#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 -6.88 -3.86 1.61 7.64 -1.26 -5.02 113.62 105.85 2yuj n SER 2 Ca 0.00 0.59 -0.07 0.00 1.01 0.00 0.00 58.87 60.40 2yuj n SER 2 Cb 0.00 -1.67 -0.02 0.00 -1.01 0.00 0.00 64.21 61.51 2yuj n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yuj s SER 3 N -5.20 -0.26 0.00 6.43 1.04 -1.26 -5.17 113.70 109.29 2yuj s SER 3 Ca 0.00 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2yuj s SER 3 Cb 0.00 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.84 2yuj s SER 3 CO 0.00 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.49 2yuj n GLY 4 N -0.46 1.35 3.62 7.32 0.00 -1.26 -5.10 105.19 110.66 2yuj n GLY 4 Ca -0.04 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 2.00 5.87 0.21 1.61 0.01 -1.26 -4.93 113.70 117.21 2yuj s SER 5 Ca 0.00 1.90 -0.21 0.00 1.31 0.00 0.00 55.95 58.95 2yuj s SER 5 Cb 0.00 -2.52 0.04 0.00 0.21 0.00 0.00 66.02 63.75 2yuj s SER 5 CO 0.00 -1.63 0.63 -0.44 0.41 0.00 0.00 173.24 172.21 2yuj s SER 6 N 6.53 -0.39 0.00 2.44 0.01 -1.26 -5.18 113.70 115.86 2yuj s SER 6 Ca 0.90 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 57.83 2yuj s SER 6 Cb -0.32 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.56 2yuj s SER 6 CO 0.35 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2yuj n GLY 7 N -0.40 -0.35 3.76 3.44 0.00 -1.26 -5.12 105.19 105.25 2yuj n GLY 7 Ca -0.11 -1.54 -0.35 0.00 0.00 0.00 0.00 46.02 44.02 2yuj n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2yuj s ILE 8 N -2.48 2.84 0.95 -0.61 -4.36 -1.26 -5.01 121.20 111.26 2yuj s ILE 8 Ca 0.00 0.50 -0.12 0.00 -0.26 0.00 0.00 60.65 60.77 2yuj s ILE 8 Cb 0.00 -3.16 0.16 0.00 1.25 0.00 0.00 42.46 40.71 2yuj s ILE 8 CO 0.00 -0.14 1.09 -2.16 0.24 0.00 0.00 174.94 173.98 2yuj s PRO 9 N -3.45 0.84 -0.22 0.37 0.04 -1.26 -5.08 135.00 126.24 2yuj s PRO 9 Ca 0.75 0.67 -0.06 0.00 0.04 0.00 0.00 61.00 62.39 2yuj s PRO 9 Cb -0.27 -1.77 0.11 0.00 0.04 0.00 0.00 34.50 32.60 2yuj s PRO 9 CO 0.33 -2.49 0.45 0.50 0.04 0.00 0.00 177.00 175.84 2yuj s ARG 10 N -4.95 0.37 0.36 4.56 6.06 -1.26 -5.17 118.95 118.93 2yuj s ARG 10 Ca 0.64 1.02 0.05 0.00 -2.50 0.00 0.00 55.73 54.94 2yuj s ARG 10 Cb -0.18 0.31 -0.03 0.00 0.06 0.00 0.00 34.95 35.10 2yuj s ARG 10 CO 0.57 -0.32 0.18 0.14 -2.50 0.00 0.00 175.30 173.37 2yuj s VAL 11 N 2.66 0.36 -0.26 7.11 -7.23 -1.26 -5.08 120.40 116.69 2yuj s VAL 11 Ca 0.01 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.90 2yuj s VAL 11 Cb -0.13 -2.43 -0.05 0.00 0.56 0.00 0.00 36.38 34.33 2yuj s VAL 11 CO -0.14 0.00 2.25 0.12 -0.31 0.00 0.00 175.10 177.01 2yuj s PHE 12 N -3.38 1.16 0.17 2.82 5.36 -1.26 -4.95 117.98 117.90 2yuj s PHE 12 Ca 0.32 0.70 0.06 0.00 -0.96 0.00 0.00 56.93 57.05 2yuj s PHE 12 Cb 0.03 -3.88 -0.04 0.00 -0.34 0.00 0.00 43.02 38.79 2yuj s PHE 12 CO 0.19 -3.83 -0.13 -1.14 -1.46 0.00 0.00 175.22 168.85 2yuj s GLN 13 N 6.65 1.19 -0.22 10.12 0.74 -1.26 -5.15 119.66 131.73 2yuj s GLN 13 Ca 1.00 -1.48 -0.05 0.00 0.05 0.00 0.00 55.36 54.88 2yuj s GLN 13 Cb -0.30 -0.94 0.11 0.00 1.10 0.00 0.00 33.01 32.98 2yuj s GLN 13 CO 0.34 0.15 0.43 1.21 -0.55 0.00 0.00 175.29 176.87 2yuj s ASN 14 N -3.09 -0.23 0.32 6.67 2.47 -1.26 -5.16 114.94 114.65 2yuj s ASN 14 Ca 0.18 0.80 0.08 0.00 0.42 0.00 0.00 52.86 54.34 2yuj s ASN 14 Cb -0.01 1.39 -0.06 0.00 -1.45 0.00 0.00 41.25 41.12 2yuj s ASN 14 CO 0.04 -0.25 -0.08 -0.13 -3.72 0.00 0.00 177.10 172.96 2yuj s ARG 15 N 2.63 1.71 -0.06 0.43 1.81 -1.26 -4.81 118.95 119.39 2yuj s ARG 15 Ca 0.04 -1.88 -0.14 0.00 -1.72 0.00 0.00 55.73 52.03 2yuj s ARG 15 Cb -0.13 -1.47 -0.05 0.00 -0.45 0.00 0.00 34.95 32.84 2yuj s ARG 15 CO -0.14 0.09 0.36 0.12 -0.68 0.00 0.00 175.30 175.05 2yuj s PHE 16 N -2.78 3.63 -0.29 -0.53 5.36 -1.26 -4.99 117.98 117.12 2yuj s PHE 16 Ca 0.31 0.84 -0.09 0.00 -0.96 0.00 0.00 56.93 57.04 2yuj s PHE 16 Cb 0.03 -2.29 0.13 0.00 -0.34 0.00 0.00 43.02 40.55 2yuj s PHE 16 CO 0.15 0.51 0.62 -1.54 -1.46 0.00 0.00 175.22 173.49 2yuj s SER 17 N -0.52 -1.06 -0.27 6.13 1.04 -1.23 -2.12 113.70 115.67 2yuj s SER 17 Ca 0.21 1.42 -0.30 0.00 0.48 0.00 0.00 55.95 57.77 2yuj s SER 17 Cb -0.15 2.18 0.18 0.00 0.10 0.00 0.00 66.02 68.33 2yuj s SER 17 CO 0.10 -0.23 1.31 0.28 0.98 0.00 0.00 173.24 175.68 2yuj s THR 18 N 2.86 0.00 0.27 2.02 -1.32 -1.18 -4.98 115.64 113.31 2yuj s THR 18 Ca -0.02 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.16 2yuj s THR 18 Cb -0.12 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.77 2yuj s THR 18 CO -0.18 0.00 1.07 -1.10 -2.21 0.00 0.00 174.62 172.19 2yuj s GLN 19 N -1.13 4.68 -0.01 7.08 -0.21 -1.26 -1.89 119.66 126.91 2yuj s GLN 19 Ca 0.08 1.75 -0.03 0.00 0.02 0.00 0.00 55.36 57.17 2yuj s GLN 19 Cb -0.01 -3.20 -0.00 0.00 1.00 0.00 0.00 33.01 30.80 2yuj s GLN 19 CO -0.06 0.27 0.06 0.71 -2.12 0.00 0.00 175.29 174.15 2yuj s TYR 20 N -1.17 0.02 1.18 0.91 2.02 -0.36 -4.88 117.35 115.08 2yuj s TYR 20 Ca 0.44 -0.04 -0.18 0.00 -0.37 0.00 0.00 57.07 56.92 2yuj s TYR 20 Cb -0.31 -0.04 0.28 0.00 -0.40 0.00 0.00 41.96 41.49 2yuj s TYR 20 CO 0.39 -0.12 1.10 1.03 -1.57 0.00 0.00 175.55 176.38 2yuj s ARG 21 N -0.57 -1.06 -0.11 -0.62 0.52 -1.25 -0.21 118.95 115.66 2yuj s ARG 21 Ca -0.06 0.04 -0.05 0.00 -0.52 0.00 0.00 55.73 55.14 2yuj s ARG 21 Cb -0.04 -1.61 0.05 0.00 0.52 0.00 0.00 34.95 33.88 2yuj s ARG 21 CO 0.00 -3.62 0.24 0.00 0.02 0.00 0.00 175.30 171.94 2yuj s PHE 23 N 1.79 1.71 0.12 0.00 0.08 0.17 -2.31 117.98 119.56 2yuj s PHE 23 Ca -0.04 -1.26 -0.09 0.00 0.12 0.00 0.00 56.93 55.66 2yuj s PHE 23 Cb -0.11 -1.02 -0.06 0.00 -0.57 0.00 0.00 43.02 41.25 2yuj s PHE 23 CO -0.08 -0.35 0.43 0.45 -0.10 0.00 0.00 175.22 175.57 2yuj s SER 24 N -3.46 6.62 0.48 1.36 0.15 -1.26 -0.90 113.70 116.69 2yuj s SER 24 Ca 0.32 0.79 0.20 0.00 0.70 0.00 0.00 55.95 57.97 2yuj s SER 24 Cb 0.05 -2.17 1.20 0.00 -1.71 0.00 0.00 66.02 63.39 2yuj s SER 24 CO 0.16 0.10 2.02 -0.37 1.20 0.00 0.00 173.24 176.36 2yuj h VAL 25 N 2.54 0.88 -0.29 4.45 -1.51 -1.91 -2.33 116.25 118.09 2yuj h VAL 25 Ca -0.48 -0.61 0.08 0.00 -1.23 0.00 0.00 66.70 64.46 2yuj h VAL 25 Cb 1.18 1.35 -0.01 0.00 -2.13 0.00 0.00 31.29 31.68 2yuj h VAL 25 CO 0.68 0.16 0.23 0.77 -1.23 0.00 0.00 177.57 178.18 2yuj h SER 26 N 0.00 0.00 0.05 4.19 4.64 -1.94 -2.13 113.55 118.36 2yuj h SER 26 Ca -0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2yuj h SER 26 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 2yuj h SER 26 CO 0.02 0.00 -0.07 0.24 -0.87 0.00 0.00 176.83 176.15 2yuj h MET 27 N 0.00 -0.14 -6.58 4.77 2.07 -1.83 -3.42 114.93 109.79 2yuj h MET 27 Ca 0.14 0.01 -0.52 0.00 -2.07 0.00 0.00 59.70 57.26 2yuj h MET 27 Cb 0.60 0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.35 2yuj h MET 27 CO -0.00 -0.10 -0.03 -1.17 1.07 0.00 0.00 176.91 176.68 2yuj s LEU 28 N -10.23 4.06 0.17 1.22 0.20 -0.80 -5.09 118.68 108.20 2yuj s LEU 28 Ca -0.14 0.99 -0.23 0.00 0.69 0.00 0.00 54.13 55.44 2yuj s LEU 28 Cb 0.07 -3.80 0.06 0.00 -0.43 0.00 0.00 46.19 42.09 2yuj s LEU 28 CO 0.66 -0.19 0.70 0.00 -0.29 0.00 0.00 176.35 177.24 2yuj s ALA 29 N -2.01 -1.54 0.00 5.97 0.00 -1.26 -4.94 121.76 117.98 2yuj s ALA 29 Ca 0.49 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2yuj s ALA 29 Cb -0.11 0.79 0.00 0.00 0.00 0.00 0.00 23.12 23.80 2yuj s ALA 29 CO 0.24 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2yuj n GLY 30 N -0.39 5.95 0.19 0.00 0.00 -1.26 -5.04 105.19 104.64 2yuj n GLY 30 Ca -0.11 -1.60 0.04 0.00 0.00 0.00 0.00 46.02 44.35 2yuj n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuj h PRO 31 N 0.00 0.00 -6.60 1.61 0.13 -2.09 -3.44 132.00 121.62 2yuj h PRO 31 Ca 0.00 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.47 2yuj h PRO 31 Cb 0.00 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 30.96 2yuj h PRO 31 CO 0.00 0.37 -0.77 -0.80 -0.23 0.00 0.00 178.00 176.57 2yuj s ASN 32 N -6.68 4.02 0.96 1.44 0.01 -1.26 -5.14 114.94 108.29 2yuj s ASN 32 Ca -0.02 -0.58 -0.15 0.00 -0.71 0.00 0.00 52.86 51.40 2yuj s ASN 32 Cb 0.13 -0.61 0.21 0.00 0.41 0.00 0.00 41.25 41.39 2yuj s ASN 32 CO 0.70 0.15 1.32 -1.81 -1.51 0.00 0.00 177.10 175.95 2yuj s ASP 33 N -2.43 3.06 -0.29 -1.22 1.01 -1.26 -5.07 116.67 110.47 2yuj s ASP 33 Ca 0.21 0.18 -0.15 0.00 0.71 0.00 0.00 52.55 53.50 2yuj s ASP 33 Cb -0.10 -0.20 0.14 0.00 1.01 0.00 0.00 42.92 43.77 2yuj s ASP 33 CO 0.12 -2.76 0.90 -0.13 0.21 0.00 0.00 175.17 173.51 2yuj s ARG 34 N -5.88 0.42 -0.09 8.23 0.52 -1.26 -5.05 118.95 115.85 2yuj s ARG 34 Ca 0.75 0.85 0.08 0.00 -0.52 0.00 0.00 55.73 56.89 2yuj s ARG 34 Cb -0.03 0.28 -0.12 0.00 0.52 0.00 0.00 34.95 35.60 2yuj s ARG 34 CO 0.53 -0.11 0.04 0.45 0.02 0.00 0.00 175.30 176.23 2yuj n SER 35 N 4.36 2.71 0.22 0.23 2.88 -1.26 -4.54 113.62 118.22 2yuj n SER 35 Ca -0.15 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.50 2yuj n SER 35 Cb 0.55 0.77 0.69 0.00 -0.75 0.00 0.00 64.21 65.47 2yuj n SER 35 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2yuj h ASP 36 N 0.00 0.00 -0.93 -3.46 3.04 -1.96 -1.36 116.42 111.75 2yuj h ASP 36 Ca -0.24 0.00 0.01 0.00 -3.24 0.00 0.00 57.03 53.56 2yuj h ASP 36 Cb 1.52 0.00 -0.05 0.00 -1.04 0.00 0.00 39.33 39.76 2yuj h ASP 36 CO 0.01 0.00 0.61 0.58 -2.04 0.00 0.00 179.24 178.40 2yuj h VAL 37 N 0.00 1.23 0.02 4.15 2.07 -1.92 -2.63 116.25 119.17 2yuj h VAL 37 Ca 0.05 -0.43 -0.24 0.00 0.82 0.00 0.00 66.70 66.90 2yuj h VAL 37 Cb 0.20 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 29.81 2yuj h VAL 37 CO -0.00 0.23 -1.24 -0.33 0.02 0.00 0.00 177.57 176.24 2yuj h GLU 38 N 1.24 0.05 -2.36 1.57 5.08 -1.61 -3.36 114.58 115.20 2yuj h GLU 38 Ca 0.34 -0.08 -0.66 0.00 -1.00 0.00 0.00 59.36 57.96 2yuj h GLU 38 Cb -0.12 0.03 -0.15 0.00 0.50 0.00 0.00 28.75 29.00 2yuj h GLU 38 CO -0.08 0.91 1.58 1.63 -1.00 0.00 0.00 179.01 182.05 2yuj n LYS 39 N -3.30 3.83 0.00 2.33 5.02 -0.60 -4.70 118.16 120.73 2yuj n LYS 39 Ca -0.06 -3.14 0.00 0.00 -2.02 0.00 0.00 58.31 53.09 2yuj n LYS 39 Cb 0.98 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 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 1.26 1.84 3.00 0.72 0.00 -1.21 -4.86 105.19 105.94 2yuj n GLY 40 Ca 0.57 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2yuj n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuj n GLY 41 N -0.33 4.01 3.00 -0.02 0.00 -1.25 -4.79 105.19 105.81 2yuj n GLY 41 Ca 0.00 -1.69 -0.22 0.00 0.00 0.00 0.00 46.02 44.11 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 2.75 1.17 0.32 1.61 1.02 -1.26 -4.20 119.74 121.15 2yuj s LYS 42 Ca 0.47 -0.32 0.10 0.00 0.02 0.00 0.00 55.97 56.23 2yuj s LYS 42 Cb 0.10 -1.05 -0.06 0.00 -0.52 0.00 0.00 37.83 36.30 2yuj s LYS 42 CO -0.03 0.08 -0.12 0.96 -0.92 0.00 0.00 175.35 175.32 2yuj s ILE 43 N 0.38 2.27 -0.15 2.17 -4.36 -1.20 -4.25 121.20 116.08 2yuj s ILE 43 Ca -0.07 -2.25 -0.00 0.00 -0.26 0.00 0.00 60.65 58.07 2yuj s ILE 43 Cb -0.11 -2.55 0.03 0.00 1.25 0.00 0.00 42.46 41.08 2yuj s ILE 43 CO 0.01 -0.26 -0.09 -0.63 0.24 0.00 0.00 174.94 174.21 2yuj s ILE 44 N -2.60 1.29 0.33 8.37 1.01 -1.07 -1.30 121.20 127.22 2yuj s ILE 44 Ca 0.32 -0.56 0.08 0.00 0.00 0.00 0.00 60.65 60.49 2yuj s ILE 44 Cb 0.01 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2yuj s ILE 44 CO 0.16 0.32 0.15 -0.04 0.00 0.00 0.00 174.94 175.52 2yuj s MET 45 N 1.59 2.44 0.56 2.79 -1.94 -1.21 -2.79 119.30 120.74 2yuj s MET 45 Ca 0.03 -1.47 -0.20 0.00 -1.71 0.00 0.00 55.69 52.34 2yuj s MET 45 Cb -0.14 -2.23 -0.06 0.00 2.01 0.00 0.00 34.83 34.41 2yuj s MET 45 CO -0.09 0.16 1.01 -2.30 -0.01 0.00 0.00 175.02 173.78 2yuj n PRO 46 N -1.15 1.06 -0.03 2.03 -0.02 -1.26 -3.33 135.00 132.31 2yuj n PRO 46 Ca -0.04 0.40 0.22 0.00 -2.02 0.00 0.00 63.50 62.06 2yuj n PRO 46 Cb 0.61 -2.18 0.70 0.00 -0.02 0.00 0.00 33.50 32.61 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 0.77 0.00 -0.19 0.52 0.11 -1.81 0.12 132.00 131.53 2yuj h PRO 47 Ca -0.48 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.66 2yuj h PRO 47 Cb 1.35 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.45 2yuj h PRO 47 CO 0.52 0.00 0.13 0.66 -0.21 0.00 0.00 178.00 179.10 2yuj h SER 48 N 0.00 0.10 -0.02 -2.05 4.64 -1.93 -1.05 113.55 113.25 2yuj h SER 48 Ca 0.28 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.54 2yuj h SER 48 Cb 1.16 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2yuj h SER 48 CO -0.00 0.07 -0.14 0.00 -0.87 0.00 0.00 176.83 175.89 2yuj h ALA 49 N 1.90 1.39 0.02 5.18 0.00 -1.30 -1.92 119.26 124.52 2yuj h ALA 49 Ca 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2yuj h ALA 49 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2yuj h ALA 49 CO -0.01 0.42 -0.01 1.25 0.00 0.00 0.00 179.25 180.90 2yuj h LEU 50 N 0.31 -0.02 -1.89 0.00 5.85 -1.31 -1.18 115.31 117.07 2yuj h LEU 50 Ca 0.06 -0.52 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2yuj h LEU 50 Cb 0.45 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 2yuj h LEU 50 CO 0.03 0.52 0.04 0.44 -0.34 0.00 0.00 178.44 179.13 2yuj h ASP 51 N -0.57 0.10 0.07 1.25 5.19 -1.42 -2.30 116.42 118.73 2yuj h ASP 51 Ca -0.00 -0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.15 2yuj h ASP 51 Cb 0.54 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 40.05 2yuj h ASP 51 CO 0.00 0.08 -1.02 -0.61 -3.12 0.00 0.00 179.24 174.58 2yuj h GLN 52 N 0.11 0.57 -0.34 3.56 4.15 -1.31 -2.71 115.11 119.14 2yuj h GLN 52 Ca 0.03 -0.71 0.05 0.00 0.77 0.00 0.00 58.65 58.79 2yuj h GLN 52 Cb 0.01 0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 2yuj h GLN 52 CO -0.00 1.30 0.23 -0.07 -1.93 0.00 0.00 178.83 178.36 2yuj h LEU 53 N 0.17 0.21 0.00 -2.39 3.38 -0.67 0.14 115.31 116.16 2yuj h LEU 53 Ca -0.15 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.60 2yuj h LEU 53 Cb 1.71 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.38 2yuj h LEU 53 CO 0.20 0.14 -1.14 0.28 0.09 0.00 0.00 178.44 178.01 2yuj h SER 54 N 0.25 0.00 1.48 -0.43 0.02 -1.50 -2.55 113.55 110.82 2yuj h SER 54 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2yuj h SER 54 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2yuj h SER 54 CO -0.03 0.98 -0.13 0.03 -1.14 0.00 0.00 176.83 176.54 2yuj h ARG 55 N 0.00 0.00 -0.70 3.45 2.47 -0.87 -3.21 114.38 115.51 2yuj h ARG 55 Ca -0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 2yuj h ARG 55 Cb 1.81 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.13 2yuj h ARG 55 CO 0.12 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.93 2yuj n LEU 56 N -2.43 4.27 -2.44 3.04 4.77 0.38 -4.89 117.00 119.71 2yuj n LEU 56 Ca 0.05 -2.17 -0.16 0.00 -0.03 0.00 0.00 56.01 53.70 2yuj n LEU 56 Cb 0.46 -0.62 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 2yuj n LEU 56 CO 0.32 0.52 -0.20 -3.20 -1.33 0.00 0.00 177.39 173.50 2yuj n ASN 57 N 0.46 -4.77 -4.87 -1.43 5.15 -1.21 -4.65 115.26 103.93 2yuj n ASN 57 Ca 0.19 0.10 -0.37 0.00 -0.60 0.00 0.00 54.58 53.91 2yuj n ASN 57 Cb 0.90 -4.01 -0.06 0.00 -0.53 0.00 0.00 39.78 36.08 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2yuj s ILE 58 N -2.80 5.37 0.20 -1.44 1.01 -0.96 -5.04 121.20 117.53 2yuj s ILE 58 Ca 0.01 0.31 0.08 0.00 0.00 0.00 0.00 60.65 61.05 2yuj s ILE 58 Cb -0.00 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 2yuj s ILE 58 CO 0.01 0.55 -0.15 0.42 0.00 0.00 0.00 174.94 175.77 2yuj s THR 59 N -1.10 1.74 0.50 2.92 -4.23 -1.26 -4.52 115.64 109.68 2yuj s THR 59 Ca 0.20 -2.17 -0.23 0.00 -1.18 0.00 0.00 61.69 58.31 2yuj s THR 59 Cb -0.13 -2.01 -0.06 0.00 1.34 0.00 0.00 72.50 71.64 2yuj s THR 59 CO 0.09 -0.56 1.33 -0.47 -0.54 0.00 0.00 174.62 174.46 2yuj s TYR 60 N -2.85 2.49 0.50 3.99 5.04 -1.26 -4.21 117.35 121.05 2yuj s TYR 60 Ca 0.21 1.39 -0.19 0.00 -2.44 0.00 0.00 57.07 56.05 2yuj s TYR 60 Cb -0.01 -3.72 -0.08 0.00 0.35 0.00 0.00 41.96 38.50 2yuj s TYR 60 CO 0.07 -2.54 1.01 -1.25 -1.34 0.00 0.00 175.55 171.50 2yuj s PRO 61 N -2.71 3.82 -0.67 4.97 0.04 -1.26 -5.12 135.00 134.06 2yuj s PRO 61 Ca 0.67 1.18 0.04 0.00 0.04 0.00 0.00 61.00 62.92 2yuj s PRO 61 Cb -0.38 -2.11 0.33 0.00 0.04 0.00 0.00 34.50 32.37 2yuj s PRO 61 CO 0.47 -0.39 1.09 -1.33 0.04 0.00 0.00 177.00 176.88 2yuj n MET 62 N -1.28 3.57 -2.68 4.56 2.81 -1.26 -4.94 117.12 117.90 2yuj n MET 62 Ca 0.08 -4.81 -0.40 0.00 -1.81 0.00 0.00 57.70 50.76 2yuj n MET 62 Cb 0.53 -2.29 -0.05 0.00 -0.71 0.00 0.00 33.22 30.70 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 -3.50 4.58 0.45 4.03 1.43 -1.26 -4.07 118.68 120.33 2yuj s LEU 63 Ca 0.46 1.96 0.08 0.00 -1.03 0.00 0.00 54.13 55.60 2yuj s LEU 63 Cb 0.25 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.88 2yuj s LEU 63 CO -0.12 0.01 0.59 -0.36 0.23 0.00 0.00 176.35 176.71 2yuj s PHE 64 N -0.72 2.51 -0.57 0.29 0.08 -0.07 -2.59 117.98 116.90 2yuj s PHE 64 Ca 0.44 -0.48 0.04 0.00 0.12 0.00 0.00 56.93 57.05 2yuj s PHE 64 Cb -0.26 -2.32 0.14 0.00 -0.57 0.00 0.00 43.02 40.01 2yuj s PHE 64 CO 0.33 -0.54 0.34 0.21 -0.10 0.00 0.00 175.22 175.46 2yuj s LYS 65 N -4.39 2.06 -0.91 0.44 2.36 0.28 -2.91 119.74 116.66 2yuj s LYS 65 Ca 0.55 -2.80 -0.25 0.00 -2.55 0.00 0.00 55.97 50.92 2yuj s LYS 65 Cb -0.08 -3.22 -0.09 0.00 -1.05 0.00 0.00 37.83 33.38 2yuj s LYS 65 CO 0.34 -1.18 2.10 -0.51 1.55 0.00 0.00 175.35 177.65 2yuj s LEU 66 N -0.62 3.00 -0.59 5.43 1.43 -0.41 -3.74 118.68 123.18 2yuj s LEU 66 Ca 0.20 -0.58 -0.23 0.00 -1.03 0.00 0.00 54.13 52.50 2yuj s LEU 66 Cb -0.18 -2.56 0.06 0.00 0.03 0.00 0.00 46.19 43.53 2yuj s LEU 66 CO -0.06 -3.28 0.91 -0.89 0.23 0.00 0.00 176.35 173.26 2yuj s THR 67 N 12.13 4.43 -0.38 5.49 2.01 -1.11 -3.27 115.64 134.93 2yuj s THR 67 Ca 0.78 -0.12 -0.25 0.00 0.31 0.00 0.00 61.69 62.40 2yuj s THR 67 Cb -0.08 -4.57 0.02 0.00 0.01 0.00 0.00 72.50 67.87 2yuj s THR 67 CO 0.05 -1.23 0.88 0.21 -0.69 0.00 0.00 174.62 173.84 2yuj s ASN 68 N 3.21 6.62 -0.58 3.53 2.47 -1.09 -3.49 114.94 125.60 2yuj s ASN 68 Ca 0.24 0.45 -0.02 0.00 0.42 0.00 0.00 52.86 53.95 2yuj s ASN 68 Cb -0.15 -2.44 0.32 0.00 -1.45 0.00 0.00 41.25 37.53 2yuj s ASN 68 CO 0.14 -0.85 2.12 0.29 -3.72 0.00 0.00 177.10 175.08 2yuj n LYS 69 N 6.73 2.43 0.00 0.43 5.02 -1.26 -2.81 118.16 128.70 2yuj n LYS 69 Ca 0.06 -2.76 0.00 0.00 -2.02 0.00 0.00 58.31 53.59 2yuj n LYS 69 Cb 0.48 -2.09 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 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 -0.30 1.76 -0.65 4.39 3.02 -1.26 -4.85 115.26 117.37 2yuj n ASN 70 Ca 0.51 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 55.12 2yuj n ASN 70 Cb 0.55 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.83 2yuj n ASN 70 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2yuj n SER 71 N -2.53 1.41 -3.74 6.41 7.64 -1.26 -4.98 113.62 116.57 2yuj n SER 71 Ca 0.00 -2.92 -0.27 0.00 1.01 0.00 0.00 58.87 56.68 2yuj n SER 71 Cb 0.39 -0.39 0.05 0.00 -1.01 0.00 0.00 64.21 63.24 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 -0.63 -5.45 -4.90 6.43 9.92 -1.23 -4.97 116.55 115.71 2yuj n ASP 72 Ca 0.12 -0.65 -0.28 0.00 -0.53 0.00 0.00 54.79 53.45 2yuj n ASP 72 Cb 0.78 -4.33 -0.02 0.00 -0.64 0.00 0.00 41.12 36.92 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 -6.45 3.61 -0.22 -1.24 1.81 -1.12 -5.01 118.95 110.33 2yuj s ARG 73 Ca 0.61 0.12 -0.11 0.00 -1.72 0.00 0.00 55.73 54.63 2yuj s ARG 73 Cb -0.29 -2.50 0.08 0.00 -0.45 0.00 0.00 34.95 31.78 2yuj s ARG 73 CO 0.76 0.01 0.51 1.41 -0.68 0.00 0.00 175.30 177.30 2yuj s MET 74 N -4.15 0.48 -0.13 3.54 -2.45 -1.26 -2.67 119.30 112.66 2yuj s MET 74 Ca 0.46 1.01 -0.25 0.00 -1.25 0.00 0.00 55.69 55.67 2yuj s MET 74 Cb -0.10 0.16 0.06 0.00 1.25 0.00 0.00 34.83 36.20 2yuj s MET 74 CO 0.36 -0.18 0.61 -0.08 1.05 0.00 0.00 175.02 176.78 2yuj s THR 75 N 1.81 0.01 -0.34 10.11 -1.32 -1.20 -4.90 115.64 119.80 2yuj s THR 75 Ca -0.08 -0.06 -0.04 0.00 -1.21 0.00 0.00 61.69 60.30 2yuj s THR 75 Cb -0.08 -0.89 0.06 0.00 -1.51 0.00 0.00 72.50 70.07 2yuj s THR 75 CO -0.15 -0.03 0.09 -1.00 -2.21 0.00 0.00 174.62 171.31 2yuj s HIS 76 N -0.48 3.32 0.04 9.09 3.76 -1.26 -1.29 115.29 128.47 2yuj s HIS 76 Ca -0.06 -1.78 0.03 0.00 -0.15 0.00 0.00 55.06 53.10 2yuj s HIS 76 Cb -0.03 -2.40 -0.04 0.00 1.11 0.00 0.00 32.58 31.22 2yuj s HIS 76 CO 0.05 -0.81 0.02 0.00 -0.85 0.00 0.00 174.74 173.15 2yuj s GLY 78 N -1.98 1.79 0.23 0.00 0.00 -1.26 -0.89 107.32 105.21 2yuj s GLY 78 Ca 0.24 -0.92 -0.30 0.00 0.00 0.00 0.00 44.72 43.73 2yuj s GLY 78 CO 0.15 -0.75 1.26 0.54 0.00 0.00 0.00 173.10 174.31 2yuj s VAL 79 N -0.95 3.23 -0.08 1.40 0.11 -1.26 -3.21 120.40 119.63 2yuj s VAL 79 Ca 0.16 1.07 -0.09 0.00 -2.93 0.00 0.00 61.98 60.19 2yuj s VAL 79 Cb -0.11 -3.68 -0.03 0.00 -1.53 0.00 0.00 36.38 31.02 2yuj s VAL 79 CO 0.06 0.19 -0.18 -0.11 -3.33 0.00 0.00 175.10 171.73 2yuj n LEU 80 N 2.13 1.18 -4.43 2.54 7.94 -0.42 -4.88 117.00 121.06 2yuj n LEU 80 Ca 0.04 0.19 -0.21 0.00 -1.11 0.00 0.00 56.01 54.92 2yuj n LEU 80 Cb 0.43 -0.56 -0.10 0.00 0.53 0.00 0.00 43.42 43.71 2yuj n LEU 80 CO 0.57 -0.42 -0.31 -0.70 -1.11 0.00 0.00 177.39 175.42 2yuj s GLU 81 N -2.15 1.57 -0.44 1.96 2.12 -1.24 -5.06 118.70 115.47 2yuj s GLU 81 Ca -0.15 -1.84 0.03 0.00 0.36 0.00 0.00 54.97 53.38 2yuj s GLU 81 Cb 0.02 -0.94 0.12 0.00 0.26 0.00 0.00 34.13 33.59 2yuj s GLU 81 CO 0.22 -0.09 0.19 -0.06 -0.54 0.00 0.00 175.26 174.98 2yuj s PHE 82 N -3.21 2.92 -0.25 5.30 0.08 -1.26 -3.32 117.98 118.23 2yuj s PHE 82 Ca 0.33 -2.83 0.12 0.00 0.12 0.00 0.00 56.93 54.67 2yuj s PHE 82 Cb 0.07 -2.54 0.35 0.00 -0.57 0.00 0.00 43.02 40.33 2yuj s PHE 82 CO 0.13 -0.81 1.38 1.33 -0.10 0.00 0.00 175.22 177.15 2yuj n VAL 83 N 3.65 0.16 -4.20 -0.44 0.24 -1.21 -4.59 118.33 111.94 2yuj n VAL 83 Ca 0.05 -1.06 -0.24 0.00 -2.04 0.00 0.00 64.34 61.05 2yuj n VAL 83 Cb 0.36 0.95 -0.07 0.00 -1.47 0.00 0.00 33.84 33.61 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 -0.40 3.31 0.49 2.33 0.00 -1.23 -5.00 121.76 121.26 2yuj s ALA 84 Ca 0.11 -1.46 -0.21 0.00 0.00 0.00 0.00 51.96 50.40 2yuj s ALA 84 Cb 0.35 -1.03 -0.07 0.00 0.00 0.00 0.00 23.12 22.37 2yuj s ALA 84 CO -0.10 0.36 1.11 0.34 0.00 0.00 0.00 175.76 177.48 2yuj s ASP 85 N -3.40 6.10 0.11 0.00 2.15 -1.26 -3.98 116.67 116.38 2yuj s ASP 85 Ca 0.30 2.15 -0.31 0.00 0.43 0.00 0.00 52.55 55.12 2yuj s ASP 85 Cb -0.08 -2.58 -0.10 0.00 -0.30 0.00 0.00 42.92 39.85 2yuj s ASP 85 CO 0.21 -0.96 1.86 -0.62 -0.17 0.00 0.00 175.17 175.49 2yuj n GLU 86 N -0.85 2.82 0.00 4.34 1.02 -1.26 -1.22 120.64 125.49 2yuj n GLU 86 Ca 0.09 1.03 0.00 0.00 -0.02 0.00 0.00 57.16 58.26 2yuj n GLU 86 Cb 0.50 -2.93 0.00 0.00 -0.02 0.00 0.00 31.44 28.99 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 4.28 3.14 3.55 0.62 0.00 -1.26 -5.03 105.19 110.49 2yuj n GLY 87 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.38 4.04 -0.08 -0.61 1.01 -0.36 -3.82 121.20 118.99 2yuj s ILE 88 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.35 2yuj s ILE 88 Cb 0.00 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.73 2yuj s ILE 88 CO 0.00 0.51 -0.11 0.00 0.00 0.00 0.00 174.94 175.35 2yuj s TYR 90 N 1.01 3.56 0.07 0.00 2.02 -1.12 0.45 117.35 123.35 2yuj s TYR 90 Ca -0.08 0.67 -0.09 0.00 -0.37 0.00 0.00 57.07 57.21 2yuj s TYR 90 Cb -0.15 -2.07 -0.00 0.00 -0.40 0.00 0.00 41.96 39.34 2yuj s TYR 90 CO -0.01 0.54 0.18 -0.51 -1.57 0.00 0.00 175.55 174.18 2yuj s LEU 91 N -2.00 1.46 0.77 -1.29 1.02 -0.07 -2.58 118.68 115.98 2yuj s LEU 91 Ca 0.33 -0.59 -0.15 0.00 0.02 0.00 0.00 54.13 53.74 2yuj s LEU 91 Cb -0.13 0.98 -0.02 0.00 0.02 0.00 0.00 46.19 47.03 2yuj s LEU 91 CO 0.19 -0.67 0.55 -2.65 0.02 0.00 0.00 176.35 173.78 2yuj n PRO 92 N 0.16 0.20 -0.09 1.29 -0.02 -1.26 -3.43 135.00 131.85 2yuj n PRO 92 Ca -0.16 0.11 -0.11 0.00 -2.02 0.00 0.00 63.50 61.32 2yuj n PRO 92 Cb 0.61 -1.88 0.03 0.00 -0.02 0.00 0.00 33.50 32.25 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 -0.62 0.97 -0.63 6.00 2.76 -1.91 -2.28 115.15 119.45 2yuj h HIS 93 Ca -0.45 -0.27 -0.06 0.00 -2.20 0.00 0.00 60.37 57.38 2yuj h HIS 93 Cb 1.33 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 2yuj h HIS 93 CO 0.36 1.05 0.14 0.11 -1.30 0.00 0.00 177.93 178.29 2yuj h TRP 94 N 0.68 1.06 -0.40 5.26 5.08 -1.91 -2.65 115.95 123.07 2yuj h TRP 94 Ca 0.06 -0.13 -0.10 0.00 1.08 0.00 0.00 58.89 59.80 2yuj h TRP 94 Cb 0.92 -0.30 -0.02 0.00 -3.00 0.00 0.00 29.16 26.76 2yuj h TRP 94 CO 0.05 0.90 -0.16 1.98 -1.28 0.00 0.00 178.44 179.93 2yuj h MET 95 N 0.93 0.74 -0.50 0.12 4.05 -1.89 -1.54 114.93 116.83 2yuj h MET 95 Ca 0.19 -0.26 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 2yuj h MET 95 Cb 0.38 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.10 2yuj h MET 95 CO 0.00 0.85 0.22 0.52 0.23 0.00 0.00 176.91 178.74 2yuj h MET 96 N 0.66 0.71 0.09 0.39 2.86 -1.16 -2.10 114.93 116.39 2yuj h MET 96 Ca 0.11 -0.09 -0.28 0.00 -2.06 0.00 0.00 59.70 57.37 2yuj h MET 96 Cb 0.64 -0.13 0.02 0.00 0.06 0.00 0.00 31.60 32.18 2yuj h MET 96 CO 0.04 0.57 -1.17 1.96 1.06 0.00 0.00 176.91 179.37 2yuj h GLN 97 N 0.71 0.54 -0.19 1.72 4.20 -1.21 -0.14 115.11 120.73 2yuj h GLN 97 Ca 0.18 -0.70 -0.00 0.00 0.06 0.00 0.00 58.65 58.18 2yuj h GLN 97 Cb 0.11 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2yuj h GLN 97 CO -0.02 1.30 0.11 -0.97 -0.67 0.00 0.00 178.83 178.58 2yuj h ASN 98 N 0.25 0.23 0.13 1.46 -1.24 -0.92 -1.93 115.58 113.56 2yuj h ASN 98 Ca -0.16 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.84 2yuj h ASN 98 Cb 1.84 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 40.84 2yuj h ASN 98 CO 0.22 0.18 -1.31 0.18 -1.29 0.00 0.00 177.43 175.41 2yuj n LEU 99 N -4.49 0.58 -3.28 0.34 4.77 -0.82 -4.98 117.00 109.12 2yuj n LEU 99 Ca -0.00 -0.20 -0.22 0.00 -0.03 0.00 0.00 56.01 55.56 2yuj n LEU 99 Cb 0.09 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.22 2yuj n LEU 99 CO 0.35 0.11 0.22 0.18 -1.33 0.00 0.00 177.39 176.92 2yuj n LEU 100 N -1.87 -3.26 -4.89 2.23 4.77 -0.14 -4.87 117.00 108.96 2yuj n LEU 100 Ca 0.01 -0.48 -0.29 0.00 -0.03 0.00 0.00 56.01 55.21 2yuj n LEU 100 Cb 0.43 -2.78 0.05 0.00 -2.33 0.00 0.00 43.42 38.79 2yuj n LEU 100 CO 0.43 0.59 0.71 -0.76 -1.33 0.00 0.00 177.39 177.03 2yuj s LEU 101 N -6.66 2.94 0.00 2.23 1.43 -0.75 -5.03 118.68 112.83 2yuj s LEU 101 Ca 0.53 1.02 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 2yuj s LEU 101 Cb -0.23 -3.80 -0.00 0.00 0.03 0.00 0.00 46.19 42.18 2yuj s LEU 101 CO 0.65 -1.33 0.01 1.21 0.23 0.00 0.00 176.35 177.13 2yuj n GLU 102 N -2.95 1.32 -1.80 1.70 4.07 -1.26 -4.91 120.64 116.81 2yuj n GLU 102 Ca 0.07 -1.68 -0.31 0.00 -0.06 0.00 0.00 57.16 55.18 2yuj n GLU 102 Cb 0.58 0.52 -0.04 0.00 -0.06 0.00 0.00 31.44 32.44 2yuj n GLU 102 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2yuj s GLU 103 N -2.82 2.25 0.00 5.31 2.02 -1.26 -2.10 118.70 122.10 2yuj s GLU 103 Ca 0.02 0.65 0.00 0.00 0.02 0.00 0.00 54.97 55.66 2yuj s GLU 103 Cb 0.00 -4.66 0.00 0.00 0.10 0.00 0.00 34.13 29.57 2yuj s GLU 103 CO 0.01 -3.36 0.00 0.41 0.02 0.00 0.00 175.26 172.34 2yuj n GLY 104 N 6.23 1.09 3.60 -1.39 0.00 -0.98 -5.00 105.19 108.75 2yuj n GLY 104 Ca 0.34 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.29 1.23 -0.04 -0.02 0.00 -0.89 -4.57 107.32 100.73 2yuj s GLY 105 Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 44.72 44.08 2yuj s GLY 105 CO 0.00 2.55 1.28 1.08 0.00 0.00 0.00 173.10 178.00 2yuj s LEU 106 N 4.80 4.29 0.05 0.66 1.43 -1.26 -2.06 118.68 126.60 2yuj s LEU 106 Ca 0.53 1.91 0.03 0.00 -1.03 0.00 0.00 54.13 55.57 2yuj s LEU 106 Cb -0.10 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 2yuj s LEU 106 CO 0.32 -0.64 -0.10 -0.69 0.23 0.00 0.00 176.35 175.47 2yuj s VAL 107 N 2.37 0.72 0.27 -1.59 1.01 0.71 -4.85 120.40 119.05 2yuj s VAL 107 Ca 0.59 -1.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 2yuj s VAL 107 Cb -0.27 -0.79 -0.10 0.00 0.00 0.00 0.00 36.38 35.22 2yuj s VAL 107 CO 0.23 -0.35 1.37 -1.10 0.00 0.00 0.00 175.10 175.25 2yuj s GLN 108 N -1.72 4.31 -0.45 2.72 -1.52 -1.23 -1.23 119.66 120.54 2yuj s GLN 108 Ca -0.07 2.24 0.03 0.00 -1.95 0.00 0.00 55.36 55.61 2yuj s GLN 108 Cb -0.09 -3.11 0.12 0.00 -0.22 0.00 0.00 33.01 29.71 2yuj s GLN 108 CO 0.01 -0.32 0.21 0.08 -0.25 0.00 0.00 175.29 175.02 2yuj s VAL 109 N -0.38 2.08 -0.10 1.09 1.01 -0.79 -2.76 120.40 120.55 2yuj s VAL 109 Ca 0.55 -2.81 -0.02 0.00 0.00 0.00 0.00 61.98 59.70 2yuj s VAL 109 Cb -0.40 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 2yuj s VAL 109 CO 0.46 -0.79 -0.02 -1.61 0.00 0.00 0.00 175.10 173.15 2yuj s GLU 110 N 0.22 3.12 -0.36 2.72 2.02 -1.25 -3.13 118.70 122.05 2yuj s GLU 110 Ca 0.16 -0.45 -0.22 0.00 0.02 0.00 0.00 54.97 54.47 2yuj s GLU 110 Cb -0.24 -2.80 0.01 0.00 0.10 0.00 0.00 34.13 31.20 2yuj s GLU 110 CO -0.03 0.59 0.74 -1.54 0.02 0.00 0.00 175.26 175.04 2yuj s SER 111 N -0.57 6.51 -0.09 -0.19 1.04 -0.90 1.00 113.70 120.49 2yuj s SER 111 Ca 0.09 0.29 0.04 0.00 0.48 0.00 0.00 55.95 56.86 2yuj s SER 111 Cb -0.12 -2.37 -0.00 0.00 0.10 0.00 0.00 66.02 63.62 2yuj s SER 111 CO 0.02 -0.69 -0.24 0.68 0.98 0.00 0.00 173.24 174.00 2yuj s VAL 112 N 2.97 2.11 -0.42 5.02 -7.23 -1.07 -4.74 120.40 117.05 2yuj s VAL 112 Ca 0.29 -1.01 -0.27 0.00 -1.81 0.00 0.00 61.98 59.18 2yuj s VAL 112 Cb -0.14 -1.80 0.02 0.00 0.56 0.00 0.00 36.38 35.03 2yuj s VAL 112 CO 0.16 0.56 1.03 0.20 -0.31 0.00 0.00 175.10 176.74 2yuj s ASN 113 N 0.24 6.67 0.49 4.85 -0.87 -1.26 -4.53 114.94 120.53 2yuj s ASN 113 Ca -0.16 0.54 0.06 0.00 -1.57 0.00 0.00 52.86 51.73 2yuj s ASN 113 Cb -0.17 -2.51 0.00 0.00 -0.02 0.00 0.00 41.25 38.55 2yuj s ASN 113 CO 0.08 -1.04 0.29 -0.76 -2.57 0.00 0.00 177.10 173.11 2yuj s LEU 114 N 3.90 2.86 0.30 0.60 1.43 -1.26 -5.11 118.68 121.40 2yuj s LEU 114 Ca 0.43 -1.18 0.02 0.00 -1.03 0.00 0.00 54.13 52.37 2yuj s LEU 114 Cb -0.10 -1.32 -0.05 0.00 0.03 0.00 0.00 46.19 44.76 2yuj s LEU 114 CO 0.24 -0.86 0.11 0.00 0.23 0.00 0.00 176.35 176.06 2yuj s GLN 115 N -4.11 1.55 0.54 1.70 0.00 -1.26 -4.69 119.66 113.39 2yuj s GLN 115 Ca 0.35 -1.87 -0.21 0.00 -0.00 0.00 0.00 55.36 53.62 2yuj s GLN 115 Cb -0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 33.01 32.58 2yuj s GLN 115 CO 0.20 -0.33 1.27 0.14 0.00 0.00 0.00 175.29 176.58 2yuj s VAL 116 N -3.58 2.47 0.25 3.63 -7.23 -1.17 0.32 120.40 115.09 2yuj s VAL 116 Ca 0.36 0.34 -0.11 0.00 -1.81 0.00 0.00 61.98 60.75 2yuj s VAL 116 Cb 0.07 -3.16 -0.08 0.00 0.56 0.00 0.00 36.38 33.77 2yuj s VAL 116 CO 0.15 -0.02 0.59 0.00 -0.31 0.00 0.00 175.10 175.51 2yuj s ALA 117 N -1.43 3.51 -0.13 1.32 0.00 -1.26 -4.66 121.76 119.11 2yuj s ALA 117 Ca 0.71 -0.19 0.13 0.00 0.00 0.00 0.00 51.96 52.61 2yuj s ALA 117 Cb -0.35 -2.52 -0.19 0.00 0.00 0.00 0.00 23.12 20.06 2yuj s ALA 117 CO 0.41 0.47 0.09 0.25 0.00 0.00 0.00 175.76 176.98 2yuj n THR 118 N -0.14 0.86 -3.59 0.00 -2.24 -1.10 -4.60 114.28 103.47 2yuj n THR 118 Ca 0.01 -0.58 -0.29 0.00 -2.27 0.00 0.00 64.05 60.91 2yuj n THR 118 Cb 0.53 -0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 68.12 2yuj n THR 118 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2yuj s TYR 119 N -2.46 1.32 -0.43 4.78 5.04 -1.26 -1.79 117.35 122.54 2yuj s TYR 119 Ca -0.07 -1.96 -0.16 0.00 -2.44 0.00 0.00 57.07 52.43 2yuj s TYR 119 Cb 0.05 -1.39 0.03 0.00 0.35 0.00 0.00 41.96 41.00 2yuj s TYR 119 CO 0.61 -0.81 0.39 -1.54 -1.34 0.00 0.00 175.55 172.86 2yuj s SER 120 N 0.81 6.16 -0.14 4.32 1.04 -0.71 -2.20 113.70 122.98 2yuj s SER 120 Ca 0.17 -0.87 -0.07 0.00 0.48 0.00 0.00 55.95 55.66 2yuj s SER 120 Cb -0.23 -2.20 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 2yuj s SER 120 CO -0.02 -0.56 0.11 -0.75 0.98 0.00 0.00 173.24 173.00 2yuj s LYS 121 N 1.93 3.63 0.19 4.02 2.20 0.23 -1.44 119.74 130.49 2yuj s LYS 121 Ca 0.09 -0.21 0.09 0.00 -0.36 0.00 0.00 55.97 55.58 2yuj s LYS 121 Cb -0.19 -3.20 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 2yuj s LYS 121 CO 0.11 0.60 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.46 2yuj s PHE 122 N -0.52 1.88 -0.36 4.03 0.40 0.15 -1.83 117.98 121.73 2yuj s PHE 122 Ca 0.12 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 55.98 2yuj s PHE 122 Cb -0.12 -0.91 0.12 0.00 0.51 0.00 0.00 43.02 42.63 2yuj s PHE 122 CO 0.02 0.39 0.17 -1.14 0.70 0.00 0.00 175.22 175.36 2yuj s GLN 123 N -3.05 0.82 -0.42 0.44 0.74 0.10 0.57 119.66 118.87 2yuj s GLN 123 Ca 0.19 -1.39 -0.35 0.00 0.05 0.00 0.00 55.36 53.86 2yuj s GLN 123 Cb -0.05 -1.88 -0.12 0.00 1.10 0.00 0.00 33.01 32.06 2yuj s GLN 123 CO 0.08 -1.10 2.24 -2.30 -0.55 0.00 0.00 175.29 173.66 2yuj n PRO 124 N 4.28 0.91 0.14 1.67 -0.02 -1.26 -3.01 135.00 137.70 2yuj n PRO 124 Ca 0.04 0.23 0.05 0.00 -2.02 0.00 0.00 63.50 61.79 2yuj n PRO 124 Cb 0.38 -2.39 0.48 0.00 -0.02 0.00 0.00 33.50 31.95 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 12.61 0.23 -6.51 -0.52 1.08 -1.84 -3.42 115.11 116.74 2yuj h GLN 125 Ca -0.24 -0.03 -0.68 0.00 -1.45 0.00 0.00 58.65 56.25 2yuj h GLN 125 Cb 1.32 -0.04 -0.19 0.00 -0.05 0.00 0.00 27.48 28.53 2yuj h GLN 125 CO 1.06 0.25 -0.76 -1.12 -0.95 0.00 0.00 178.83 177.31 2yuj s SER 126 N -6.89 4.19 0.24 1.46 0.01 -1.21 -5.02 113.70 106.48 2yuj s SER 126 Ca -0.06 -0.35 0.24 0.00 1.31 0.00 0.00 55.95 57.09 2yuj s SER 126 Cb 0.16 -0.79 0.93 0.00 0.21 0.00 0.00 66.02 66.53 2yuj s SER 126 CO 0.71 0.23 1.73 -0.81 0.41 0.00 0.00 173.24 175.52 2yuj n PRO 127 N 1.24 0.21 -0.14 12.44 -0.04 -1.26 -3.31 135.00 144.14 2yuj n PRO 127 Ca -0.15 0.35 0.15 0.00 -0.04 0.00 0.00 63.50 63.81 2yuj n PRO 127 Cb 0.52 -1.84 0.51 0.00 -0.04 0.00 0.00 33.50 32.65 2yuj n PRO 127 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2yuj h ASP 128 N 0.00 0.37 0.65 3.54 5.19 -1.96 0.57 116.42 124.79 2yuj h ASP 128 Ca 0.00 0.02 -0.17 0.00 -0.62 0.00 0.00 57.03 56.25 2yuj h ASP 128 Cb 0.49 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 2yuj h ASP 128 CO 0.00 0.20 -0.79 0.15 -3.12 0.00 0.00 179.24 175.67 2yuj h PHE 129 N 0.40 0.15 -0.06 4.55 3.57 -1.91 -3.13 116.94 120.50 2yuj h PHE 129 Ca 0.35 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.74 2yuj h PHE 129 Cb 0.80 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 2yuj h PHE 129 CO -0.00 0.85 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.72 2yuj h LEU 130 N 0.06 0.08 -1.90 0.59 3.38 -1.07 -1.90 115.31 114.55 2yuj h LEU 130 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2yuj h LEU 130 Cb 1.39 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 2yuj h LEU 130 CO 0.11 0.24 -0.11 -0.78 0.09 0.00 0.00 178.44 177.99 2yuj h ASP 131 N 0.08 0.00 -3.39 -0.43 1.82 -1.43 -3.43 116.42 109.64 2yuj h ASP 131 Ca 0.02 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.13 2yuj h ASP 131 Cb 0.31 0.00 0.08 0.00 0.68 0.00 0.00 39.33 40.40 2yuj h ASP 131 CO 0.02 0.11 0.87 -0.63 -1.61 0.00 0.00 179.24 178.00 2yuj s ILE 132 N -4.60 2.11 0.29 2.25 1.01 -0.72 -4.90 121.20 116.63 2yuj s ILE 132 Ca -0.04 0.09 0.10 0.00 0.00 0.00 0.00 60.65 60.80 2yuj s ILE 132 Cb 0.15 -3.06 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 2yuj s ILE 132 CO 0.64 0.02 1.65 0.74 0.00 0.00 0.00 174.94 177.99 2yuj h THR 133 N 3.36 1.39 -2.34 2.92 2.02 -1.88 -3.35 112.91 115.03 2yuj h THR 133 Ca -0.47 -1.89 -0.59 0.00 0.77 0.00 0.00 66.41 64.23 2yuj h THR 133 Cb 1.22 2.00 -0.41 0.00 -1.74 0.00 0.00 68.15 69.22 2yuj h THR 133 CO 0.78 0.54 -0.77 0.59 0.37 0.00 0.00 175.52 177.03 2yuj n ASN 134 N -3.89 2.12 -0.23 4.18 4.13 -1.26 -4.94 115.26 115.37 2yuj n ASN 134 Ca -0.02 -3.06 0.07 0.00 1.68 0.00 0.00 54.58 53.25 2yuj n ASN 134 Cb 0.56 -0.66 0.33 0.00 -1.54 0.00 0.00 39.78 38.47 2yuj n ASN 134 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 2yuj h PRO 135 N 4.56 0.79 -0.35 3.52 0.11 -1.85 -2.21 132.00 136.57 2yuj h PRO 135 Ca 0.16 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 2yuj h PRO 135 Cb 0.77 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 2yuj h PRO 135 CO 0.65 0.52 0.21 0.87 -0.21 0.00 0.00 178.00 180.05 2yuj h LYS 136 N 0.81 0.47 -0.43 1.05 1.57 -1.95 0.33 116.57 118.42 2yuj h LYS 136 Ca 0.36 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.12 2yuj h LYS 136 Cb 0.35 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 2yuj h LYS 136 CO -0.14 0.35 0.26 0.00 -0.57 0.00 0.00 179.45 179.35 2yuj h ALA 137 N 1.09 0.54 -0.30 3.86 0.00 -1.83 0.80 119.26 123.43 2yuj h ALA 137 Ca 0.12 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2yuj h ALA 137 Cb -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2yuj h ALA 137 CO -0.02 -0.06 -0.41 0.28 0.00 0.00 0.00 179.25 179.04 2yuj h VAL 138 N 0.52 1.29 -0.06 0.00 2.07 -1.25 -1.09 116.25 117.72 2yuj h VAL 138 Ca 0.17 -1.58 -0.18 0.00 0.82 0.00 0.00 66.70 65.93 2yuj h VAL 138 Cb -0.01 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2yuj h VAL 138 CO -0.07 0.51 -0.72 0.25 0.02 0.00 0.00 177.57 177.56 2yuj h LEU 139 N 0.59 0.39 -0.37 2.57 5.85 0.03 -2.97 115.31 121.39 2yuj h LEU 139 Ca 0.05 -0.26 -0.19 0.00 0.84 0.00 0.00 57.88 58.32 2yuj h LEU 139 Cb 0.95 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 2yuj h LEU 139 CO 0.09 0.98 -0.78 -0.33 -0.34 0.00 0.00 178.44 178.07 2yuj h GLU 140 N 0.22 0.35 -0.49 1.25 5.08 0.70 -1.89 114.58 119.81 2yuj h GLU 140 Ca -0.03 -0.31 -0.07 0.00 -1.00 0.00 0.00 59.36 57.95 2yuj h GLU 140 Cb 1.29 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 2yuj h GLU 140 CO 0.12 0.97 0.01 -0.97 -1.00 0.00 0.00 179.01 178.14 2yuj h ASN 141 N 0.23 0.77 0.71 1.42 -0.73 -1.18 -2.85 115.58 113.95 2yuj h ASN 141 Ca -0.04 -0.18 -0.25 0.00 1.87 0.00 0.00 56.30 57.71 2yuj h ASN 141 Cb 1.36 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 39.74 2yuj h ASN 141 CO 0.13 0.83 -1.12 0.00 -0.37 0.00 0.00 177.43 176.89 2yuj h ALA 142 N 1.26 0.23 0.00 1.57 0.00 -1.50 -3.24 119.26 117.58 2yuj h ALA 142 Ca 0.15 -0.86 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 2yuj h ALA 142 Cb 0.44 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2yuj h ALA 142 CO 0.02 1.03 -0.00 -0.07 0.00 0.00 0.00 179.25 180.22 2yuj h LEU 143 N 0.07 0.00 -1.73 0.00 3.38 -1.13 -1.49 115.31 114.41 2yuj h LEU 143 Ca -0.09 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.94 2yuj h LEU 143 Cb 1.84 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 2yuj h LEU 143 CO 0.17 0.00 0.29 0.03 0.09 0.00 0.00 178.44 179.02 2yuj h ARG 144 N 0.00 0.33 0.00 1.13 3.08 -1.53 -0.88 114.38 116.51 2yuj h ARG 144 Ca -0.00 -0.02 -0.18 0.00 0.07 0.00 0.00 59.98 59.85 2yuj h ARG 144 Cb 0.00 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2yuj h ARG 144 CO 0.00 0.22 -0.84 -0.91 -1.07 0.00 0.00 179.97 177.37 2yuj h ASN 145 N 0.34 0.14 -3.87 7.04 2.35 -1.46 -3.45 115.58 116.67 2yuj h ASN 145 Ca 0.19 -0.12 -0.49 0.00 -0.55 0.00 0.00 56.30 55.33 2yuj h ASN 145 Cb 0.31 -0.04 0.02 0.00 0.05 0.00 0.00 38.32 38.65 2yuj h ASN 145 CO -0.04 0.92 0.45 -0.36 -1.65 0.00 0.00 177.43 176.74 2yuj s PHE 146 N -3.20 3.44 -0.20 1.19 0.08 -0.34 -3.75 117.98 115.22 2yuj s PHE 146 Ca -0.02 1.68 0.16 0.00 0.12 0.00 0.00 56.93 58.88 2yuj s PHE 146 Cb 0.11 -3.21 -0.23 0.00 -0.57 0.00 0.00 43.02 39.11 2yuj s PHE 146 CO 0.81 -0.58 0.05 0.00 -0.10 0.00 0.00 175.22 175.40 2yuj n ALA 147 N 0.64 1.52 -2.35 5.36 0.00 -1.26 -4.78 120.51 119.63 2yuj n ALA 147 Ca 0.02 -1.27 -0.19 0.00 0.00 0.00 0.00 53.44 52.00 2yuj n ALA 147 Cb 0.47 -0.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.67 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 -3.38 -0.49 -0.01 0.00 1.43 -0.57 -4.85 118.68 110.81 2yuj s LEU 149 Ca 0.35 0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 53.86 2yuj s LEU 149 Cb 0.06 0.97 -0.04 0.00 0.03 0.00 0.00 46.19 47.21 2yuj s LEU 149 CO 0.16 -0.28 0.07 -0.89 0.23 0.00 0.00 176.35 175.64 2yuj s THR 150 N 2.50 4.64 -0.30 5.49 2.01 -1.25 -2.46 115.64 126.27 2yuj s THR 150 Ca 0.06 -0.42 -0.29 0.00 0.31 0.00 0.00 61.69 61.36 2yuj s THR 150 Cb -0.14 -3.10 -0.01 0.00 0.01 0.00 0.00 72.50 69.26 2yuj s THR 150 CO -0.13 0.37 1.58 -0.89 -0.69 0.00 0.00 174.62 174.86 2yuj s THR 151 N -1.16 3.74 0.00 -0.82 2.01 -1.15 -3.20 115.64 115.07 2yuj s THR 151 Ca 0.22 0.80 0.00 0.00 0.31 0.00 0.00 61.69 63.02 2yuj s THR 151 Cb -0.12 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.54 2yuj s THR 151 CO 0.12 -0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.22 2yuj n GLY 152 N 4.89 1.07 3.12 4.40 0.00 -1.20 -5.01 105.19 112.46 2yuj n GLY 152 Ca 0.19 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.01 4.25 -1.19 1.61 1.11 -1.19 -4.91 116.67 114.34 2yuj s ASP 153 Ca 0.00 -1.13 -0.18 0.00 0.18 0.00 0.00 52.55 51.42 2yuj s ASP 153 Cb 0.00 -1.59 0.10 0.00 1.07 0.00 0.00 42.92 42.50 2yuj s ASP 153 CO 0.00 -0.15 1.55 -0.69 1.18 0.00 0.00 175.17 177.06 2yuj s VAL 154 N 1.20 4.36 0.63 -1.27 1.01 -1.26 -2.40 120.40 122.67 2yuj s VAL 154 Ca -0.04 -1.83 -0.11 0.00 0.00 0.00 0.00 61.98 60.00 2yuj s VAL 154 Cb -0.18 -5.06 -0.03 0.00 0.00 0.00 0.00 36.38 31.10 2yuj s VAL 154 CO -0.06 -1.87 1.04 0.27 0.00 0.00 0.00 175.10 174.49 2yuj s ILE 155 N 3.60 4.57 -0.23 2.22 -4.36 0.13 -4.79 121.20 122.33 2yuj s ILE 155 Ca 0.48 0.83 0.02 0.00 -0.26 0.00 0.00 60.65 61.72 2yuj s ILE 155 Cb 0.01 -3.82 0.05 0.00 1.25 0.00 0.00 42.46 39.94 2yuj s ILE 155 CO 0.01 -1.09 -0.12 0.00 0.24 0.00 0.00 174.94 173.98 2yuj s ALA 156 N -3.20 2.31 0.13 2.27 0.00 -1.26 -2.05 121.76 119.96 2yuj s ALA 156 Ca 0.55 -1.48 -0.00 0.00 0.00 0.00 0.00 51.96 51.03 2yuj s ALA 156 Cb -0.11 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2yuj s ALA 156 CO 0.54 -0.95 0.29 0.96 0.00 0.00 0.00 175.76 176.60 2yuj s ILE 157 N 1.24 5.30 -0.03 0.00 -4.36 -1.00 -4.80 121.20 117.55 2yuj s ILE 157 Ca -0.04 -0.42 -0.11 0.00 -0.26 0.00 0.00 60.65 59.82 2yuj s ILE 157 Cb -0.18 -3.69 0.02 0.00 1.25 0.00 0.00 42.46 39.86 2yuj s ILE 157 CO -0.07 -0.01 0.25 0.21 0.24 0.00 0.00 174.94 175.56 2yuj s ASN 158 N -2.87 -0.16 0.00 4.36 3.84 -1.26 -0.47 114.94 118.38 2yuj s ASN 158 Ca 0.36 0.13 0.00 0.00 0.21 0.00 0.00 52.86 53.57 2yuj s ASN 158 Cb -0.12 0.35 0.00 0.00 -0.55 0.00 0.00 41.25 40.93 2yuj s ASN 158 CO 0.28 -0.33 0.00 0.00 -2.79 0.00 0.00 177.10 174.26 2yuj n TYR 159 N 1.77 -1.39 -1.52 0.43 0.18 -1.25 -4.96 117.16 110.43 2yuj n TYR 159 Ca -0.20 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.23 2yuj n TYR 159 Cb 0.56 0.28 0.06 0.00 -0.38 0.00 0.00 39.34 39.86 2yuj n TYR 159 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 2yuj n ASN 160 N -2.07 7.52 -2.50 9.48 2.85 -1.26 -4.80 115.26 124.47 2yuj n ASN 160 Ca 0.00 -3.74 -0.21 0.00 -0.11 0.00 0.00 54.58 50.52 2yuj n ASN 160 Cb 0.00 -1.03 -0.00 0.00 1.24 0.00 0.00 39.78 39.99 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2yuj n GLU 161 N -0.63 -2.31 -3.75 1.20 1.02 -1.26 -4.97 120.64 109.94 2yuj n GLU 161 Ca 0.57 0.99 -0.13 0.00 -0.02 0.00 0.00 57.16 58.58 2yuj n GLU 161 Cb 0.50 -5.69 -0.13 0.00 -0.02 0.00 0.00 31.44 26.10 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 -5.17 0.21 -0.96 3.49 3.01 -1.26 -5.10 119.74 113.95 2yuj s LYS 162 Ca 0.06 0.46 -0.18 0.00 -1.01 0.00 0.00 55.97 55.31 2yuj s LYS 162 Cb -0.03 -0.07 0.14 0.00 -1.01 0.00 0.00 37.83 36.87 2yuj s LYS 162 CO 0.07 -0.13 1.15 0.42 0.51 0.00 0.00 175.35 177.37 2yuj s ILE 163 N 0.99 4.85 -0.04 2.17 1.09 -1.26 -3.87 121.20 125.13 2yuj s ILE 163 Ca -0.07 -1.81 -0.30 0.00 -1.10 0.00 0.00 60.65 57.37 2yuj s ILE 163 Cb -0.08 -4.77 -0.05 0.00 -1.06 0.00 0.00 42.46 36.49 2yuj s ILE 163 CO -0.06 -1.49 1.44 -0.31 -0.10 0.00 0.00 174.94 174.43 2yuj s TYR 164 N 2.30 2.64 0.12 3.97 1.51 0.37 -4.82 117.35 123.45 2yuj s TYR 164 Ca 0.33 0.69 -0.30 0.00 -1.01 0.00 0.00 57.07 56.78 2yuj s TYR 164 Cb -0.05 -3.70 -0.07 0.00 -0.11 0.00 0.00 41.96 38.03 2yuj s TYR 164 CO -0.08 -2.69 1.14 -1.21 -1.11 0.00 0.00 175.55 171.59 2yuj s GLU 165 N 2.95 4.52 -0.13 -0.62 2.02 -1.26 -2.37 118.70 123.80 2yuj s GLU 165 Ca 0.65 1.73 -0.14 0.00 0.02 0.00 0.00 54.97 57.22 2yuj s GLU 165 Cb -0.31 -3.31 0.04 0.00 0.10 0.00 0.00 34.13 30.65 2yuj s GLU 165 CO 0.25 -0.07 0.40 -0.51 0.02 0.00 0.00 175.26 175.35 2yuj s LEU 166 N 0.29 0.48 0.02 1.80 1.43 -0.87 -2.66 118.68 119.17 2yuj s LEU 166 Ca 0.53 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 54.37 2yuj s LEU 166 Cb -0.29 1.40 -0.01 0.00 0.03 0.00 0.00 46.19 47.31 2yuj s LEU 166 CO 0.32 -0.19 -0.05 -0.60 0.23 0.00 0.00 176.35 176.06 2yuj s ARG 167 N 0.00 0.41 0.56 1.70 3.52 -1.16 0.19 118.95 124.16 2yuj s ARG 167 Ca -0.02 -0.46 -0.17 0.00 -0.13 0.00 0.00 55.73 54.95 2yuj s ARG 167 Cb -0.03 -0.25 -0.05 0.00 -1.56 0.00 0.00 34.95 33.06 2yuj s ARG 167 CO 0.01 0.05 1.04 0.08 -0.81 0.00 0.00 175.30 175.68 2yuj s VAL 168 N -0.81 3.93 0.05 7.11 1.01 -1.01 0.01 120.40 130.68 2yuj s VAL 168 Ca -0.06 0.98 0.00 0.00 0.00 0.00 0.00 61.98 62.90 2yuj s VAL 168 Cb -0.06 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2yuj s VAL 168 CO -0.00 -0.48 0.00 0.23 0.00 0.00 0.00 175.10 174.85 2yuj n MET 169 N -1.72 0.00 -3.86 2.72 2.81 -0.76 -3.28 117.12 113.03 2yuj n MET 169 Ca 0.08 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.85 2yuj n MET 169 Cb 0.53 -0.45 -0.14 0.00 -0.71 0.00 0.00 33.22 32.45 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 -2.00 0.04 -0.07 0.03 2.12 -1.19 -4.68 118.70 112.95 2yuj s GLU 170 Ca 0.00 0.04 -0.05 0.00 0.36 0.00 0.00 54.97 55.32 2yuj s GLU 170 Cb 0.00 0.02 0.03 0.00 0.26 0.00 0.00 34.13 34.44 2yuj s GLU 170 CO 0.00 -0.01 0.17 0.95 -0.54 0.00 0.00 175.26 175.83 2yuj s THR 171 N -0.00 -0.02 0.17 -1.70 -4.23 -1.25 0.74 115.64 109.34 2yuj s THR 171 Ca -0.00 0.07 0.08 0.00 -1.18 0.00 0.00 61.69 60.66 2yuj s THR 171 Cb -0.00 -0.25 -0.04 0.00 1.34 0.00 0.00 72.50 73.54 2yuj s THR 171 CO 0.00 0.03 -0.08 -0.54 -0.54 0.00 0.00 174.62 173.49 2yuj s LYS 172 N 0.56 2.14 0.10 3.99 1.02 -0.93 -3.98 119.74 122.63 2yuj s LYS 172 Ca -0.04 -1.21 -0.08 0.00 0.02 0.00 0.00 55.97 54.67 2yuj s LYS 172 Cb -0.05 -2.22 -0.17 0.00 -0.52 0.00 0.00 37.83 34.86 2yuj s LYS 172 CO -0.03 0.45 1.23 -1.00 -0.92 0.00 0.00 175.35 175.08 2yuj h PRO 173 N 2.95 0.48 -6.03 -1.68 0.13 -1.90 -2.91 132.00 123.04 2yuj h PRO 173 Ca -0.47 -0.57 -0.54 0.00 -0.87 0.00 0.00 66.00 63.55 2yuj h PRO 173 Cb 1.20 0.17 -0.05 0.00 0.13 0.00 0.00 31.00 32.45 2yuj h PRO 173 CO 0.55 1.21 -0.37 0.34 -0.23 0.00 0.00 178.00 179.49 2yuj s ASP 174 N -7.19 4.76 0.22 1.44 2.15 -1.26 -5.03 116.67 111.77 2yuj s ASP 174 Ca -0.07 -1.00 -0.08 0.00 0.43 0.00 0.00 52.55 51.83 2yuj s ASP 174 Cb 0.08 -0.19 0.28 0.00 -0.30 0.00 0.00 42.92 42.79 2yuj s ASP 174 CO 0.89 -0.80 1.82 0.07 -0.17 0.00 0.00 175.17 176.98 2yuj h LYS 175 N 1.01 0.74 -5.47 4.34 2.10 -1.91 -3.40 116.57 113.97 2yuj h LYS 175 Ca -0.40 -0.04 -0.59 0.00 -2.00 0.00 0.00 60.65 57.61 2yuj h LYS 175 Cb 1.28 -0.17 -0.11 0.00 -0.90 0.00 0.00 32.23 32.33 2yuj h LYS 175 CO 0.60 0.49 -0.26 0.00 -2.00 0.00 0.00 179.45 178.28 2yuj s ALA 176 N -6.08 3.56 -0.00 0.07 0.00 -1.26 -2.92 121.76 115.14 2yuj s ALA 176 Ca -0.13 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.36 2yuj s ALA 176 Cb 0.17 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 2yuj s ALA 176 CO 0.77 -0.11 -0.02 0.14 0.00 0.00 0.00 175.76 176.54 2yuj s VAL 177 N 0.90 0.17 -0.57 0.00 -7.23 -1.03 -4.65 120.40 107.98 2yuj s VAL 177 Ca 0.18 -0.08 -0.20 0.00 -1.81 0.00 0.00 61.98 60.07 2yuj s VAL 177 Cb -0.14 -0.15 0.08 0.00 0.56 0.00 0.00 36.38 36.73 2yuj s VAL 177 CO 0.06 0.05 0.73 -0.94 -0.31 0.00 0.00 175.10 174.69 2yuj s SER 178 N -0.01 6.20 -0.91 4.85 1.04 0.15 -1.52 113.70 123.51 2yuj s SER 178 Ca 0.00 -1.14 -0.15 0.00 0.48 0.00 0.00 55.95 55.14 2yuj s SER 178 Cb -0.01 -2.32 0.19 0.00 0.10 0.00 0.00 66.02 63.98 2yuj s SER 178 CO -0.00 -1.10 0.95 0.27 0.98 0.00 0.00 173.24 174.34 2yuj s ILE 179 N 2.93 5.34 -0.61 -1.02 -4.36 -0.21 -3.04 121.20 120.23 2yuj s ILE 179 Ca 0.15 -2.28 0.04 0.00 -0.26 0.00 0.00 60.65 58.30 2yuj s ILE 179 Cb -0.21 -4.60 0.16 0.00 1.25 0.00 0.00 42.46 39.06 2yuj s ILE 179 CO 0.09 -1.23 0.42 -0.63 0.24 0.00 0.00 174.94 173.83 2yuj s ILE 180 N 0.91 2.29 -0.37 8.37 1.09 -1.26 -4.49 121.20 127.74 2yuj s ILE 180 Ca 0.25 -3.73 -0.12 0.00 -1.10 0.00 0.00 60.65 55.95 2yuj s ILE 180 Cb -0.08 -2.53 0.02 0.00 -1.06 0.00 0.00 42.46 38.81 2yuj s ILE 180 CO -0.09 -1.01 0.45 -0.62 -0.10 0.00 0.00 174.94 173.58 2yuj n GLU 181 N 2.40 -2.29 -3.53 2.79 -0.58 -1.26 -5.07 120.64 113.10 2yuj n GLU 181 Ca 0.19 2.05 -0.12 0.00 -0.42 0.00 0.00 57.16 58.85 2yuj n GLU 181 Cb 0.37 -5.18 -0.04 0.00 -0.57 0.00 0.00 31.44 26.01 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 -2.49 6.72 0.30 0.00 1.47 -1.26 -5.05 116.67 116.36 2yuj s ASP 183 Ca -0.01 0.86 -0.10 0.00 1.18 0.00 0.00 52.55 54.48 2yuj s ASP 183 Cb -0.00 -2.30 0.01 0.00 -0.34 0.00 0.00 42.92 40.28 2yuj s ASP 183 CO -0.09 -0.02 0.53 0.00 0.68 0.00 0.00 175.17 176.27 2yuj s MET 184 N 0.69 1.78 -0.27 2.11 0.23 -1.26 -4.89 119.30 117.68 2yuj s MET 184 Ca 0.27 -1.44 -0.06 0.00 -1.03 0.00 0.00 55.69 53.43 2yuj s MET 184 Cb -0.15 0.49 -0.00 0.00 -1.53 0.00 0.00 34.83 33.63 2yuj s MET 184 CO 0.11 -0.76 0.05 1.21 -2.03 0.00 0.00 175.02 173.61 2yuj s ASN 185 N -3.09 4.97 -0.10 -1.18 2.47 -0.74 -5.03 114.94 112.23 2yuj s ASN 185 Ca 0.24 -0.52 -0.10 0.00 0.42 0.00 0.00 52.86 52.90 2yuj s ASN 185 Cb -0.01 -1.86 -0.05 0.00 -1.45 0.00 0.00 41.25 37.88 2yuj s ASN 185 CO 0.13 -0.12 0.22 -0.69 -3.72 0.00 0.00 177.10 172.93 2yuj s VAL 186 N 1.53 5.36 0.04 -5.21 1.01 -1.26 -1.73 120.40 120.13 2yuj s VAL 186 Ca 0.04 0.40 0.04 0.00 0.00 0.00 0.00 61.98 62.46 2yuj s VAL 186 Cb -0.16 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2yuj s VAL 186 CO 0.02 0.57 -0.12 -0.62 0.00 0.00 0.00 175.10 174.95 2yuj s ASP 187 N -0.75 1.37 0.05 3.32 2.15 -0.52 -4.98 116.67 117.31 2yuj s ASP 187 Ca 0.17 -0.46 0.02 0.00 0.43 0.00 0.00 52.55 52.71 2yuj s ASP 187 Cb -0.13 -0.06 -0.04 0.00 -0.30 0.00 0.00 42.92 42.39 2yuj s ASP 187 CO 0.06 -0.03 0.06 -0.36 -0.17 0.00 0.00 175.17 174.73 2yuj s PHE 188 N -0.94 3.18 -0.70 -5.34 0.40 -1.26 0.34 117.98 113.66 2yuj s PHE 188 Ca -0.01 0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 2yuj s PHE 188 Cb -0.08 -1.65 0.17 0.00 0.51 0.00 0.00 43.02 41.97 2yuj s PHE 188 CO 0.01 0.52 0.52 0.34 0.70 0.00 0.00 175.22 177.31 2yuj s ASP 189 N -2.10 5.20 0.00 1.36 -1.08 0.19 -4.88 116.67 115.36 2yuj s ASP 189 Ca 0.26 -3.36 0.00 0.00 -0.52 0.00 0.00 52.55 48.93 2yuj s ASP 189 Cb -0.12 -1.79 0.00 0.00 -1.46 0.00 0.00 42.92 39.55 2yuj s ASP 189 CO 0.18 -0.23 0.00 0.00 0.52 0.00 0.00 175.17 175.64