 65 Cb -0.11 -2.98 0.04 0.00 -1.05 0.00 0.00 37.83 33.73 2yuj s LYS 65 CO 0.45 -0.87 0.98 -0.51 1.55 0.00 0.00 175.35 176.94 2yuj s LEU 66 N 1.04 4.04 -0.48 5.43 1.43 -0.83 -2.74 118.68 126.59 2yuj s LEU 66 Ca 0.07 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 52.67 2yuj s LEU 66 Cb -0.19 -2.81 0.11 0.00 0.03 0.00 0.00 46.19 43.33 2yuj s LEU 66 CO -0.09 -1.29 0.37 -0.89 0.23 0.00 0.00 176.35 174.68 2yuj s THR 67 N 4.11 4.61 -0.13 5.49 2.01 -0.41 -2.80 115.64 128.52 2yuj s THR 67 Ca 0.31 -1.52 -0.29 0.00 0.31 0.00 0.00 61.69 60.49 2yuj s THR 67 Cb -0.12 -3.93 -0.01 0.00 0.01 0.00 0.00 72.50 68.45 2yuj s THR 67 CO 0.19 -0.71 1.11 0.20 -0.69 0.00 0.00 174.62 174.72 2yuj s ASN 68 N 2.77 7.11 -0.46 3.53 -0.87 -0.62 -3.62 114.94 122.78 2yuj s ASN 68 Ca 0.04 1.61 0.03 0.00 -1.57 0.00 0.00 52.86 52.97 2yuj s ASN 68 Cb -0.26 -2.55 0.60 0.00 -0.02 0.00 0.00 41.25 39.02 2yuj s ASN 68 CO 0.02 -0.59 1.89 0.29 -2.57 0.00 0.00 177.10 176.15 2yuj n LYS 69 N 5.61 2.24 0.00 -0.60 4.76 -1.26 -3.21 118.16 125.71 2yuj n LYS 69 Ca 0.11 -2.88 0.00 0.00 -2.87 0.00 0.00 58.31 52.67 2yuj n LYS 69 Cb 0.47 -2.13 0.00 0.00 -1.84 0.00 0.00 35.03 31.53 2yuj n LYS 69 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2yuj n ASN 70 N -1.01 0.85 -0.57 4.39 4.13 -1.26 -4.84 115.26 116.95 2yuj n ASN 70 Ca 0.57 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.90 2yuj n ASN 70 Cb 1.46 0.00 0.17 0.00 -1.54 0.00 0.00 39.78 39.87 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 -2.46 3.08 -2.77 6.41 7.64 -1.26 -4.96 113.62 119.29 2yuj n SER 71 Ca 0.00 -2.55 -0.18 0.00 1.01 0.00 0.00 58.87 57.16 2yuj n SER 71 Cb 0.26 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2yuj n SER 71 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2yuj n ASP 72 N -0.30 -4.41 -4.86 6.43 9.92 -1.20 -4.94 116.55 117.19 2yuj n ASP 72 Ca 0.14 -0.06 -0.32 0.00 -0.53 0.00 0.00 54.79 54.03 2yuj n ASP 72 Cb 0.61 -3.68 -0.05 0.00 -0.64 0.00 0.00 41.12 37.36 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 -5.40 3.92 -0.24 -1.24 1.81 -1.23 -4.94 118.95 111.62 2yuj s ARG 73 Ca 0.15 0.56 -0.02 0.00 -1.72 0.00 0.00 55.73 54.71 2yuj s ARG 73 Cb -0.08 -2.45 0.13 0.00 -0.45 0.00 0.00 34.95 32.10 2yuj s ARG 73 CO 0.19 0.12 0.33 1.41 -0.68 0.00 0.00 175.30 176.67 2yuj s MET 74 N -3.21 0.31 0.21 3.54 -2.45 -1.26 -1.60 119.30 114.85 2yuj s MET 74 Ca 0.53 0.30 0.04 0.00 -1.25 0.00 0.00 55.69 55.31 2yuj s MET 74 Cb -0.10 -0.68 -0.05 0.00 1.25 0.00 0.00 34.83 35.24 2yuj s MET 74 CO 0.22 -0.75 -0.05 -0.08 1.05 0.00 0.00 175.02 175.42 2yuj s THR 75 N 2.46 1.19 -0.29 10.11 -1.32 -1.12 -4.93 115.64 121.74 2yuj s THR 75 Ca 0.10 -2.06 0.03 0.00 -1.21 0.00 0.00 61.69 58.54 2yuj s THR 75 Cb -0.15 -2.20 0.08 0.00 -1.51 0.00 0.00 72.50 68.71 2yuj s THR 75 CO -0.19 -0.45 -0.02 -1.00 -2.21 0.00 0.00 174.62 170.75 2yuj s HIS 76 N -3.32 3.15 0.55 9.09 3.76 -1.26 -1.96 115.29 125.31 2yuj s HIS 76 Ca 0.25 -2.42 0.07 0.00 -0.15 0.00 0.00 55.06 52.81 2yuj s HIS 76 Cb 0.04 -2.21 0.07 0.00 1.11 0.00 0.00 32.58 31.59 2yuj s HIS 76 CO 0.07 -0.88 0.76 0.00 -0.85 0.00 0.00 174.74 173.84 2yuj s GLY 78 N -4.58 0.15 0.38 0.00 0.00 -1.26 -1.99 107.32 100.03 2yuj s GLY 78 Ca 0.60 -0.11 -0.18 0.00 0.00 0.00 0.00 44.72 45.03 2yuj s GLY 78 CO 0.38 -0.06 0.86 0.54 0.00 0.00 0.00 173.10 174.82 2yuj s VAL 79 N 0.01 4.52 0.24 1.40 0.11 -1.26 -1.69 120.40 123.72 2yuj s VAL 79 Ca 0.00 1.25 0.00 0.00 -2.93 0.00 0.00 61.98 60.30 2yuj s VAL 79 Cb -0.02 -3.61 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 2yuj s VAL 79 CO -0.00 -0.26 0.00 -0.11 -3.33 0.00 0.00 175.10 171.40 2yuj n LEU 80 N -0.51 0.04 -4.93 2.54 7.94 -0.75 -4.75 117.00 116.57 2yuj n LEU 80 Ca 0.05 0.40 -0.25 0.00 -1.11 0.00 0.00 56.01 55.11 2yuj n LEU 80 Cb 0.54 0.27 -0.01 0.00 0.53 0.00 0.00 43.42 44.75 2yuj n LEU 80 CO 0.39 -0.76 0.26 -1.61 -1.11 0.00 0.00 177.39 174.56 2yuj s GLU 81 N -2.00 3.44 -0.40 1.96 8.01 -0.98 -5.04 118.70 123.70 2yuj s GLU 81 Ca 0.00 -0.22 0.08 0.00 0.01 0.00 0.00 54.97 54.85 2yuj s GLU 81 Cb 0.00 -2.58 0.26 0.00 -4.31 0.00 0.00 34.13 27.51 2yuj s GLU 81 CO 0.00 0.00 0.59 1.19 0.01 0.00 0.00 175.26 177.05 2yuj n PHE 82 N -1.95 -0.62 -2.28 1.61 3.72 -1.26 -3.17 117.46 113.52 2yuj n PHE 82 Ca -0.03 -3.40 -0.02 0.00 -0.05 0.00 0.00 57.45 53.95 2yuj n PHE 82 Cb 0.56 -0.15 -0.02 0.00 -0.94 0.00 0.00 39.48 38.94 2yuj n PHE 82 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 2yuj n VAL 83 N 1.27 0.06 -2.11 -4.37 0.24 -1.21 -4.39 118.33 107.83 2yuj n VAL 83 Ca 0.20 -0.60 -0.28 0.00 -2.04 0.00 0.00 64.34 61.62 2yuj n VAL 83 Cb 0.56 0.77 0.19 0.00 -1.47 0.00 0.00 33.84 33.88 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 -0.17 2.53 0.27 2.33 0.00 -1.18 -4.92 121.76 120.62 2yuj s ALA 84 Ca 0.16 -1.47 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 2yuj s ALA 84 Cb 0.20 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.75 2yuj s ALA 84 CO -0.08 -2.38 0.47 0.34 0.00 0.00 0.00 175.76 174.12 2yuj s ASP 85 N -4.93 6.36 0.06 0.00 -1.08 -1.24 -4.23 116.67 111.62 2yuj s ASP 85 Ca 0.75 0.45 -0.30 0.00 -0.52 0.00 0.00 52.55 52.93 2yuj s ASP 85 Cb -0.02 -2.03 -0.09 0.00 -1.46 0.00 0.00 42.92 39.31 2yuj s ASP 85 CO 0.52 -0.15 1.95 -0.62 0.52 0.00 0.00 175.17 177.38 2yuj n GLU 86 N -1.12 2.87 -1.92 4.34 1.02 -1.26 -1.45 120.64 123.12 2yuj n GLU 86 Ca -0.04 1.05 -0.06 0.00 -0.02 0.00 0.00 57.16 58.09 2yuj n GLU 86 Cb 0.55 -3.00 -0.01 0.00 -0.02 0.00 0.00 31.44 28.97 2yuj n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2yuj n GLY 87 N 4.49 0.27 2.79 0.62 0.00 -1.26 -5.02 105.19 107.08 2yuj n GLY 87 Ca 0.20 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.26 -0.40 -0.13 -0.61 1.01 -0.53 -4.23 121.20 114.05 2yuj s ILE 88 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 2yuj s ILE 88 Cb 0.00 -0.78 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 2yuj s ILE 88 CO 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 174.94 174.67 2yuj s TYR 90 N -0.01 3.64 0.04 0.00 2.02 -0.74 -0.86 117.35 121.43 2yuj s TYR 90 Ca 0.02 1.06 0.02 0.00 -0.37 0.00 0.00 57.07 57.80 2yuj s TYR 90 Cb -0.13 -2.53 -0.02 0.00 -0.40 0.00 0.00 41.96 38.88 2yuj s TYR 90 CO 0.02 0.35 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.77 2yuj s LEU 91 N -0.10 2.25 0.00 -1.29 1.43 -0.50 -2.42 118.68 118.05 2yuj s LEU 91 Ca 0.28 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2yuj s LEU 91 Cb -0.17 -0.12 0.06 0.00 0.03 0.00 0.00 46.19 45.99 2yuj s LEU 91 CO 0.14 -0.22 0.14 -2.65 0.23 0.00 0.00 176.35 174.00 2yuj n PRO 92 N 1.49 -1.17 -0.09 1.29 -0.02 -1.26 -3.54 135.00 131.70 2yuj n PRO 92 Ca -0.23 -0.24 -0.20 0.00 -2.02 0.00 0.00 63.50 60.81 2yuj n PRO 92 Cb 0.55 -0.39 -0.12 0.00 -0.02 0.00 0.00 33.50 33.52 2yuj n PRO 92 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2yuj n HIS 93 N -3.21 0.41 -0.19 6.00 -0.00 -1.26 -3.59 115.22 113.38 2yuj n HIS 93 Ca 0.02 0.10 -0.07 0.00 0.46 0.00 0.00 57.72 58.23 2yuj n HIS 93 Cb 0.10 -1.05 0.02 0.00 -0.12 0.00 0.00 29.99 28.94 2yuj n HIS 93 CO 0.00 0.00 0.00 0.11 0.46 0.00 0.00 176.34 176.91 2yuj h TRP 94 N -0.11 0.74 -0.35 1.57 5.08 -1.94 -1.13 115.95 119.82 2yuj h TRP 94 Ca -0.54 -0.01 -0.14 0.00 1.08 0.00 0.00 58.89 59.28 2yuj h TRP 94 Cb 1.89 -0.24 -0.01 0.00 -3.00 0.00 0.00 29.16 27.80 2yuj h TRP 94 CO 0.04 0.53 -0.35 1.98 -1.28 0.00 0.00 178.44 179.36 2yuj h MET 95 N 0.74 0.80 -0.10 0.12 4.05 -1.87 0.64 114.93 119.31 2yuj h MET 95 Ca 0.19 -0.39 -0.06 0.00 -0.28 0.00 0.00 59.70 59.17 2yuj h MET 95 Cb 0.02 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 2yuj h MET 95 CO -0.03 1.02 -0.20 1.98 0.23 0.00 0.00 176.91 179.91 2yuj h MET 96 N 0.66 0.16 0.19 0.39 4.05 -1.54 -2.04 114.93 116.80 2yuj h MET 96 Ca 0.06 -0.04 -0.35 0.00 -0.28 0.00 0.00 59.70 59.09 2yuj h MET 96 Cb 0.90 -0.02 0.01 0.00 -0.80 0.00 0.00 31.60 31.69 2yuj h MET 96 CO 0.08 0.36 -1.74 0.37 0.23 0.00 0.00 176.91 176.21 2yuj h GLN 97 N 0.15 0.41 -0.43 0.39 4.15 -1.02 -2.20 115.11 116.55 2yuj h GLN 97 Ca 0.03 -0.70 0.01 0.00 0.77 0.00 0.00 58.65 58.76 2yuj h GLN 97 Cb 0.44 0.26 -0.02 0.00 0.21 0.00 0.00 27.48 28.37 2yuj h GLN 97 CO 0.03 1.33 0.29 -0.97 -1.93 0.00 0.00 178.83 177.58 2yuj h ASN 98 N 0.11 0.49 0.65 -0.69 -1.24 -0.73 -1.21 115.58 112.95 2yuj h ASN 98 Ca -0.34 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.66 2yuj h ASN 98 Cb 2.11 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 41.04 2yuj h ASN 98 CO 0.19 0.35 -0.65 0.18 -1.29 0.00 0.00 177.43 176.21 2yuj n LEU 99 N -4.47 0.60 -3.09 0.34 4.77 -0.78 -4.95 117.00 109.42 2yuj n LEU 99 Ca 0.04 0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.90 2yuj n LEU 99 Cb 0.06 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2yuj n LEU 99 CO 0.35 0.03 0.16 0.18 -1.33 0.00 0.00 177.39 176.79 2yuj n LEU 100 N -1.85 -3.06 -4.95 2.23 4.77 -0.46 -4.84 117.00 108.84 2yuj n LEU 100 Ca 0.04 -0.42 -0.28 0.00 -0.03 0.00 0.00 56.01 55.32 2yuj n LEU 100 Cb 0.40 -2.73 0.18 0.00 -2.33 0.00 0.00 43.42 38.93 2yuj n LEU 100 CO 0.36 0.48 0.81 -0.76 -1.33 0.00 0.00 177.39 176.96 2yuj s LEU 101 N -6.41 2.79 0.00 2.23 1.43 -0.85 -5.04 118.68 112.82 2yuj s LEU 101 Ca 0.45 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.67 2yuj s LEU 101 Cb -0.20 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.88 2yuj s LEU 101 CO 0.56 -2.61 0.23 -0.62 0.23 0.00 0.00 176.35 174.14 2yuj n GLU 102 N -3.59 0.48 -2.16 1.70 1.02 -1.26 -4.92 120.64 111.91 2yuj n GLU 102 Ca 0.16 -3.48 -0.42 0.00 -0.02 0.00 0.00 57.16 53.40 2yuj n GLU 102 Cb 0.60 2.46 -0.03 0.00 -0.02 0.00 0.00 31.44 34.45 2yuj n GLU 102 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2yuj s GLU 103 N -3.48 4.29 -1.05 3.49 0.41 -1.26 -2.57 118.70 118.53 2yuj s GLU 103 Ca 0.33 2.07 0.00 0.00 -0.41 0.00 0.00 54.97 56.96 2yuj s GLU 103 Cb 0.02 -3.42 0.00 0.00 -1.78 0.00 0.00 34.13 28.95 2yuj s GLU 103 CO 0.23 -0.53 0.00 0.41 -0.49 0.00 0.00 175.26 174.88 2yuj n GLY 104 N 3.62 0.13 3.73 -1.39 0.00 -1.05 -4.97 105.19 105.26 2yuj n GLY 104 Ca 0.13 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.54 2.73 -0.14 -0.02 0.00 -1.06 -4.67 107.32 101.61 2yuj s GLY 105 Ca 0.00 0.25 -0.25 0.00 0.00 0.00 0.00 44.72 44.72 2yuj s GLY 105 CO 0.00 1.22 0.81 1.08 0.00 0.00 0.00 173.10 176.21 2yuj s LEU 106 N 0.50 4.21 -0.04 0.66 1.43 -1.26 -0.42 118.68 123.76 2yuj s LEU 106 Ca 0.40 1.20 0.06 0.00 -1.03 0.00 0.00 54.13 54.76 2yuj s LEU 106 Cb -0.19 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 42.79 2yuj s LEU 106 CO 0.21 -0.34 -0.23 -0.69 0.23 0.00 0.00 176.35 175.54 2yuj s VAL 107 N 1.84 1.84 -0.06 -1.59 1.01 -0.86 -4.87 120.40 117.71 2yuj s VAL 107 Ca 0.39 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 2yuj s VAL 107 Cb -0.17 -1.55 -0.06 0.00 0.00 0.00 0.00 36.38 34.61 2yuj s VAL 107 CO 0.14 0.52 1.69 -1.10 0.00 0.00 0.00 175.10 176.35 2yuj s GLN 108 N -0.26 4.12 0.14 2.72 -1.52 -1.24 -2.76 119.66 120.86 2yuj s GLN 108 Ca 0.01 2.18 0.06 0.00 -1.95 0.00 0.00 55.36 55.66 2yuj s GLN 108 Cb -0.12 -4.01 -0.04 0.00 -0.22 0.00 0.00 33.01 28.62 2yuj s GLN 108 CO 0.02 -0.92 0.04 0.08 -0.25 0.00 0.00 175.29 174.25 2yuj s VAL 109 N 4.27 4.03 0.13 1.09 1.01 -0.44 -1.29 120.40 129.20 2yuj s VAL 109 Ca 0.75 -1.18 -0.20 0.00 0.00 0.00 0.00 61.98 61.36 2yuj s VAL 109 Cb -0.33 -3.00 0.05 0.00 0.00 0.00 0.00 36.38 33.10 2yuj s VAL 109 CO 0.31 -0.03 0.50 -1.61 0.00 0.00 0.00 175.10 174.27 2yuj s GLU 110 N -2.76 1.15 -0.26 2.72 2.02 -1.11 -2.95 118.70 117.52 2yuj s GLU 110 Ca 0.28 -0.56 -0.05 0.00 0.02 0.00 0.00 54.97 54.66 2yuj s GLU 110 Cb -0.10 0.52 0.00 0.00 0.10 0.00 0.00 34.13 34.65 2yuj s GLU 110 CO 0.20 -0.47 0.02 -1.54 0.02 0.00 0.00 175.26 173.48 2yuj s SER 111 N -2.70 4.75 0.12 -0.19 1.04 -1.02 -0.38 113.70 115.32 2yuj s SER 111 Ca 0.01 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.87 2yuj s SER 111 Cb 0.00 -1.80 -0.04 0.00 0.10 0.00 0.00 66.02 64.28 2yuj s SER 111 CO -0.11 -0.12 -0.10 0.68 0.98 0.00 0.00 173.24 174.57 2yuj s VAL 112 N 1.47 1.04 -0.30 5.02 -7.23 -1.21 -4.92 120.40 114.27 2yuj s VAL 112 Ca 0.03 -1.91 -0.03 0.00 -1.81 0.00 0.00 61.98 58.26 2yuj s VAL 112 Cb -0.16 -1.67 0.04 0.00 0.56 0.00 0.00 36.38 35.14 2yuj s VAL 112 CO -0.00 -0.70 0.02 0.21 -0.31 0.00 0.00 175.10 174.31 2yuj s ASN 113 N -2.92 4.89 0.42 4.85 3.84 -1.26 -4.38 114.94 120.37 2yuj s ASN 113 Ca 0.12 -1.10 0.08 0.00 0.21 0.00 0.00 52.86 52.17 2yuj s ASN 113 Cb 0.01 -1.75 -0.02 0.00 -0.55 0.00 0.00 41.25 38.94 2yuj s ASN 113 CO -0.00 -0.24 0.39 -0.76 -2.79 0.00 0.00 177.10 173.70 2yuj s LEU 114 N 1.32 3.39 0.31 3.21 1.43 -1.26 -5.09 118.68 121.99 2yuj s LEU 114 Ca -0.03 -0.74 0.05 0.00 -1.03 0.00 0.00 54.13 52.39 2yuj s LEU 114 Cb -0.19 -2.07 -0.06 0.00 0.03 0.00 0.00 46.19 43.90 2yuj s LEU 114 CO -0.01 -0.67 0.01 0.00 0.23 0.00 0.00 176.35 175.91 2yuj s GLN 115 N -4.15 1.63 0.91 1.70 0.00 -1.26 -4.52 119.66 113.97 2yuj s GLN 115 Ca 0.48 -1.87 -0.11 0.00 -0.00 0.00 0.00 55.36 53.86 2yuj s GLN 115 Cb -0.04 -1.05 0.11 0.00 0.00 0.00 0.00 33.01 32.03 2yuj s GLN 115 CO 0.28 -0.08 0.95 1.33 0.00 0.00 0.00 175.29 177.76 2yuj n VAL 116 N -0.66 0.33 -3.86 3.63 0.24 -1.18 -0.63 118.33 116.20 2yuj n VAL 116 Ca -0.04 -0.09 -0.28 0.00 -2.04 0.00 0.00 64.34 61.89 2yuj n VAL 116 Cb 0.65 -0.92 -0.03 0.00 -1.47 0.00 0.00 33.84 32.07 2yuj n VAL 116 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yuj s ALA 117 N -2.49 3.94 -0.09 2.33 0.00 -1.26 -4.54 121.76 119.65 2yuj s ALA 117 Ca 0.65 -0.90 0.07 0.00 0.00 0.00 0.00 51.96 51.79 2yuj s ALA 117 Cb -0.24 -1.87 -0.11 0.00 0.00 0.00 0.00 23.12 20.91 2yuj s ALA 117 CO 0.59 0.61 0.02 -2.37 0.00 0.00 0.00 175.76 174.61 2yuj n THR 118 N -0.28 0.62 -3.50 0.00 5.66 -1.05 -4.54 114.28 111.19 2yuj n THR 118 Ca -0.06 -0.37 -0.22 0.00 -3.05 0.00 0.00 64.05 60.36 2yuj n THR 118 Cb 0.53 -0.77 -0.13 0.00 -1.55 0.00 0.00 70.33 68.40 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 -2.22 -0.10 -0.05 1.09 6.14 -1.26 -1.69 117.35 119.25 2yuj s TYR 119 Ca -0.06 -0.20 0.02 0.00 0.64 0.00 0.00 57.07 57.48 2yuj s TYR 119 Cb 0.03 -0.56 -0.03 0.00 0.42 0.00 0.00 41.96 41.82 2yuj s TYR 119 CO 0.36 -0.71 -0.10 -1.12 0.64 0.00 0.00 175.55 174.63 2yuj s SER 120 N 2.25 4.40 -0.13 4.32 0.01 -0.44 -0.98 113.70 123.14 2yuj s SER 120 Ca 0.07 -0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.25 2yuj s SER 120 Cb -0.15 -1.03 0.01 0.00 0.21 0.00 0.00 66.02 65.05 2yuj s SER 120 CO -0.22 0.34 -0.23 -0.75 0.41 0.00 0.00 173.24 172.80 2yuj s LYS 121 N -0.87 3.03 0.19 12.44 2.20 0.18 -0.30 119.74 136.61 2yuj s LYS 121 Ca 0.13 -0.86 0.10 0.00 -0.36 0.00 0.00 55.97 54.98 2yuj s LYS 121 Cb -0.11 -2.39 -0.04 0.00 -1.51 0.00 0.00 37.83 33.78 2yuj s LYS 121 CO 0.02 0.05 -0.18 -0.06 -0.36 0.00 0.00 175.35 174.82 2yuj s PHE 122 N 0.65 2.44 -0.34 4.03 0.40 -1.19 -0.31 117.98 123.66 2yuj s PHE 122 Ca -0.11 -0.30 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 2yuj s PHE 122 Cb -0.16 -1.20 0.12 0.00 0.51 0.00 0.00 43.02 42.29 2yuj s PHE 122 CO 0.02 0.51 0.16 -1.14 0.70 0.00 0.00 175.22 175.47 2yuj s GLN 123 N -2.74 0.66 -0.35 0.44 0.74 -0.56 -1.83 119.66 116.01 2yuj s GLN 123 Ca 0.23 -1.21 -0.36 0.00 0.05 0.00 0.00 55.36 54.06 2yuj s GLN 123 Cb -0.08 -1.68 -0.12 0.00 1.10 0.00 0.00 33.01 32.22 2yuj s GLN 123 CO 0.12 -1.09 2.16 -2.30 -0.55 0.00 0.00 175.29 173.63 2yuj n PRO 124 N 4.46 1.00 -0.01 1.67 -0.02 -1.26 -3.08 135.00 137.75 2yuj n PRO 124 Ca 0.03 0.28 0.01 0.00 -2.02 0.00 0.00 63.50 61.80 2yuj n PRO 124 Cb 0.39 -2.35 0.32 0.00 -0.02 0.00 0.00 33.50 31.83 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 11.73 0.55 -6.19 -0.52 1.08 -1.83 -3.43 115.11 116.51 2yuj h GLN 125 Ca -0.27 -0.10 -0.65 0.00 -1.45 0.00 0.00 58.65 56.18 2yuj h GLN 125 Cb 1.33 -0.09 -0.11 0.00 -0.05 0.00 0.00 27.48 28.55 2yuj h GLN 125 CO 1.02 0.52 -0.63 -1.12 -0.95 0.00 0.00 178.83 177.68 2yuj s SER 126 N -6.71 5.28 0.48 1.46 0.01 -1.23 -5.01 113.70 107.99 2yuj s SER 126 Ca -0.08 -0.03 0.30 0.00 1.31 0.00 0.00 55.95 57.45 2yuj s SER 126 Cb 0.16 -1.38 1.13 0.00 0.21 0.00 0.00 66.02 66.14 2yuj s SER 126 CO 0.76 0.22 1.88 1.55 0.41 0.00 0.00 173.24 178.06 2yuj h PRO 127 N 3.77 0.00 -0.80 12.44 0.13 -1.94 -3.16 132.00 142.43 2yuj h PRO 127 Ca -0.48 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.77 2yuj h PRO 127 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 2yuj h PRO 127 CO 0.61 0.00 0.52 -0.44 -0.23 0.00 0.00 178.00 178.46 2yuj h ASP 128 N 0.00 0.60 -0.18 1.44 5.19 -1.96 -1.16 116.42 120.35 2yuj h ASP 128 Ca 0.00 0.02 -0.07 0.00 -0.62 0.00 0.00 57.03 56.36 2yuj h ASP 128 Cb 0.59 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 39.99 2yuj h ASP 128 CO 0.00 0.34 -0.17 0.15 -3.12 0.00 0.00 179.24 176.43 2yuj h PHE 129 N 0.65 0.53 -0.29 4.55 3.57 -1.91 -3.06 116.94 120.98 2yuj h PHE 129 Ca 0.38 -0.16 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 2yuj h PHE 129 Cb 0.59 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 2yuj h PHE 129 CO -0.00 0.80 0.16 -0.07 -2.23 0.00 0.00 178.31 176.97 2yuj h LEU 130 N 0.11 0.34 -1.80 0.59 3.38 -1.49 -1.11 115.31 115.33 2yuj h LEU 130 Ca 0.03 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2yuj h LEU 130 Cb 0.71 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 2yuj h LEU 130 CO 0.04 0.28 -0.15 0.44 0.09 0.00 0.00 178.44 179.14 2yuj h ASP 131 N 0.39 0.00 -2.82 -0.43 5.19 -1.15 -3.43 116.42 114.18 2yuj h ASP 131 Ca 0.10 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.99 2yuj h ASP 131 Cb 0.01 0.00 0.06 0.00 0.18 0.00 0.00 39.33 39.58 2yuj h ASP 131 CO -0.02 0.15 0.97 -0.63 -3.12 0.00 0.00 179.24 176.59 2yuj s ILE 132 N -4.47 2.14 0.18 0.35 1.01 -0.42 -4.90 121.20 115.09 2yuj s ILE 132 Ca -0.04 0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 2yuj s ILE 132 Cb 0.15 -3.06 0.09 0.00 0.01 0.00 0.00 42.46 39.65 2yuj s ILE 132 CO 0.64 0.01 1.75 0.00 0.00 0.00 0.00 174.94 177.34 2yuj h THR 133 N 3.76 1.23 -3.13 2.92 1.03 -1.87 -3.32 112.91 113.54 2yuj h THR 133 Ca -0.44 -0.71 -0.68 0.00 -0.01 0.00 0.00 66.41 64.57 2yuj h THR 133 Cb 1.20 0.50 -0.37 0.00 -1.07 0.00 0.00 68.15 68.41 2yuj h THR 133 CO 0.92 0.28 -0.22 -3.20 -0.01 0.00 0.00 175.52 173.29 2yuj n ASN 134 N -4.44 3.97 0.15 0.00 4.05 -1.26 -4.88 115.26 112.85 2yuj n ASN 134 Ca 0.04 -3.20 -0.00 0.00 0.45 0.00 0.00 54.58 51.87 2yuj n ASN 134 Cb 0.16 -0.95 0.21 0.00 1.23 0.00 0.00 39.78 40.43 2yuj n ASN 134 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2yuj h PRO 135 N 5.62 0.00 -0.07 1.20 0.13 -1.86 -3.00 132.00 134.02 2yuj h PRO 135 Ca 0.17 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.23 2yuj h PRO 135 Cb 0.77 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 2yuj h PRO 135 CO 0.84 0.56 -0.24 0.87 -0.23 0.00 0.00 178.00 179.81 2yuj h LYS 136 N 0.00 0.12 -0.00 0.86 1.57 -1.94 -1.11 116.57 116.08 2yuj h LYS 136 Ca -0.01 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2yuj h LYS 136 Cb 1.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2yuj h LYS 136 CO 0.07 0.36 -0.01 0.00 -0.57 0.00 0.00 179.45 179.30 2yuj h ALA 137 N 1.65 0.00 -0.09 3.86 0.00 -1.95 -1.27 119.26 121.47 2yuj h ALA 137 Ca 0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 2yuj h ALA 137 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2yuj h ALA 137 CO 0.03 -0.10 -0.07 0.28 0.00 0.00 0.00 179.25 179.39 2yuj h VAL 138 N -0.76 1.11 0.18 0.00 2.07 -1.47 0.82 116.25 118.21 2yuj h VAL 138 Ca -0.00 -0.47 -0.30 0.00 0.82 0.00 0.00 66.70 66.75 2yuj h VAL 138 Cb 0.79 1.12 0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2yuj h VAL 138 CO 0.00 0.14 -1.35 0.25 0.02 0.00 0.00 177.57 176.64 2yuj h LEU 139 N 0.13 0.65 0.01 2.57 5.85 -1.25 -3.13 115.31 120.13 2yuj h LEU 139 Ca 0.03 -0.68 -0.22 0.00 0.84 0.00 0.00 57.88 57.85 2yuj h LEU 139 Cb 0.21 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2yuj h LEU 139 CO 0.01 1.53 -1.05 -0.33 -0.34 0.00 0.00 178.44 178.27 2yuj h GLU 140 N 0.12 0.03 -0.04 1.25 5.08 -0.80 -2.51 114.58 117.71 2yuj h GLU 140 Ca -0.19 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.04 2yuj h GLU 140 Cb 2.05 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.31 2yuj h GLU 140 CO 0.24 1.01 -0.34 -0.91 -1.00 0.00 0.00 179.01 178.01 2yuj h ASN 141 N 0.01 0.08 0.62 1.42 2.35 0.57 -2.94 115.58 117.68 2yuj h ASN 141 Ca -0.03 -0.03 -0.26 0.00 -0.55 0.00 0.00 56.30 55.43 2yuj h ASN 141 Cb 1.80 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 40.10 2yuj h ASN 141 CO 0.14 0.42 -1.54 0.00 -1.65 0.00 0.00 177.43 174.80 2yuj h ALA 142 N 1.59 0.69 -0.15 -0.83 0.00 -1.58 -3.34 119.26 115.64 2yuj h ALA 142 Ca 0.01 -1.30 0.04 0.00 0.00 0.00 0.00 54.91 53.66 2yuj h ALA 142 Cb 0.64 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2yuj h ALA 142 CO 0.05 1.46 0.11 -0.07 0.00 0.00 0.00 179.25 180.80 2yuj h LEU 143 N 0.00 0.00 -1.74 0.00 3.38 -1.27 -0.94 115.31 114.74 2yuj h LEU 143 Ca -0.22 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.77 2yuj h LEU 143 Cb 1.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.66 2yuj h LEU 143 CO 0.09 0.00 0.21 0.03 0.09 0.00 0.00 178.44 178.86 2yuj h ARG 144 N 0.00 0.34 -0.01 1.13 2.47 -1.66 -1.24 114.38 115.40 2yuj h ARG 144 Ca 0.07 -0.02 -0.17 0.00 -1.26 0.00 0.00 59.98 58.60 2yuj h ARG 144 Cb 0.29 -0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 2yuj h ARG 144 CO -0.00 0.22 -0.76 -0.97 0.56 0.00 0.00 179.97 179.02 2yuj h ASN 145 N 0.35 0.11 -3.84 7.04 -0.73 -1.39 -3.45 115.58 113.67 2yuj h ASN 145 Ca 0.13 -0.08 -0.47 0.00 1.87 0.00 0.00 56.30 57.74 2yuj h ASN 145 Cb 0.09 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.62 2yuj h ASN 145 CO -0.03 0.83 0.26 -0.36 -0.37 0.00 0.00 177.43 177.76 2yuj s PHE 146 N -3.35 3.54 -0.13 0.67 0.08 -0.47 -2.97 117.98 115.35 2yuj s PHE 146 Ca -0.02 1.58 0.12 0.00 0.12 0.00 0.00 56.93 58.73 2yuj s PHE 146 Cb 0.11 -2.79 -0.17 0.00 -0.57 0.00 0.00 43.02 39.61 2yuj s PHE 146 CO 0.80 0.14 0.06 0.00 -0.10 0.00 0.00 175.22 176.11 2yuj n ALA 147 N 0.15 1.70 -2.21 5.36 0.00 -1.26 -4.90 120.51 119.36 2yuj n ALA 147 Ca 0.03 -0.87 -0.12 0.00 0.00 0.00 0.00 53.44 52.47 2yuj n ALA 147 Cb 0.52 -0.06 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 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 -3.13 1.36 -0.15 0.00 1.43 -1.16 -4.94 118.68 112.10 2yuj s LEU 149 Ca 0.24 -1.52 -0.21 0.00 -1.03 0.00 0.00 54.13 51.61 2yuj s LEU 149 Cb 0.07 0.53 0.05 0.00 0.03 0.00 0.00 46.19 46.87 2yuj s LEU 149 CO 0.03 -0.95 0.54 -0.89 0.23 0.00 0.00 176.35 175.31 2yuj s THR 150 N -3.84 0.01 -0.61 5.49 2.01 -1.24 -3.49 115.64 113.97 2yuj s THR 150 Ca 0.39 -0.07 -0.27 0.00 0.31 0.00 0.00 61.69 62.04 2yuj s THR 150 Cb 0.05 -0.80 0.03 0.00 0.01 0.00 0.00 72.50 71.79 2yuj s THR 150 CO 0.18 -0.04 1.15 0.28 -0.69 0.00 0.00 174.62 175.51 2yuj s THR 151 N -0.27 4.04 0.00 -0.82 -1.32 -1.15 -3.62 115.64 112.50 2yuj s THR 151 Ca -0.04 0.63 0.00 0.00 -1.21 0.00 0.00 61.69 61.07 2yuj s THR 151 Cb -0.03 -4.73 0.00 0.00 -1.51 0.00 0.00 72.50 66.23 2yuj s THR 151 CO 0.03 -1.41 0.00 0.61 -2.21 0.00 0.00 174.62 171.64 2yuj n GLY 152 N 5.15 1.31 3.12 6.08 0.00 -0.97 -4.92 105.19 114.96 2yuj n GLY 152 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.00 1.47 -0.43 1.61 1.01 -1.24 -4.94 116.67 112.15 2yuj s ASP 153 Ca 0.00 -0.46 -0.15 0.00 0.71 0.00 0.00 52.55 52.65 2yuj s ASP 153 Cb 0.00 -0.08 0.04 0.00 1.01 0.00 0.00 42.92 43.89 2yuj s ASP 153 CO 0.00 -0.01 0.35 -0.69 0.21 0.00 0.00 175.17 175.03 2yuj s VAL 154 N -0.91 5.23 -0.23 -1.27 1.01 -1.26 -1.63 120.40 121.35 2yuj s VAL 154 Ca -0.00 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 2yuj s VAL 154 Cb -0.08 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 2yuj s VAL 154 CO 0.01 -0.42 0.00 0.27 0.00 0.00 0.00 175.10 174.97 2yuj s ILE 155 N 1.73 3.79 0.22 2.22 -4.36 -0.78 -4.76 121.20 119.25 2yuj s ILE 155 Ca 0.05 -0.35 -0.30 0.00 -0.26 0.00 0.00 60.65 59.79 2yuj s ILE 155 Cb -0.21 -2.74 -0.09 0.00 1.25 0.00 0.00 42.46 40.68 2yuj s ILE 155 CO 0.09 0.40 0.98 0.00 0.24 0.00 0.00 174.94 176.65 2yuj s ALA 156 N 1.43 3.34 -0.03 2.27 0.00 -1.26 -3.70 121.76 123.81 2yuj s ALA 156 Ca 0.05 0.68 0.05 0.00 0.00 0.00 0.00 51.96 52.74 2yuj s ALA 156 Cb -0.15 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.72 2yuj s ALA 156 CO 0.00 0.08 -0.17 0.96 0.00 0.00 0.00 175.76 176.63 2yuj s ILE 157 N -0.94 1.36 -0.02 0.00 -4.36 -1.10 -4.90 121.20 111.25 2yuj s ILE 157 Ca 0.43 -0.70 -0.06 0.00 -0.26 0.00 0.00 60.65 60.06 2yuj s ILE 157 Cb -0.27 -1.16 0.00 0.00 1.25 0.00 0.00 42.46 42.29 2yuj s ILE 157 CO 0.34 0.39 0.13 0.21 0.24 0.00 0.00 174.94 176.24 2yuj s ASN 158 N -0.13 -0.03 0.00 4.36 3.84 -1.26 -0.89 114.94 120.83 2yuj s ASN 158 Ca 0.00 -0.03 0.00 0.00 0.21 0.00 0.00 52.86 53.04 2yuj s ASN 158 Cb -0.09 0.23 0.00 0.00 -0.55 0.00 0.00 41.25 40.84 2yuj s ASN 158 CO 0.01 -0.23 0.00 0.00 -2.79 0.00 0.00 177.10 174.09 2yuj n TYR 159 N 2.10 -1.64 -1.85 0.43 4.11 -1.26 -4.95 117.16 114.10 2yuj n TYR 159 Ca -0.19 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.40 2yuj n TYR 159 Cb 0.57 0.36 0.04 0.00 -0.00 0.00 0.00 39.34 40.31 2yuj n TYR 159 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 2yuj n ASN 160 N -2.23 6.42 -2.46 9.48 6.94 -1.26 -4.86 115.26 127.29 2yuj n ASN 160 Ca 0.00 -3.78 -0.20 0.00 -0.02 0.00 0.00 54.58 50.58 2yuj n ASN 160 Cb 0.00 -0.74 0.00 0.00 -2.36 0.00 0.00 39.78 36.68 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2yuj n GLU 161 N -0.70 -2.60 -3.59 -3.83 1.02 -1.26 -4.97 120.64 104.71 2yuj n GLU 161 Ca 0.52 0.93 -0.29 0.00 -0.02 0.00 0.00 57.16 58.30 2yuj n GLU 161 Cb 0.65 -5.59 -0.15 0.00 -0.02 0.00 0.00 31.44 26.32 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 -5.20 0.33 -0.79 3.49 1.02 -1.26 -5.08 119.74 112.24 2yuj s LYS 162 Ca 0.09 -0.68 -0.26 0.00 0.02 0.00 0.00 55.97 55.14 2yuj s LYS 162 Cb -0.04 -1.38 0.01 0.00 -0.52 0.00 0.00 37.83 35.91 2yuj s LYS 162 CO 0.12 -1.01 1.52 0.42 -0.92 0.00 0.00 175.35 175.48 2yuj s ILE 163 N 1.96 3.65 -0.07 2.17 1.09 -1.26 -4.39 121.20 124.36 2yuj s ILE 163 Ca 0.09 0.02 -0.26 0.00 -1.10 0.00 0.00 60.65 59.40 2yuj s ILE 163 Cb -0.16 -4.62 -0.03 0.00 -1.06 0.00 0.00 42.46 36.58 2yuj s ILE 163 CO -0.33 -1.56 0.83 -0.31 -0.10 0.00 0.00 174.94 173.47 2yuj s TYR 164 N 6.83 3.57 0.03 3.97 1.51 -0.07 -4.88 117.35 128.32 2yuj s TYR 164 Ca 0.49 1.41 -0.29 0.00 -1.01 0.00 0.00 57.07 57.67 2yuj s TYR 164 Cb -0.07 -2.96 -0.04 0.00 -0.11 0.00 0.00 41.96 38.77 2yuj s TYR 164 CO 0.09 -0.02 0.92 -2.00 -1.11 0.00 0.00 175.55 173.43 2yuj s GLU 165 N 1.17 4.58 0.03 -0.62 2.12 -1.26 -2.70 118.70 122.03 2yuj s GLU 165 Ca 0.43 1.33 -0.02 0.00 0.36 0.00 0.00 54.97 57.06 2yuj s GLU 165 Cb -0.19 -3.42 -0.02 0.00 0.26 0.00 0.00 34.13 30.76 2yuj s GLU 165 CO 0.20 0.08 0.02 -0.51 -0.54 0.00 0.00 175.26 174.51 2yuj s LEU 166 N 0.55 2.14 -0.20 2.70 1.43 -1.24 -2.76 118.68 121.29 2yuj s LEU 166 Ca 0.47 -0.62 -0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2yuj s LEU 166 Cb -0.21 0.31 0.10 0.00 0.03 0.00 0.00 46.19 46.41 2yuj s LEU 166 CO 0.27 -0.44 0.33 -0.60 0.23 0.00 0.00 176.35 176.13 2yuj s ARG 167 N -2.43 0.26 0.70 1.70 3.52 -1.18 -1.87 118.95 119.66 2yuj s ARG 167 Ca -0.07 0.63 -0.17 0.00 -0.13 0.00 0.00 55.73 56.00 2yuj s ARG 167 Cb -0.03 -0.34 0.02 0.00 -1.56 0.00 0.00 34.95 33.04 2yuj s ARG 167 CO -0.04 -0.47 1.26 0.28 -0.81 0.00 0.00 175.30 175.51 2yuj n VAL 168 N 5.36 4.02 -0.01 7.11 0.31 -0.65 -1.50 118.33 132.97 2yuj n VAL 168 Ca -0.06 -0.41 -0.02 0.00 -0.01 0.00 0.00 64.34 63.85 2yuj n VAL 168 Cb 0.50 -1.39 -0.01 0.00 -0.91 0.00 0.00 33.84 32.02 2yuj n VAL 168 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2yuj n MET 169 N -2.32 0.06 -3.88 5.55 2.81 0.58 -2.30 117.12 117.62 2yuj n MET 169 Ca 0.15 0.02 -0.09 0.00 -1.81 0.00 0.00 57.70 55.97 2yuj n MET 169 Cb 0.49 -0.87 -0.08 0.00 -0.71 0.00 0.00 33.22 32.05 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 -2.05 0.74 -0.23 0.03 2.56 -1.01 -4.41 118.70 114.33 2yuj s GLU 170 Ca -0.04 -0.86 -0.22 0.00 0.00 0.00 0.00 54.97 53.85 2yuj s GLU 170 Cb 0.01 0.30 0.06 0.00 2.00 0.00 0.00 34.13 36.50 2yuj s GLU 170 CO 0.05 -0.22 0.63 0.95 -0.56 0.00 0.00 175.26 176.12 2yuj s THR 171 N -3.33 0.00 0.17 -1.70 -4.23 -1.26 0.49 115.64 105.78 2yuj s THR 171 Ca 0.01 -0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.63 2yuj s THR 171 Cb 0.03 -0.88 -0.04 0.00 1.34 0.00 0.00 72.50 72.94 2yuj s THR 171 CO -0.08 -0.00 -0.24 -0.54 -0.54 0.00 0.00 174.62 173.22 2yuj s LYS 172 N 0.30 1.52 0.26 3.99 1.02 -0.15 -3.89 119.74 122.79 2yuj s LYS 172 Ca -0.00 -1.43 0.13 0.00 0.02 0.00 0.00 55.97 54.68 2yuj s LYS 172 Cb -0.04 -1.90 0.20 0.00 -0.52 0.00 0.00 37.83 35.57 2yuj s LYS 172 CO 0.01 0.42 1.50 -1.00 -0.92 0.00 0.00 175.35 175.37 2yuj h PRO 173 N 3.45 0.00 -5.53 -1.68 0.13 -1.90 -2.79 132.00 123.68 2yuj h PRO 173 Ca -0.48 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.01 2yuj h PRO 173 Cb 1.19 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.20 2yuj h PRO 173 CO 0.45 0.63 -0.54 -0.51 -0.23 0.00 0.00 178.00 177.80 2yuj s ASP 174 N -6.60 4.08 0.16 1.44 1.11 -1.25 -5.05 116.67 110.57 2yuj s ASP 174 Ca 0.01 -1.43 -0.15 0.00 0.18 0.00 0.00 52.55 51.16 2yuj s ASP 174 Cb 0.10 -0.02 0.07 0.00 1.07 0.00 0.00 42.92 44.14 2yuj s ASP 174 CO 0.75 -0.65 1.79 0.07 1.18 0.00 0.00 175.17 178.31 2yuj h LYS 175 N 1.51 0.44 -5.02 8.23 2.10 -1.94 -3.40 116.57 118.48 2yuj h LYS 175 Ca -0.43 -0.03 -0.63 0.00 -2.00 0.00 0.00 60.65 57.56 2yuj h LYS 175 Cb 1.27 -0.10 -0.16 0.00 -0.90 0.00 0.00 32.23 32.35 2yuj h LYS 175 CO 0.76 0.29 -0.44 0.00 -2.00 0.00 0.00 179.45 178.06 2yuj s ALA 176 N -6.15 3.56 -0.05 0.07 0.00 -1.26 -2.91 121.76 115.02 2yuj s ALA 176 Ca -0.13 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2yuj s ALA 176 Cb 0.12 -2.50 0.01 0.00 0.00 0.00 0.00 23.12 20.75 2yuj s ALA 176 CO 0.72 -0.48 -0.11 0.14 0.00 0.00 0.00 175.76 176.04 2yuj s VAL 177 N 1.64 0.97 -0.86 0.00 -7.23 -1.23 -4.59 120.40 109.10 2yuj s VAL 177 Ca 0.09 -0.41 -0.24 0.00 -1.81 0.00 0.00 61.98 59.61 2yuj s VAL 177 Cb -0.15 -0.88 0.06 0.00 0.56 0.00 0.00 36.38 35.96 2yuj s VAL 177 CO 0.09 0.31 1.29 -0.94 -0.31 0.00 0.00 175.10 175.54 2yuj s SER 178 N 0.48 6.35 -1.21 4.85 1.04 0.20 -2.96 113.70 122.45 2yuj s SER 178 Ca -0.09 -1.11 -0.18 0.00 0.48 0.00 0.00 55.95 55.05 2yuj s SER 178 Cb -0.13 -2.53 0.08 0.00 0.10 0.00 0.00 66.02 63.55 2yuj s SER 178 CO 0.02 -1.57 1.61 0.27 0.98 0.00 0.00 173.24 174.55 2yuj s ILE 179 N 4.86 4.25 -0.73 -1.02 -4.36 -0.60 -3.09 121.20 120.50 2yuj s ILE 179 Ca 0.37 -1.79 0.01 0.00 -0.26 0.00 0.00 60.65 58.98 2yuj s ILE 179 Cb -0.06 -5.11 0.18 0.00 1.25 0.00 0.00 42.46 38.73 2yuj s ILE 179 CO 0.02 -1.92 0.56 -0.63 0.24 0.00 0.00 174.94 173.20 2yuj s ILE 180 N 3.89 3.57 -0.35 8.37 1.01 -1.26 -4.65 121.20 131.79 2yuj s ILE 180 Ca 0.50 -3.74 -0.07 0.00 0.00 0.00 0.00 60.65 57.33 2yuj s ILE 180 Cb 0.02 -3.29 0.01 0.00 0.01 0.00 0.00 42.46 39.20 2yuj s ILE 180 CO 0.02 -0.98 0.28 -0.62 0.00 0.00 0.00 174.94 173.64 2yuj n GLU 181 N 2.56 -2.79 -3.62 2.79 -0.58 -1.26 -5.07 120.64 112.67 2yuj n GLU 181 Ca 0.16 2.36 -0.12 0.00 -0.42 0.00 0.00 57.16 59.14 2yuj n GLU 181 Cb 0.36 -5.28 -0.07 0.00 -0.57 0.00 0.00 31.44 25.88 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yuj s ASP 183 N -0.01 6.55 0.45 0.00 1.11 -1.26 -5.04 116.67 118.48 2yuj s ASP 183 Ca 0.00 0.45 0.03 0.00 0.18 0.00 0.00 52.55 53.21 2yuj s ASP 183 Cb -0.04 -2.37 -0.02 0.00 1.07 0.00 0.00 42.92 41.56 2yuj s ASP 183 CO -0.02 -0.59 0.07 0.00 1.18 0.00 0.00 175.17 175.80 2yuj s MET 184 N 2.84 2.05 -0.27 8.23 0.23 -1.26 -4.96 119.30 126.16 2yuj s MET 184 Ca 0.29 -2.28 -0.10 0.00 -1.03 0.00 0.00 55.69 52.57 2yuj s MET 184 Cb -0.14 -1.07 -0.04 0.00 -1.53 0.00 0.00 34.83 32.04 2yuj s MET 184 CO 0.14 -0.41 0.15 1.21 -2.03 0.00 0.00 175.02 174.08 2yuj s ASN 185 N -3.73 5.70 -0.19 -1.18 2.47 -0.68 -5.02 114.94 112.31 2yuj s ASN 185 Ca 0.16 -0.08 -0.12 0.00 0.42 0.00 0.00 52.86 53.24 2yuj s ASN 185 Cb 0.02 -2.05 -0.05 0.00 -1.45 0.00 0.00 41.25 37.73 2yuj s ASN 185 CO 0.09 -0.04 0.20 -0.69 -3.72 0.00 0.00 177.10 172.94 2yuj s VAL 186 N 1.70 5.36 0.45 -5.21 1.01 -1.26 -1.32 120.40 121.12 2yuj s VAL 186 Ca 0.07 0.35 0.07 0.00 0.00 0.00 0.00 61.98 62.47 2yuj s VAL 186 Cb -0.16 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 2yuj s VAL 186 CO 0.08 0.41 0.36 -0.62 0.00 0.00 0.00 175.10 175.33 2yuj s ASP 187 N 0.48 4.86 -0.03 3.32 -1.08 0.59 -4.98 116.67 119.83 2yuj s ASP 187 Ca 0.12 -0.91 -0.02 0.00 -0.52 0.00 0.00 52.55 51.22 2yuj s ASP 187 Cb -0.12 -0.32 0.02 0.00 -1.46 0.00 0.00 42.92 41.04 2yuj s ASP 187 CO 0.01 -0.75 0.07 -0.36 0.52 0.00 0.00 175.17 174.66 2yuj s PHE 188 N -2.56 -0.06 -0.46 -5.34 0.08 -1.26 -3.15 117.98 105.23 2yuj s PHE 188 Ca 0.45 0.24 0.01 0.00 0.12 0.00 0.00 56.93 57.75 2yuj s PHE 188 Cb -0.02 -0.10 0.12 0.00 -0.57 0.00 0.00 43.02 42.46 2yuj s PHE 188 CO 0.26 -0.09 0.21 0.34 -0.10 0.00 0.00 175.22 175.84 2yuj s ASP 189 N 0.70 4.84 0.00 1.36 2.15 -0.76 -4.96 116.67 120.00 2yuj s ASP 189 Ca -0.06 -2.49 0.09 0.00 0.43 0.00 0.00 52.55 50.52 2yuj s ASP 189 Cb -0.08 -1.72 0.07 0.00 -0.30 0.00 0.00 42.92 40.89 2yuj s ASP 189 CO -0.03 -0.37 0.78 0.00 -0.17 0.00 0.00 175.17 175.38