#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 -8.12 0.00 1.61 2.88 -1.26 -4.87 113.62 103.86 2yuj n SER 2 Ca 0.00 1.31 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 2yuj n SER 2 Cb 0.00 -3.68 0.00 0.00 -0.75 0.00 0.00 64.21 59.78 2yuj n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2yuj n SER 3 N -4.03 0.00 -0.08 -3.46 3.41 -1.26 -5.13 113.62 103.07 2yuj n SER 3 Ca 0.01 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.63 2yuj n SER 3 Cb 0.55 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2yuj n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yuj n GLY 4 N 1.94 -1.71 0.28 5.00 0.00 -1.26 -4.94 105.19 104.51 2yuj n GLY 4 Ca 0.00 -1.49 -0.00 0.00 0.00 0.00 0.00 46.02 44.52 2yuj n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yuj n SER 5 N -2.02 0.02 -3.15 1.61 7.64 -1.26 -5.05 113.62 111.40 2yuj n SER 5 Ca -0.00 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.92 2yuj n SER 5 Cb 0.04 -0.36 -0.01 0.00 -1.01 0.00 0.00 64.21 62.87 2yuj n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yuj s SER 6 N -4.30 -1.46 0.00 6.43 0.15 -1.26 -5.17 113.70 108.09 2yuj s SER 6 Ca -0.00 0.54 0.00 0.00 0.70 0.00 0.00 55.95 57.18 2yuj s SER 6 Cb 0.00 2.07 0.00 0.00 -1.71 0.00 0.00 66.02 66.38 2yuj s SER 6 CO 0.00 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.78 2yuj n GLY 7 N 5.42 4.47 3.11 9.45 0.00 -1.26 -5.17 105.19 121.22 2yuj n GLY 7 Ca 0.02 -2.04 -0.23 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.09 1.18 -0.15 -0.61 -4.36 -1.26 -5.12 121.20 109.79 2yuj s ILE 8 Ca 0.00 -0.63 -0.29 0.00 -0.26 0.00 0.00 60.65 59.47 2yuj s ILE 8 Cb 0.00 -0.99 -0.02 0.00 1.25 0.00 0.00 42.46 42.70 2yuj s ILE 8 CO 0.00 0.34 1.22 -2.16 0.24 0.00 0.00 174.94 174.58 2yuj s PRO 9 N -0.25 4.27 -0.10 0.37 0.04 -1.26 -5.03 135.00 133.03 2yuj s PRO 9 Ca 0.04 1.63 -0.09 0.00 0.04 0.00 0.00 61.00 62.61 2yuj s PRO 9 Cb -0.07 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 2yuj s PRO 9 CO -0.00 -0.63 0.20 1.03 0.04 0.00 0.00 177.00 177.63 2yuj s ARG 10 N 3.15 3.61 -0.24 4.56 0.52 -1.26 -5.07 118.95 124.23 2yuj s ARG 10 Ca 0.54 -0.02 -0.10 0.00 -0.52 0.00 0.00 55.73 55.63 2yuj s ARG 10 Cb -0.22 -3.22 -0.05 0.00 0.52 0.00 0.00 34.95 31.99 2yuj s ARG 10 CO 0.15 0.71 0.14 0.14 0.02 0.00 0.00 175.30 176.46 2yuj s VAL 11 N -0.90 5.11 -0.01 3.52 -7.23 -1.26 -5.02 120.40 114.62 2yuj s VAL 11 Ca 0.16 0.09 -0.01 0.00 -1.81 0.00 0.00 61.98 60.42 2yuj s VAL 11 Cb -0.13 -3.38 -0.01 0.00 0.56 0.00 0.00 36.38 33.42 2yuj s VAL 11 CO 0.05 0.35 0.20 -0.26 -0.31 0.00 0.00 175.10 175.13 2yuj h PHE 12 N 7.63 -0.04 -3.52 2.82 0.04 -2.01 -3.42 116.94 118.43 2yuj h PHE 12 Ca -0.37 -0.00 -0.69 0.00 2.80 0.00 0.00 57.97 59.71 2yuj h PHE 12 Cb 1.17 0.01 -0.36 0.00 2.20 0.00 0.00 35.95 38.98 2yuj h PHE 12 CO 0.67 -0.02 -0.41 -0.65 -0.60 0.00 0.00 178.31 177.30 2yuj s GLN 13 N -1.53 2.46 -0.27 1.51 -1.52 -1.26 -5.02 119.66 114.04 2yuj s GLN 13 Ca -0.01 -2.52 -0.09 0.00 -1.95 0.00 0.00 55.36 50.80 2yuj s GLN 13 Cb 0.00 -3.67 0.12 0.00 -0.22 0.00 0.00 33.01 29.24 2yuj s GLN 13 CO 0.02 -1.16 0.58 1.21 -0.25 0.00 0.00 175.29 175.68 2yuj s ASN 14 N 0.59 -0.87 0.41 5.90 3.04 -1.26 -5.17 114.94 117.57 2yuj s ASN 14 Ca 0.17 1.36 0.04 0.00 0.04 0.00 0.00 52.86 54.47 2yuj s ASN 14 Cb -0.21 2.00 -0.02 0.00 -1.54 0.00 0.00 41.25 41.48 2yuj s ASN 14 CO -0.03 -0.23 0.15 -0.13 -3.04 0.00 0.00 177.10 173.82 2yuj s ARG 15 N 2.81 1.94 -0.43 0.43 3.00 -1.26 -5.04 118.95 120.40 2yuj s ARG 15 Ca -0.03 -2.18 -0.15 0.00 0.00 0.00 0.00 55.73 53.36 2yuj s ARG 15 Cb -0.12 -0.50 0.03 0.00 0.00 0.00 0.00 34.95 34.36 2yuj s ARG 15 CO -0.17 -0.52 0.34 0.12 0.00 0.00 0.00 175.30 175.07 2yuj s PHE 16 N -3.22 3.23 -0.33 -0.53 5.36 -1.26 -5.02 117.98 116.21 2yuj s PHE 16 Ca 0.25 -0.64 -0.01 0.00 -0.96 0.00 0.00 56.93 55.56 2yuj s PHE 16 Cb 0.02 -2.75 0.11 0.00 -0.34 0.00 0.00 43.02 40.06 2yuj s PHE 16 CO 0.16 -0.65 0.15 -1.54 -1.46 0.00 0.00 175.22 171.88 2yuj s SER 17 N 1.90 3.62 0.12 6.13 1.04 -1.26 -1.96 113.70 123.30 2yuj s SER 17 Ca 0.06 -1.80 -0.12 0.00 0.48 0.00 0.00 55.95 54.57 2yuj s SER 17 Cb -0.20 -0.65 0.01 0.00 0.10 0.00 0.00 66.02 65.28 2yuj s SER 17 CO 0.10 -0.38 0.30 0.28 0.98 0.00 0.00 173.24 174.52 2yuj s THR 18 N 1.46 0.10 0.53 2.02 -1.32 -0.42 -4.96 115.64 113.05 2yuj s THR 18 Ca 0.12 -0.94 -0.06 0.00 -1.21 0.00 0.00 61.69 59.60 2yuj s THR 18 Cb -0.19 -1.35 -0.02 0.00 -1.51 0.00 0.00 72.50 69.43 2yuj s THR 18 CO -0.19 -0.45 0.85 -1.10 -2.21 0.00 0.00 174.62 171.52 2yuj s GLN 19 N -3.85 3.30 -0.27 7.08 -0.21 -1.26 -0.43 119.66 124.01 2yuj s GLN 19 Ca 0.06 0.16 -0.23 0.00 0.02 0.00 0.00 55.36 55.37 2yuj s GLN 19 Cb 0.03 -2.31 0.07 0.00 1.00 0.00 0.00 33.01 31.80 2yuj s GLN 19 CO -0.10 -0.43 0.71 0.71 -2.12 0.00 0.00 175.29 174.07 2yuj s TYR 20 N -2.87 -0.85 0.27 0.91 2.02 -1.04 -4.87 117.35 110.92 2yuj s TYR 20 Ca 0.51 1.97 -0.29 0.00 -0.37 0.00 0.00 57.07 58.88 2yuj s TYR 20 Cb -0.10 0.35 -0.09 0.00 -0.40 0.00 0.00 41.96 41.71 2yuj s TYR 20 CO 0.46 -0.41 1.21 1.03 -1.57 0.00 0.00 175.55 176.27 2yuj s ARG 21 N 0.65 4.49 -0.08 -0.62 0.52 -1.25 -2.38 118.95 120.28 2yuj s ARG 21 Ca -0.02 1.99 -0.05 0.00 -0.52 0.00 0.00 55.73 57.13 2yuj s ARG 21 Cb -0.05 -3.16 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 2yuj s ARG 21 CO -0.04 -0.03 0.13 0.00 0.02 0.00 0.00 175.30 175.39 2yuj s PHE 23 N -1.11 1.18 0.59 0.00 0.08 0.12 -0.34 117.98 118.50 2yuj s PHE 23 Ca 0.19 -1.34 -0.04 0.00 0.12 0.00 0.00 56.93 55.85 2yuj s PHE 23 Cb -0.12 -0.28 0.03 0.00 -0.57 0.00 0.00 43.02 42.08 2yuj s PHE 23 CO 0.08 -0.99 0.87 -1.54 -0.10 0.00 0.00 175.22 173.55 2yuj s SER 24 N -3.24 5.36 -0.23 1.36 1.04 -1.26 -0.20 113.70 116.53 2yuj s SER 24 Ca 0.33 0.45 0.15 0.00 0.48 0.00 0.00 55.95 57.35 2yuj s SER 24 Cb 0.01 -1.36 0.77 0.00 0.10 0.00 0.00 66.02 65.54 2yuj s SER 24 CO 0.20 -1.17 1.70 1.33 0.98 0.00 0.00 173.24 176.28 2yuj n VAL 25 N -2.55 2.69 -0.06 5.02 0.24 -1.12 -4.26 118.33 118.29 2yuj n VAL 25 Ca 0.06 -1.50 -0.06 0.00 -2.04 0.00 0.00 64.34 60.79 2yuj n VAL 25 Cb 0.59 -0.28 -0.10 0.00 -1.47 0.00 0.00 33.84 32.58 2yuj n VAL 25 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2yuj n SER 26 N 0.40 1.90 0.23 -1.34 2.88 -1.26 -4.47 113.62 111.96 2yuj n SER 26 Ca 0.27 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.94 2yuj n SER 26 Cb 1.15 0.84 0.77 0.00 -0.75 0.00 0.00 64.21 66.22 2yuj n SER 26 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2yuj h MET 27 N 0.00 0.00 -7.07 -1.46 2.07 -2.00 -3.43 114.93 103.04 2yuj h MET 27 Ca -0.33 0.00 -0.53 0.00 -2.07 0.00 0.00 59.70 56.77 2yuj h MET 27 Cb 1.74 0.00 0.19 0.00 -1.87 0.00 0.00 31.60 31.66 2yuj h MET 27 CO 0.02 0.00 0.04 -0.11 1.07 0.00 0.00 176.91 177.93 2yuj n LEU 28 N -4.15 2.81 -4.77 1.22 7.94 -1.26 -5.04 117.00 113.75 2yuj n LEU 28 Ca -0.00 0.50 -0.33 0.00 -1.11 0.00 0.00 56.01 55.06 2yuj n LEU 28 Cb 0.20 -1.41 -0.07 0.00 0.53 0.00 0.00 43.42 42.68 2yuj n LEU 28 CO 0.31 -2.36 -0.25 0.00 -1.11 0.00 0.00 177.39 173.98 2yuj s ALA 29 N -2.28 4.20 0.00 1.96 0.00 -1.26 -5.14 121.76 119.24 2yuj s ALA 29 Ca 0.68 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.53 2yuj s ALA 29 Cb -0.27 0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2yuj s ALA 29 CO 0.57 -0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.71 2yuj n GLY 30 N -1.29 4.54 0.36 0.00 0.00 -1.26 -4.94 105.19 102.60 2yuj n GLY 30 Ca -0.21 -1.32 0.12 0.00 0.00 0.00 0.00 46.02 44.61 2yuj n GLY 30 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2yuj h PRO 31 N 0.00 0.76 -5.33 1.61 0.11 -2.08 -3.43 132.00 123.64 2yuj h PRO 31 Ca 0.00 -0.05 -0.51 0.00 0.11 0.00 0.00 66.00 65.55 2yuj h PRO 31 Cb 0.00 -0.17 -0.14 0.00 0.11 0.00 0.00 31.00 30.80 2yuj h PRO 31 CO 0.00 0.51 -0.61 -0.80 -0.21 0.00 0.00 178.00 176.89 2yuj s ASN 32 N -5.50 2.74 0.04 -2.05 0.01 -1.26 -5.16 114.94 103.75 2yuj s ASN 32 Ca -0.11 -1.38 0.03 0.00 -0.71 0.00 0.00 52.86 50.69 2yuj s ASN 32 Cb 0.24 -0.16 -0.02 0.00 0.41 0.00 0.00 41.25 41.72 2yuj s ASN 32 CO 0.80 -0.57 -0.10 -1.81 -1.51 0.00 0.00 177.10 173.92 2yuj s ASP 33 N -3.54 1.12 0.04 -1.22 1.01 -1.26 -5.02 116.67 107.79 2yuj s ASP 33 Ca 0.36 -0.47 0.01 0.00 0.71 0.00 0.00 52.55 53.16 2yuj s ASP 33 Cb 0.09 -0.02 -0.04 0.00 1.01 0.00 0.00 42.92 43.96 2yuj s ASP 33 CO 0.16 -0.09 0.10 -0.13 0.21 0.00 0.00 175.17 175.42 2yuj s ARG 34 N -1.28 3.05 -0.06 8.23 1.81 -1.26 -5.01 118.95 124.43 2yuj s ARG 34 Ca -0.04 -0.55 0.12 0.00 -1.72 0.00 0.00 55.73 53.53 2yuj s ARG 34 Cb -0.08 -2.84 -0.18 0.00 -0.45 0.00 0.00 34.95 31.40 2yuj s ARG 34 CO 0.01 0.61 0.19 -1.13 -0.68 0.00 0.00 175.30 174.30 2yuj n SER 35 N 0.79 2.05 -0.07 0.23 3.41 -1.26 -4.49 113.62 114.28 2yuj n SER 35 Ca -0.10 0.00 0.24 0.00 -0.26 0.00 0.00 58.87 58.74 2yuj n SER 35 Cb 0.52 1.29 0.71 0.00 -0.26 0.00 0.00 64.21 66.46 2yuj n SER 35 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2yuj h ASP 36 N 0.00 0.00 -0.87 4.04 1.82 -1.95 0.17 116.42 119.63 2yuj h ASP 36 Ca -0.12 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 2yuj h ASP 36 Cb 1.03 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.99 2yuj h ASP 36 CO 0.01 0.00 0.55 0.58 -1.61 0.00 0.00 179.24 178.76 2yuj h VAL 37 N 0.00 1.23 -0.06 2.25 2.07 -1.91 -2.21 116.25 117.62 2yuj h VAL 37 Ca 0.32 -0.48 -0.12 0.00 0.82 0.00 0.00 66.70 67.24 2yuj h VAL 37 Cb 1.30 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2yuj h VAL 37 CO -0.00 0.24 -0.52 -0.33 0.02 0.00 0.00 177.57 176.97 2yuj h GLU 38 N 1.19 0.16 -3.79 1.57 5.08 -1.26 -3.37 114.58 114.16 2yuj h GLU 38 Ca 0.32 -0.09 -0.79 0.00 -1.00 0.00 0.00 59.36 57.79 2yuj h GLU 38 Cb -0.09 0.01 -0.26 0.00 0.50 0.00 0.00 28.75 28.91 2yuj h GLU 38 CO -0.06 0.65 0.25 0.15 -1.00 0.00 0.00 179.01 178.99 2yuj s LYS 39 N -3.88 3.81 0.00 2.33 1.02 -0.83 -4.90 119.74 117.28 2yuj s LYS 39 Ca -0.03 -2.69 0.00 0.00 0.02 0.00 0.00 55.97 53.26 2yuj s LYS 39 Cb 0.13 -4.49 0.00 0.00 -0.52 0.00 0.00 37.83 32.95 2yuj s LYS 39 CO 0.77 -1.29 0.00 0.41 -0.92 0.00 0.00 175.35 174.32 2yuj n GLY 40 N 3.60 0.89 2.48 -3.33 0.00 -1.26 -4.84 105.19 102.74 2yuj n GLY 40 Ca 0.18 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.19 5.95 3.74 -0.02 0.00 -1.26 -4.97 105.19 108.44 2yuj n GLY 41 Ca 0.00 -2.61 -0.35 0.00 0.00 0.00 0.00 46.02 43.05 2yuj n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuj s LYS 42 N -3.73 3.69 0.42 1.61 -0.14 -1.24 -0.54 119.74 119.81 2yuj s LYS 42 Ca 0.52 -0.26 0.03 0.00 -1.36 0.00 0.00 55.97 54.91 2yuj s LYS 42 Cb 0.43 -3.18 -0.03 0.00 -1.68 0.00 0.00 37.83 33.37 2yuj s LYS 42 CO -0.18 0.52 0.09 0.96 -0.76 0.00 0.00 175.35 175.98 2yuj s ILE 43 N -0.30 0.79 -0.37 2.17 -4.36 -0.82 -4.59 121.20 113.73 2yuj s ILE 43 Ca 0.10 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 2yuj s ILE 43 Cb -0.12 -2.37 0.11 0.00 1.25 0.00 0.00 42.46 41.34 2yuj s ILE 43 CO 0.01 0.00 0.15 -0.63 0.24 0.00 0.00 174.94 174.71 2yuj s ILE 44 N -3.14 1.33 0.34 8.37 1.01 -0.87 -2.67 121.20 125.57 2yuj s ILE 44 Ca 0.22 -2.02 -0.00 0.00 0.00 0.00 0.00 60.65 58.85 2yuj s ILE 44 Cb 0.03 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2yuj s ILE 44 CO 0.12 -0.75 0.55 -0.04 0.00 0.00 0.00 174.94 174.83 2yuj s MET 45 N 0.99 3.50 1.15 2.79 -1.94 -1.21 -2.65 119.30 121.93 2yuj s MET 45 Ca 0.13 -0.29 -0.16 0.00 -1.71 0.00 0.00 55.69 53.67 2yuj s MET 45 Cb -0.20 -2.66 0.20 0.00 2.01 0.00 0.00 34.83 34.17 2yuj s MET 45 CO -0.13 0.15 0.51 -2.30 -0.01 0.00 0.00 175.02 173.25 2yuj n PRO 46 N -1.68 -2.01 0.21 2.03 -0.02 -1.26 -2.84 135.00 129.43 2yuj n PRO 46 Ca -0.04 -0.56 0.08 0.00 -2.02 0.00 0.00 63.50 60.95 2yuj n PRO 46 Cb 0.56 -1.93 0.47 0.00 -0.02 0.00 0.00 33.50 32.57 2yuj n PRO 46 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2yuj h PRO 47 N -2.37 0.00 -0.27 0.52 0.13 -1.74 -2.94 132.00 125.33 2yuj h PRO 47 Ca -0.57 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2yuj h PRO 47 Cb 1.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 2yuj h PRO 47 CO 0.43 0.28 0.19 0.66 -0.23 0.00 0.00 178.00 179.33 2yuj h SER 48 N 0.00 0.13 -0.49 1.44 4.64 -1.91 -1.71 113.55 115.65 2yuj h SER 48 Ca -0.00 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2yuj h SER 48 Cb 0.68 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 2yuj h SER 48 CO 0.04 0.08 0.19 0.00 -0.87 0.00 0.00 176.83 176.27 2yuj h ALA 49 N 1.86 0.64 -0.07 5.18 0.00 -1.86 0.26 119.26 125.26 2yuj h ALA 49 Ca 0.12 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 2yuj h ALA 49 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2yuj h ALA 49 CO -0.02 0.25 -0.53 1.25 0.00 0.00 0.00 179.25 180.20 2yuj h LEU 50 N 0.65 0.23 -0.15 0.00 5.85 -1.50 0.81 115.31 121.20 2yuj h LEU 50 Ca 0.16 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2yuj h LEU 50 Cb 0.20 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2yuj h LEU 50 CO -0.01 0.72 -0.54 -0.78 -0.34 0.00 0.00 178.44 177.49 2yuj h ASP 51 N 0.16 0.00 0.18 1.25 1.82 -1.07 -3.20 116.42 115.57 2yuj h ASP 51 Ca 0.00 0.00 -0.34 0.00 -0.39 0.00 0.00 57.03 56.30 2yuj h ASP 51 Cb 0.99 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.94 2yuj h ASP 51 CO 0.08 0.54 -2.13 1.67 -1.61 0.00 0.00 179.24 177.79 2yuj n GLN 52 N -3.29 0.67 0.02 0.28 7.27 0.89 -3.73 117.38 119.50 2yuj n GLN 52 Ca 0.01 0.12 -0.12 0.00 0.07 0.00 0.00 57.00 57.09 2yuj n GLN 52 Cb 0.72 -1.63 -0.06 0.00 2.41 0.00 0.00 30.24 31.68 2yuj n GLN 52 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 2yuj h LEU 53 N 0.00 0.04 -0.95 1.69 3.38 0.56 -1.20 115.31 118.84 2yuj h LEU 53 Ca -0.45 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.39 2yuj h LEU 53 Cb 2.14 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 2yuj h LEU 53 CO 0.04 0.06 -0.46 -1.28 0.09 0.00 0.00 178.44 176.89 2yuj h SER 54 N 0.03 0.15 0.90 -0.43 0.87 -1.74 -1.89 113.55 111.44 2yuj h SER 54 Ca 0.01 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2yuj h SER 54 Cb 0.02 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2yuj h SER 54 CO -0.00 0.59 -0.15 0.03 -0.53 0.00 0.00 176.83 176.77 2yuj h ARG 55 N 0.12 0.00 -0.69 2.24 2.47 -1.56 -2.63 114.38 114.32 2yuj h ARG 55 Ca 0.01 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2yuj h ARG 55 Cb 0.86 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.18 2yuj h ARG 55 CO 0.07 0.15 0.00 1.28 0.56 0.00 0.00 179.97 182.03 2yuj n LEU 56 N -3.32 4.55 -3.14 3.04 4.77 -0.48 -4.89 117.00 117.52 2yuj n LEU 56 Ca 0.00 -2.31 -0.23 0.00 -0.03 0.00 0.00 56.01 53.44 2yuj n LEU 56 Cb 0.37 -0.64 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 2yuj n LEU 56 CO 0.31 0.53 0.01 -3.20 -1.33 0.00 0.00 177.39 173.71 2yuj n ASN 57 N 0.46 -5.66 -4.64 -1.43 5.15 -0.99 -4.96 115.26 103.20 2yuj n ASN 57 Ca 0.21 -0.33 -0.36 0.00 -0.60 0.00 0.00 54.58 53.50 2yuj n ASN 57 Cb 0.96 -4.58 -0.10 0.00 -0.53 0.00 0.00 39.78 35.54 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 -3.14 5.20 0.42 -1.44 1.01 -0.74 -5.05 121.20 117.46 2yuj s ILE 58 Ca 0.35 0.13 0.07 0.00 0.00 0.00 0.00 60.65 61.19 2yuj s ILE 58 Cb -0.16 -3.42 -0.06 0.00 0.01 0.00 0.00 42.46 38.83 2yuj s ILE 58 CO 0.43 0.35 0.11 0.42 0.00 0.00 0.00 174.94 176.25 2yuj s THR 59 N 1.06 2.13 0.36 2.92 -4.23 -1.26 -4.30 115.64 112.32 2yuj s THR 59 Ca 0.07 -1.83 -0.28 0.00 -1.18 0.00 0.00 61.69 58.47 2yuj s THR 59 Cb -0.14 -2.96 -0.10 0.00 1.34 0.00 0.00 72.50 70.64 2yuj s THR 59 CO 0.04 0.00 1.34 -0.47 -0.54 0.00 0.00 174.62 174.99 2yuj s TYR 60 N -2.66 2.91 0.81 3.99 5.04 -1.26 -4.15 117.35 122.03 2yuj s TYR 60 Ca 0.37 1.37 -0.12 0.00 -2.44 0.00 0.00 57.07 56.25 2yuj s TYR 60 Cb 0.06 -3.74 0.08 0.00 0.35 0.00 0.00 41.96 38.71 2yuj s TYR 60 CO 0.20 -2.12 1.12 -1.25 -1.34 0.00 0.00 175.55 172.17 2yuj s PRO 61 N -1.95 1.99 -0.49 4.97 0.04 -1.26 -5.14 135.00 133.16 2yuj s PRO 61 Ca 0.51 0.40 0.07 0.00 0.04 0.00 0.00 61.00 62.03 2yuj s PRO 61 Cb -0.41 -1.93 0.26 0.00 0.04 0.00 0.00 34.50 32.47 2yuj s PRO 61 CO 0.54 -1.63 0.63 -1.33 0.04 0.00 0.00 177.00 175.25 2yuj n MET 62 N -3.40 1.51 -2.93 4.56 2.81 -1.26 -5.04 117.12 113.37 2yuj n MET 62 Ca 0.07 -3.84 -0.34 0.00 -1.81 0.00 0.00 57.70 51.78 2yuj n MET 62 Cb 0.58 -1.67 -0.07 0.00 -0.71 0.00 0.00 33.22 31.35 2yuj n MET 62 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2yuj s LEU 63 N -1.83 4.06 0.01 4.03 1.43 -1.26 -3.98 118.68 121.14 2yuj s LEU 63 Ca 0.38 1.57 0.08 0.00 -1.03 0.00 0.00 54.13 55.12 2yuj s LEU 63 Cb 0.18 -4.26 -0.03 0.00 0.03 0.00 0.00 46.19 42.11 2yuj s LEU 63 CO -0.07 -0.24 -0.23 -0.36 0.23 0.00 0.00 176.35 175.68 2yuj s PHE 64 N -2.00 2.43 -0.45 0.29 0.08 -0.77 -3.76 117.98 113.79 2yuj s PHE 64 Ca 0.57 -0.35 -0.17 0.00 0.12 0.00 0.00 56.93 57.09 2yuj s PHE 64 Cb -0.11 -1.47 0.04 0.00 -0.57 0.00 0.00 43.02 40.91 2yuj s PHE 64 CO 0.16 0.11 0.46 0.21 -0.10 0.00 0.00 175.22 176.07 2yuj s LYS 65 N -1.03 3.06 -0.65 0.44 2.20 0.62 -2.27 119.74 122.11 2yuj s LYS 65 Ca 0.12 -0.96 -0.22 0.00 -0.36 0.00 0.00 55.97 54.55 2yuj s LYS 65 Cb -0.10 -4.04 0.08 0.00 -1.51 0.00 0.00 37.83 32.26 2yuj s LYS 65 CO 0.02 -0.98 0.91 -0.51 -0.36 0.00 0.00 175.35 174.42 2yuj s LEU 66 N 2.11 4.64 -0.44 5.43 1.43 0.20 -2.24 118.68 129.80 2yuj s LEU 66 Ca 0.10 -1.12 -0.09 0.00 -1.03 0.00 0.00 54.13 51.99 2yuj s LEU 66 Cb -0.20 -2.39 0.09 0.00 0.03 0.00 0.00 46.19 43.73 2yuj s LEU 66 CO 0.11 -1.36 0.29 -0.89 0.23 0.00 0.00 176.35 174.73 2yuj s THR 67 N 3.71 4.18 0.12 5.49 2.01 -0.94 -1.33 115.64 128.89 2yuj s THR 67 Ca 0.20 -1.56 -0.31 0.00 0.31 0.00 0.00 61.69 60.33 2yuj s THR 67 Cb -0.18 -3.64 -0.08 0.00 0.01 0.00 0.00 72.50 68.61 2yuj s THR 67 CO 0.09 -0.61 1.45 0.21 -0.69 0.00 0.00 174.62 175.08 2yuj s ASN 68 N 2.30 6.75 -0.56 3.53 2.47 -0.71 -3.61 114.94 125.11 2yuj s ASN 68 Ca 0.04 2.39 -0.01 0.00 0.42 0.00 0.00 52.86 55.71 2yuj s ASN 68 Cb -0.24 -2.58 0.43 0.00 -1.45 0.00 0.00 41.25 37.41 2yuj s ASN 68 CO 0.01 -0.72 2.00 0.29 -3.72 0.00 0.00 177.10 174.96 2yuj n LYS 69 N 4.18 2.42 0.00 0.43 4.76 -1.26 -3.33 118.16 125.37 2yuj n LYS 69 Ca 0.13 -2.86 0.00 0.00 -2.87 0.00 0.00 58.31 52.70 2yuj n LYS 69 Cb 0.41 -2.12 0.00 0.00 -1.84 0.00 0.00 35.03 31.48 2yuj n LYS 69 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2yuj n ASN 70 N -0.69 0.00 -1.08 4.39 4.05 -1.26 -4.88 115.26 115.79 2yuj n ASN 70 Ca 0.55 0.00 0.08 0.00 0.45 0.00 0.00 54.58 55.66 2yuj n ASN 70 Cb 0.80 0.05 0.26 0.00 1.23 0.00 0.00 39.78 42.12 2yuj n ASN 70 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 2yuj n SER 71 N -2.25 3.83 -2.53 1.20 7.64 -1.26 -4.95 113.62 115.30 2yuj n SER 71 Ca 0.00 -2.34 -0.16 0.00 1.01 0.00 0.00 58.87 57.39 2yuj n SER 71 Cb 0.00 -0.43 -0.00 0.00 -1.01 0.00 0.00 64.21 62.76 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 0.65 -4.48 -4.89 6.43 9.92 -1.21 -4.94 116.55 118.03 2yuj n ASP 72 Ca 0.20 0.08 -0.29 0.00 -0.53 0.00 0.00 54.79 54.24 2yuj n ASP 72 Cb 0.69 -3.76 0.02 0.00 -0.64 0.00 0.00 41.12 37.42 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 -5.14 3.35 -0.27 -1.24 1.81 -1.23 -4.92 118.95 111.31 2yuj s ARG 73 Ca 0.04 0.45 -0.08 0.00 -1.72 0.00 0.00 55.73 54.43 2yuj s ARG 73 Cb -0.02 -2.17 0.13 0.00 -0.45 0.00 0.00 34.95 32.44 2yuj s ARG 73 CO 0.05 -0.59 0.57 1.41 -0.68 0.00 0.00 175.30 176.07 2yuj s MET 74 N -5.08 0.50 0.05 3.54 -2.45 -1.26 -1.75 119.30 112.85 2yuj s MET 74 Ca 0.54 1.24 -0.05 0.00 -1.25 0.00 0.00 55.69 56.16 2yuj s MET 74 Cb -0.11 0.63 -0.01 0.00 1.25 0.00 0.00 34.83 36.59 2yuj s MET 74 CO 0.50 -0.30 0.09 -0.08 1.05 0.00 0.00 175.02 176.28 2yuj s THR 75 N 2.81 0.14 -0.22 10.11 -1.32 -0.44 -4.91 115.64 121.81 2yuj s THR 75 Ca 0.00 -1.18 0.02 0.00 -1.21 0.00 0.00 61.69 59.31 2yuj s THR 75 Cb -0.13 -1.01 0.05 0.00 -1.51 0.00 0.00 72.50 69.90 2yuj s THR 75 CO -0.18 -0.65 -0.11 -1.00 -2.21 0.00 0.00 174.62 170.47 2yuj s HIS 76 N -2.90 2.71 0.39 9.09 3.76 -1.26 0.59 115.29 127.67 2yuj s HIS 76 Ca -0.02 -1.85 0.08 0.00 -0.15 0.00 0.00 55.06 53.11 2yuj s HIS 76 Cb 0.01 -1.75 -0.02 0.00 1.11 0.00 0.00 32.58 31.93 2yuj s HIS 76 CO -0.06 -0.80 0.35 0.00 -0.85 0.00 0.00 174.74 173.39 2yuj s GLY 78 N -4.09 1.31 0.44 0.00 0.00 0.30 -1.85 107.32 103.43 2yuj s GLY 78 Ca 0.46 -1.09 -0.18 0.00 0.00 0.00 0.00 44.72 43.90 2yuj s GLY 78 CO 0.28 -0.85 0.92 0.54 0.00 0.00 0.00 173.10 173.98 2yuj s VAL 79 N -0.53 4.49 0.15 1.40 0.11 -1.26 -1.94 120.40 122.82 2yuj s VAL 79 Ca 0.07 1.30 0.00 0.00 -2.93 0.00 0.00 61.98 60.42 2yuj s VAL 79 Cb -0.11 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.10 2yuj s VAL 79 CO 0.00 -0.41 0.00 -0.11 -3.33 0.00 0.00 175.10 171.25 2yuj n LEU 80 N -0.90 0.42 -4.74 2.54 7.94 -1.09 -4.76 117.00 116.42 2yuj n LEU 80 Ca 0.06 0.25 -0.24 0.00 -1.11 0.00 0.00 56.01 54.97 2yuj n LEU 80 Cb 0.54 0.01 -0.07 0.00 0.53 0.00 0.00 43.42 44.43 2yuj n LEU 80 CO 0.41 -0.72 -0.16 -1.61 -1.11 0.00 0.00 177.39 174.19 2yuj s GLU 81 N -1.81 2.24 -0.42 1.96 2.02 -1.20 -5.05 118.70 116.44 2yuj s GLU 81 Ca 0.00 -1.81 0.06 0.00 0.02 0.00 0.00 54.97 53.24 2yuj s GLU 81 Cb 0.00 -2.01 0.21 0.00 0.10 0.00 0.00 34.13 32.43 2yuj s GLU 81 CO 0.00 -0.09 0.44 1.19 0.02 0.00 0.00 175.26 176.82 2yuj n PHE 82 N -1.23 -0.41 -2.53 1.61 3.72 -1.26 -3.29 117.46 114.07 2yuj n PHE 82 Ca -0.01 -3.48 0.02 0.00 -0.05 0.00 0.00 57.45 53.93 2yuj n PHE 82 Cb 0.64 -0.07 0.02 0.00 -0.94 0.00 0.00 39.48 39.14 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 2.10 0.28 -3.03 -4.37 0.24 -1.13 -4.25 118.33 108.17 2yuj n VAL 83 Ca 0.26 -1.32 -0.24 0.00 -2.04 0.00 0.00 64.34 60.99 2yuj n VAL 83 Cb 0.50 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 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 -0.82 3.63 0.55 2.33 0.00 -1.14 -4.93 121.76 121.38 2yuj s ALA 84 Ca 0.28 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.27 2yuj s ALA 84 Cb 0.34 -2.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.16 2yuj s ALA 84 CO -0.12 -0.26 0.95 0.34 0.00 0.00 0.00 175.76 176.66 2yuj s ASP 85 N -4.13 6.35 0.26 0.00 -1.08 -1.26 -3.77 116.67 113.03 2yuj s ASP 85 Ca 0.45 1.33 -0.31 0.00 -0.52 0.00 0.00 52.55 53.50 2yuj s ASP 85 Cb -0.10 -2.42 -0.12 0.00 -1.46 0.00 0.00 42.92 38.82 2yuj s ASP 85 CO 0.39 -0.70 1.66 -1.61 0.52 0.00 0.00 175.17 175.43 2yuj s GLU 86 N -4.72 4.11 -1.10 4.34 0.41 -1.26 -1.85 118.70 118.63 2yuj s GLU 86 Ca 0.54 2.61 0.00 0.00 -0.41 0.00 0.00 54.97 57.71 2yuj s GLU 86 Cb -0.11 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 29.20 2yuj s GLU 86 CO 0.45 -0.70 0.00 0.41 -0.49 0.00 0.00 175.26 174.93 2yuj n GLY 87 N 3.00 0.12 3.10 -1.39 0.00 -1.26 -5.00 105.19 103.76 2yuj n GLY 87 Ca 0.12 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.59 -0.16 -0.06 -0.61 1.01 -0.77 -4.39 121.20 113.63 2yuj s ILE 88 Ca 0.00 0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.83 2yuj s ILE 88 Cb 0.00 -0.46 0.02 0.00 0.01 0.00 0.00 42.46 42.03 2yuj s ILE 88 CO 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 174.94 174.95 2yuj s TYR 90 N 1.07 3.58 0.06 0.00 2.02 -1.09 0.11 117.35 123.11 2yuj s TYR 90 Ca -0.08 0.82 -0.03 0.00 -0.37 0.00 0.00 57.07 57.40 2yuj s TYR 90 Cb -0.14 -2.36 -0.03 0.00 -0.40 0.00 0.00 41.96 39.03 2yuj s TYR 90 CO -0.01 0.39 0.03 -0.51 -1.57 0.00 0.00 175.55 173.89 2yuj s LEU 91 N -0.12 2.18 0.00 -1.29 1.02 0.72 -2.04 118.68 119.15 2yuj s LEU 91 Ca 0.22 -0.90 -0.11 0.00 0.02 0.00 0.00 54.13 53.36 2yuj s LEU 91 Cb -0.15 0.44 0.18 0.00 0.02 0.00 0.00 46.19 46.68 2yuj s LEU 91 CO 0.09 -0.64 0.40 -2.65 0.02 0.00 0.00 176.35 173.57 2yuj n PRO 92 N 0.07 -1.71 -0.09 1.29 -0.02 -1.26 -2.78 135.00 130.50 2yuj n PRO 92 Ca -0.14 -0.66 -0.11 0.00 -2.02 0.00 0.00 63.50 60.56 2yuj n PRO 92 Cb 0.61 -1.18 -0.15 0.00 -0.02 0.00 0.00 33.50 32.77 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 -4.20 0.22 0.01 6.00 -0.00 -1.26 -3.66 115.22 112.32 2yuj n HIS 93 Ca 0.06 0.07 -0.04 0.00 0.46 0.00 0.00 57.72 58.28 2yuj n HIS 93 Cb 0.27 -1.04 0.19 0.00 -0.12 0.00 0.00 29.99 29.29 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 0.00 0.56 0.04 1.57 5.08 -1.93 -2.43 115.95 118.85 2yuj h TRP 94 Ca -0.50 -0.12 -0.23 0.00 1.08 0.00 0.00 58.89 59.12 2yuj h TRP 94 Cb 2.16 -0.14 -0.02 0.00 -3.00 0.00 0.00 29.16 28.16 2yuj h TRP 94 CO 0.01 0.72 -1.04 1.98 -1.28 0.00 0.00 178.44 178.82 2yuj h MET 95 N 0.44 0.12 -0.07 0.12 4.05 -1.91 -2.41 114.93 115.27 2yuj h MET 95 Ca 0.06 -0.18 -0.09 0.00 -0.28 0.00 0.00 59.70 59.22 2yuj h MET 95 Cb 0.69 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.54 2yuj h MET 95 CO 0.05 1.05 -0.35 0.52 0.23 0.00 0.00 176.91 178.41 2yuj h MET 96 N 0.04 0.14 0.14 0.39 2.86 -1.59 -2.70 114.93 114.22 2yuj h MET 96 Ca -0.05 -0.05 -0.32 0.00 -2.06 0.00 0.00 59.70 57.21 2yuj h MET 96 Cb 1.77 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.42 2yuj h MET 96 CO 0.15 0.48 -1.57 0.37 1.06 0.00 0.00 176.91 177.39 2yuj h GLN 97 N 0.12 0.31 -0.18 1.72 4.15 -1.47 -2.77 115.11 117.00 2yuj h GLN 97 Ca 0.01 -0.52 0.00 0.00 0.77 0.00 0.00 58.65 58.91 2yuj h GLN 97 Cb 0.68 0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.56 2yuj h GLN 97 CO 0.05 1.19 0.12 -0.97 -1.93 0.00 0.00 178.83 177.29 2yuj h ASN 98 N 0.08 0.20 0.70 -0.69 -1.24 -1.32 -1.37 115.58 111.95 2yuj h ASN 98 Ca -0.27 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.74 2yuj h ASN 98 Cb 2.05 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 41.05 2yuj h ASN 98 CO 0.18 0.14 -0.98 0.18 -1.29 0.00 0.00 177.43 175.66 2yuj n LEU 99 N -4.51 0.67 -2.15 0.34 4.77 -1.03 -4.97 117.00 110.12 2yuj n LEU 99 Ca -0.00 0.16 -0.16 0.00 -0.03 0.00 0.00 56.01 55.98 2yuj n LEU 99 Cb 0.08 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.08 2yuj n LEU 99 CO 0.35 -0.06 -0.06 0.18 -1.33 0.00 0.00 177.39 176.47 2yuj n LEU 100 N -2.26 -2.20 0.00 2.23 4.77 -0.52 -4.90 117.00 114.12 2yuj n LEU 100 Ca 0.01 -0.16 -0.26 0.00 -0.03 0.00 0.00 56.01 55.58 2yuj n LEU 100 Cb 0.48 -2.34 0.18 0.00 -2.33 0.00 0.00 43.42 39.41 2yuj n LEU 100 CO 0.39 0.08 0.76 0.18 -1.33 0.00 0.00 177.39 177.48 2yuj n LEU 101 N -2.83 0.00 -4.51 2.23 4.77 -1.07 -5.05 117.00 110.54 2yuj n LEU 101 Ca -0.11 -1.26 -0.25 0.00 -0.03 0.00 0.00 56.01 54.35 2yuj n LEU 101 Cb 0.61 -0.89 -0.09 0.00 -2.33 0.00 0.00 43.42 40.72 2yuj n LEU 101 CO 0.31 -1.34 -0.22 -0.70 -1.33 0.00 0.00 177.39 174.11 2yuj s GLU 102 N -5.52 1.87 -0.46 3.23 2.56 -1.26 -4.94 118.70 114.17 2yuj s GLU 102 Ca 0.66 -2.12 -0.26 0.00 0.00 0.00 0.00 54.97 53.25 2yuj s GLU 102 Cb -0.02 -0.73 -0.07 0.00 2.00 0.00 0.00 34.13 35.31 2yuj s GLU 102 CO 0.46 -0.39 2.40 0.39 -0.56 0.00 0.00 175.26 177.56 2yuj n GLU 103 N -0.87 1.14 -1.90 4.30 1.02 -1.26 -1.75 120.64 121.32 2yuj n GLU 103 Ca -0.06 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2yuj n GLU 103 Cb 0.66 -3.43 0.00 0.00 -0.02 0.00 0.00 31.44 28.65 2yuj n GLU 103 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2yuj n GLY 104 N 5.99 0.81 3.71 0.62 0.00 0.54 -4.99 105.19 111.86 2yuj n GLY 104 Ca 0.36 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.75 2.53 -0.07 -0.02 0.00 -0.72 -4.56 107.32 101.73 2yuj s GLY 105 Ca 0.00 0.08 -0.30 0.00 0.00 0.00 0.00 44.72 44.50 2yuj s GLY 105 CO 0.00 1.21 1.02 1.08 0.00 0.00 0.00 173.10 176.41 2yuj s LEU 106 N 0.99 4.29 -0.01 0.66 1.43 -1.26 -1.00 118.68 123.77 2yuj s LEU 106 Ca 0.36 1.61 0.03 0.00 -1.03 0.00 0.00 54.13 55.11 2yuj s LEU 106 Cb -0.17 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 2yuj s LEU 106 CO 0.17 -0.41 -0.10 -0.69 0.23 0.00 0.00 176.35 175.55 2yuj s VAL 107 N 1.71 0.83 -0.25 -1.59 1.01 -1.00 -4.87 120.40 116.23 2yuj s VAL 107 Ca 0.50 -0.44 -0.28 0.00 0.00 0.00 0.00 61.98 61.76 2yuj s VAL 107 Cb -0.20 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 2yuj s VAL 107 CO 0.22 0.24 2.01 -1.58 0.00 0.00 0.00 175.10 175.98 2yuj s GLN 108 N -0.21 3.28 -0.14 2.72 2.00 -1.24 -2.50 119.66 123.57 2yuj s GLN 108 Ca 0.03 1.79 -0.07 0.00 -2.00 0.00 0.00 55.36 55.12 2yuj s GLN 108 Cb -0.04 -4.28 -0.04 0.00 0.80 0.00 0.00 33.01 29.45 2yuj s GLN 108 CO -0.00 -1.92 0.12 0.08 -0.50 0.00 0.00 175.29 173.06 2yuj s VAL 109 N 7.45 5.30 0.17 1.34 1.01 0.42 -2.20 120.40 133.89 2yuj s VAL 109 Ca 0.90 0.14 0.02 0.00 0.00 0.00 0.00 61.98 63.04 2yuj s VAL 109 Cb -0.29 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 32.72 2yuj s VAL 109 CO 0.34 0.56 -0.00 -1.61 0.00 0.00 0.00 175.10 174.40 2yuj s GLU 110 N -0.58 1.12 -0.24 2.72 0.41 -0.95 -1.30 118.70 119.87 2yuj s GLU 110 Ca 0.12 -1.54 0.02 0.00 -0.41 0.00 0.00 54.97 53.16 2yuj s GLU 110 Cb -0.12 -0.29 0.06 0.00 -1.78 0.00 0.00 34.13 32.00 2yuj s GLU 110 CO 0.02 -0.12 -0.08 -1.54 -0.49 0.00 0.00 175.26 173.04 2yuj s SER 111 N -3.18 3.98 0.09 -0.19 1.04 -0.83 -0.28 113.70 114.33 2yuj s SER 111 Ca 0.24 -1.20 0.08 0.00 0.48 0.00 0.00 55.95 55.55 2yuj s SER 111 Cb 0.06 -1.32 -0.03 0.00 0.10 0.00 0.00 66.02 64.83 2yuj s SER 111 CO 0.04 -0.20 -0.21 0.68 0.98 0.00 0.00 173.24 174.53 2yuj s VAL 112 N 1.29 1.71 -0.50 5.02 -7.23 -1.25 -4.67 120.40 114.77 2yuj s VAL 112 Ca -0.06 -1.45 -0.12 0.00 -1.81 0.00 0.00 61.98 58.54 2yuj s VAL 112 Cb -0.19 -1.53 0.12 0.00 0.56 0.00 0.00 36.38 35.34 2yuj s VAL 112 CO -0.06 0.01 0.40 0.20 -0.31 0.00 0.00 175.10 175.35 2yuj s ASN 113 N -1.71 5.89 0.65 4.85 -0.87 -1.26 -4.58 114.94 117.91 2yuj s ASN 113 Ca 0.07 -1.87 0.05 0.00 -1.57 0.00 0.00 52.86 49.54 2yuj s ASN 113 Cb -0.10 -2.09 0.11 0.00 -0.02 0.00 0.00 41.25 39.15 2yuj s ASN 113 CO 0.04 -0.76 0.89 -0.76 -2.57 0.00 0.00 177.10 173.94 2yuj s LEU 114 N 1.45 3.04 0.40 0.60 1.43 -1.26 -5.10 118.68 119.24 2yuj s LEU 114 Ca 0.05 -0.64 0.07 0.00 -1.03 0.00 0.00 54.13 52.58 2yuj s LEU 114 Cb -0.28 -1.76 -0.08 0.00 0.03 0.00 0.00 46.19 44.10 2yuj s LEU 114 CO 0.01 -1.61 0.01 0.00 0.23 0.00 0.00 176.35 174.98 2yuj s GLN 115 N -4.90 1.93 0.51 1.70 0.00 -1.26 -4.62 119.66 113.02 2yuj s GLN 115 Ca 0.64 -2.09 -0.22 0.00 -0.00 0.00 0.00 55.36 53.69 2yuj s GLN 115 Cb -0.05 -1.60 -0.06 0.00 0.00 0.00 0.00 33.01 31.29 2yuj s GLN 115 CO 0.42 -0.04 1.29 0.14 0.00 0.00 0.00 175.29 177.09 2yuj s VAL 116 N -2.73 2.46 0.22 3.63 -7.23 -1.18 -0.77 120.40 114.79 2yuj s VAL 116 Ca 0.35 0.35 -0.10 0.00 -1.81 0.00 0.00 61.98 60.77 2yuj s VAL 116 Cb 0.09 -3.18 -0.07 0.00 0.56 0.00 0.00 36.38 33.79 2yuj s VAL 116 CO 0.18 -0.00 0.55 0.00 -0.31 0.00 0.00 175.10 175.51 2yuj s ALA 117 N -1.38 3.57 -0.07 1.32 0.00 -1.26 -4.72 121.76 119.21 2yuj s ALA 117 Ca 0.68 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.39 2yuj s ALA 117 Cb -0.36 -2.44 -0.06 0.00 0.00 0.00 0.00 23.12 20.27 2yuj s ALA 117 CO 0.43 0.51 -0.04 0.25 0.00 0.00 0.00 175.76 176.91 2yuj n THR 118 N -0.06 0.42 -3.99 0.00 -2.24 -1.22 -4.54 114.28 102.65 2yuj n THR 118 Ca -0.00 -0.19 -0.31 0.00 -2.27 0.00 0.00 64.05 61.28 2yuj n THR 118 Cb 0.52 -0.79 -0.16 0.00 -2.10 0.00 0.00 70.33 67.81 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 -2.15 2.64 -0.11 4.78 5.04 -1.26 0.52 117.35 126.81 2yuj s TYR 119 Ca -0.08 -1.86 0.00 0.00 -2.44 0.00 0.00 57.07 52.69 2yuj s TYR 119 Cb 0.02 -1.70 0.02 0.00 0.35 0.00 0.00 41.96 40.66 2yuj s TYR 119 CO 0.19 -0.79 -0.10 -1.12 -1.34 0.00 0.00 175.55 172.38 2yuj s SER 120 N 1.31 2.20 -0.17 4.32 0.01 -1.24 -0.10 113.70 120.04 2yuj s SER 120 Ca -0.05 -0.34 -0.08 0.00 1.31 0.00 0.00 55.95 56.79 2yuj s SER 120 Cb -0.18 -0.92 -0.04 0.00 0.21 0.00 0.00 66.02 65.09 2yuj s SER 120 CO -0.07 -0.07 0.09 -0.75 0.41 0.00 0.00 173.24 172.86 2yuj s LYS 121 N 1.40 3.89 0.30 12.44 2.47 0.23 -1.30 119.74 139.17 2yuj s LYS 121 Ca 0.00 -0.27 0.11 0.00 -1.56 0.00 0.00 55.97 54.25 2yuj s LYS 121 Cb -0.13 -3.25 -0.05 0.00 -1.46 0.00 0.00 37.83 32.93 2yuj s LYS 121 CO -0.06 0.40 -0.14 -0.06 0.16 0.00 0.00 175.35 175.65 2yuj s PHE 122 N 0.05 2.38 -0.35 4.03 0.40 -1.18 -0.24 117.98 123.06 2yuj s PHE 122 Ca 0.07 -0.37 0.03 0.00 -0.60 0.00 0.00 56.93 56.07 2yuj s PHE 122 Cb -0.12 -1.14 0.16 0.00 0.51 0.00 0.00 43.02 42.43 2yuj s PHE 122 CO 0.00 0.66 0.42 -1.14 0.70 0.00 0.00 175.22 175.86 2yuj s GLN 123 N -3.57 0.60 -0.25 0.44 0.74 -0.20 -2.71 119.66 114.71 2yuj s GLN 123 Ca 0.31 -0.51 -0.38 0.00 0.05 0.00 0.00 55.36 54.84 2yuj s GLN 123 Cb -0.03 -0.50 -0.14 0.00 1.10 0.00 0.00 33.01 33.44 2yuj s GLN 123 CO 0.16 -1.15 1.88 -2.30 -0.55 0.00 0.00 175.29 173.33 2yuj n PRO 124 N 4.58 1.38 0.07 1.67 -0.02 -1.26 -3.35 135.00 138.06 2yuj n PRO 124 Ca 0.08 0.49 -0.01 0.00 -2.02 0.00 0.00 63.50 62.03 2yuj n PRO 124 Cb 0.48 -2.31 0.26 0.00 -0.02 0.00 0.00 33.50 31.91 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 8.81 0.34 -6.24 -0.52 1.08 -1.89 -3.43 115.11 113.26 2yuj h GLN 125 Ca -0.43 -0.12 -0.66 0.00 -1.45 0.00 0.00 58.65 55.99 2yuj h GLN 125 Cb 1.31 -0.02 -0.14 0.00 -0.05 0.00 0.00 27.48 28.58 2yuj h GLN 125 CO 0.97 0.59 -0.66 0.45 -0.95 0.00 0.00 178.83 179.23 2yuj s SER 126 N -6.85 5.00 0.25 1.46 0.15 -1.26 -5.01 113.70 107.44 2yuj s SER 126 Ca -0.06 -0.09 0.25 0.00 0.70 0.00 0.00 55.95 56.75 2yuj s SER 126 Cb 0.14 -1.24 0.93 0.00 -1.71 0.00 0.00 66.02 64.14 2yuj s SER 126 CO 0.77 0.25 1.74 -0.81 1.20 0.00 0.00 173.24 176.39 2yuj n PRO 127 N 1.16 0.23 -0.14 5.44 -0.04 -1.26 -3.32 135.00 137.06 2yuj n PRO 127 Ca -0.13 0.36 0.14 0.00 -0.04 0.00 0.00 63.50 63.82 2yuj n PRO 127 Cb 0.52 -1.86 0.50 0.00 -0.04 0.00 0.00 33.50 32.61 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 0.40 0.18 3.54 5.19 -1.97 -0.36 116.42 123.41 2yuj h ASP 128 Ca 0.00 0.02 -0.20 0.00 -0.62 0.00 0.00 57.03 56.23 2yuj h ASP 128 Cb 0.51 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 39.95 2yuj h ASP 128 CO 0.00 0.22 -0.76 0.15 -3.12 0.00 0.00 179.24 175.73 2yuj h PHE 129 N 0.43 0.66 -0.14 4.55 3.04 -1.90 -3.12 116.94 120.45 2yuj h PHE 129 Ca 0.34 -0.30 -0.04 0.00 3.98 0.00 0.00 57.97 61.96 2yuj h PHE 129 Cb 0.73 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 39.13 2yuj h PHE 129 CO -0.00 1.07 -0.08 -0.07 -2.02 0.00 0.00 178.31 177.21 2yuj h LEU 130 N 0.32 0.20 -2.32 0.59 3.38 -1.26 -1.67 115.31 114.55 2yuj h LEU 130 Ca -0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2yuj h LEU 130 Cb 1.35 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 2yuj h LEU 130 CO 0.14 0.31 -0.04 0.44 0.09 0.00 0.00 178.44 179.37 2yuj h ASP 131 N 0.21 0.00 -3.94 -0.43 3.32 -1.35 -3.44 116.42 110.79 2yuj h ASP 131 Ca 0.05 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.56 2yuj h ASP 131 Cb 0.28 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.94 2yuj h ASP 131 CO 0.01 0.04 0.78 -0.38 -1.72 0.00 0.00 179.24 177.98 2yuj n ILE 132 N -3.48 2.02 0.14 0.35 5.41 -0.63 -4.90 119.36 118.26 2yuj n ILE 132 Ca -0.02 -0.50 -0.01 0.00 1.00 0.00 0.00 62.75 63.22 2yuj n ILE 132 Cb 0.16 -1.99 0.24 0.00 -0.71 0.00 0.00 39.64 37.34 2yuj n ILE 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yuj h THR 133 N 2.95 1.34 -2.07 1.39 1.03 -1.88 -3.34 112.91 112.33 2yuj h THR 133 Ca -0.51 -1.65 -0.56 0.00 -0.01 0.00 0.00 66.41 63.68 2yuj h THR 133 Cb 1.24 1.85 -0.40 0.00 -1.07 0.00 0.00 68.15 69.77 2yuj h THR 133 CO 0.64 0.48 -0.95 0.59 -0.01 0.00 0.00 175.52 176.27 2yuj n ASN 134 N -3.97 1.60 -0.07 0.00 4.13 -1.26 -4.94 115.26 110.74 2yuj n ASN 134 Ca -0.02 -3.03 0.10 0.00 1.68 0.00 0.00 54.58 53.31 2yuj n ASN 134 Cb 0.51 -0.64 0.47 0.00 -1.54 0.00 0.00 39.78 38.58 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 3.77 0.46 -0.40 3.52 0.11 -1.84 -2.01 132.00 135.61 2yuj h PRO 135 Ca 0.11 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 2yuj h PRO 135 Cb 0.81 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.79 2yuj h PRO 135 CO 0.60 0.30 0.14 -0.22 -0.21 0.00 0.00 178.00 178.60 2yuj h LYS 136 N 0.47 0.62 -0.38 1.05 3.64 -1.94 -0.40 116.57 119.63 2yuj h LYS 136 Ca 0.25 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2yuj h LYS 136 Cb 0.39 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2yuj h LYS 136 CO -0.07 0.61 0.13 0.00 -2.27 0.00 0.00 179.45 177.84 2yuj h ALA 137 N 0.98 0.50 -0.76 5.00 0.00 -1.80 -1.14 119.26 122.04 2yuj h ALA 137 Ca 0.13 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2yuj h ALA 137 Cb 0.24 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2yuj h ALA 137 CO -0.01 0.13 0.25 0.28 0.00 0.00 0.00 179.25 179.90 2yuj h VAL 138 N 0.47 1.26 -0.33 0.00 2.07 -1.32 0.86 116.25 119.25 2yuj h VAL 138 Ca 0.12 -0.90 -0.10 0.00 0.82 0.00 0.00 66.70 66.65 2yuj h VAL 138 Cb 0.24 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2yuj h VAL 138 CO -0.01 0.36 -0.20 0.25 0.02 0.00 0.00 177.57 178.00 2yuj h LEU 139 N 1.12 0.62 -0.24 2.57 5.85 -0.89 -2.64 115.31 121.70 2yuj h LEU 139 Ca 0.25 -0.20 -0.20 0.00 0.84 0.00 0.00 57.88 58.56 2yuj h LEU 139 Cb 0.29 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2yuj h LEU 139 CO -0.01 0.82 -0.90 -0.33 -0.34 0.00 0.00 178.44 177.68 2yuj h GLU 140 N 0.56 0.14 -0.20 1.25 5.08 -0.87 -2.49 114.58 118.04 2yuj h GLU 140 Ca 0.09 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2yuj h GLU 140 Cb 0.65 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2yuj h GLU 140 CO 0.05 0.95 -0.16 -0.91 -1.00 0.00 0.00 179.01 177.93 2yuj h ASN 141 N 0.07 0.33 0.55 1.42 4.21 -0.62 -2.75 115.58 118.79 2yuj h ASN 141 Ca -0.04 -0.08 -0.29 0.00 1.21 0.00 0.00 56.30 57.10 2yuj h ASN 141 Cb 1.55 -0.09 -0.00 0.00 -1.12 0.00 0.00 38.32 38.66 2yuj h ASN 141 CO 0.13 0.52 -1.39 0.00 -1.29 0.00 0.00 177.43 175.40 2yuj h ALA 142 N 1.52 0.20 -0.00 -0.83 0.00 -1.47 -3.29 119.26 115.38 2yuj h ALA 142 Ca 0.06 -1.01 -0.00 0.00 0.00 0.00 0.00 54.91 53.96 2yuj h ALA 142 Cb 0.48 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2yuj h ALA 142 CO 0.03 1.07 -0.01 -0.07 0.00 0.00 0.00 179.25 180.27 2yuj h LEU 143 N 0.07 0.00 -1.95 0.00 3.38 -1.24 -1.28 115.31 114.29 2yuj h LEU 143 Ca -0.19 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.82 2yuj h LEU 143 Cb 1.99 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.73 2yuj h LEU 143 CO 0.18 0.01 0.12 0.03 0.09 0.00 0.00 178.44 178.87 2yuj h ARG 144 N 0.00 0.06 0.10 1.13 3.08 -1.56 -1.73 114.38 115.46 2yuj h ARG 144 Ca -0.00 -0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 2yuj h ARG 144 Cb 0.02 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2yuj h ARG 144 CO 0.00 0.04 -1.41 -0.91 -1.07 0.00 0.00 179.97 176.62 2yuj h ASN 145 N 0.06 0.34 -3.50 7.04 4.21 -1.42 -3.46 115.58 118.84 2yuj h ASN 145 Ca 0.08 -0.43 -0.53 0.00 1.21 0.00 0.00 56.30 56.63 2yuj h ASN 145 Cb 0.23 -0.11 0.06 0.00 -1.12 0.00 0.00 38.32 37.38 2yuj h ASN 145 CO -0.01 1.35 0.72 -0.36 -1.29 0.00 0.00 177.43 177.84 2yuj s PHE 146 N -2.64 3.05 -0.17 1.19 0.08 -0.65 -4.22 117.98 114.61 2yuj s PHE 146 Ca -0.06 1.14 0.18 0.00 0.12 0.00 0.00 56.93 58.31 2yuj s PHE 146 Cb 0.07 -3.76 -0.25 0.00 -0.57 0.00 0.00 43.02 38.50 2yuj s PHE 146 CO 0.86 -2.39 0.16 0.00 -0.10 0.00 0.00 175.22 173.74 2yuj n ALA 147 N 1.99 1.60 -2.18 5.36 0.00 -1.26 -4.77 120.51 121.25 2yuj n ALA 147 Ca 0.05 -1.22 -0.11 0.00 0.00 0.00 0.00 53.44 52.16 2yuj n ALA 147 Cb 0.41 -0.29 -0.10 0.00 0.00 0.00 0.00 19.45 19.47 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 -3.09 2.10 -0.05 0.00 1.43 -0.84 -4.91 118.68 113.33 2yuj s LEU 149 Ca 0.23 -0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 2yuj s LEU 149 Cb 0.07 0.34 0.01 0.00 0.03 0.00 0.00 46.19 46.65 2yuj s LEU 149 CO 0.02 -0.46 0.16 -0.89 0.23 0.00 0.00 176.35 175.41 2yuj s THR 150 N -2.50 0.01 -0.14 5.49 2.01 -1.24 -2.78 115.64 116.49 2yuj s THR 150 Ca -0.06 -0.12 -0.29 0.00 0.31 0.00 0.00 61.69 61.53 2yuj s THR 150 Cb -0.02 -0.28 -0.03 0.00 0.01 0.00 0.00 72.50 72.19 2yuj s THR 150 CO -0.04 -0.07 1.39 -0.89 -0.69 0.00 0.00 174.62 174.32 2yuj s THR 151 N -0.16 4.06 0.00 -0.82 2.01 -1.20 -3.44 115.64 116.09 2yuj s THR 151 Ca -0.03 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.25 2yuj s THR 151 Cb -0.02 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 68.65 2yuj s THR 151 CO 0.00 -0.14 0.00 0.61 -0.69 0.00 0.00 174.62 174.41 2yuj n GLY 152 N 3.83 0.80 2.90 4.40 0.00 -0.77 -5.05 105.19 111.30 2yuj n GLY 152 Ca 0.15 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.28 1.84 -1.13 1.61 1.11 -1.22 -4.98 116.67 111.62 2yuj s ASP 153 Ca 0.00 -0.24 -0.21 0.00 0.18 0.00 0.00 52.55 52.28 2yuj s ASP 153 Cb 0.00 -0.71 0.03 0.00 1.07 0.00 0.00 42.92 43.30 2yuj s ASP 153 CO 0.00 -0.10 1.69 -0.69 1.18 0.00 0.00 175.17 177.25 2yuj s VAL 154 N 1.48 3.88 -0.44 -1.27 1.01 -1.26 -3.28 120.40 120.53 2yuj s VAL 154 Ca -0.00 -1.16 -0.29 0.00 0.00 0.00 0.00 61.98 60.53 2yuj s VAL 154 Cb -0.13 -4.91 0.02 0.00 0.00 0.00 0.00 36.38 31.36 2yuj s VAL 154 CO -0.05 -1.71 1.26 0.27 0.00 0.00 0.00 175.10 174.87 2yuj s ILE 155 N 6.22 4.09 0.23 2.22 -4.36 -0.56 -4.87 121.20 124.16 2yuj s ILE 155 Ca 0.55 1.12 -0.30 0.00 -0.26 0.00 0.00 60.65 61.76 2yuj s ILE 155 Cb 0.00 -4.42 -0.09 0.00 1.25 0.00 0.00 42.46 39.21 2yuj s ILE 155 CO 0.01 -0.87 0.95 0.00 0.24 0.00 0.00 174.94 175.26 2yuj s ALA 156 N 4.83 3.33 0.03 2.27 0.00 -1.26 -3.68 121.76 127.29 2yuj s ALA 156 Ca 0.54 0.63 0.05 0.00 0.00 0.00 0.00 51.96 53.18 2yuj s ALA 156 Cb -0.10 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 2yuj s ALA 156 CO 0.31 0.18 -0.16 0.96 0.00 0.00 0.00 175.76 177.05 2yuj s ILE 157 N -1.08 1.26 0.01 0.00 -4.36 -1.20 -4.87 121.20 110.96 2yuj s ILE 157 Ca 0.42 -0.97 0.01 0.00 -0.26 0.00 0.00 60.65 59.84 2yuj s ILE 157 Cb -0.26 -1.11 -0.01 0.00 1.25 0.00 0.00 42.46 42.34 2yuj s ILE 157 CO 0.32 0.12 -0.03 0.21 0.24 0.00 0.00 174.94 175.80 2yuj s ASN 158 N -0.98 0.30 0.00 4.36 3.84 -1.26 -1.21 114.94 119.99 2yuj s ASN 158 Ca 0.04 -0.17 0.00 0.00 0.21 0.00 0.00 52.86 52.94 2yuj s ASN 158 Cb -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 41.25 40.62 2yuj s ASN 158 CO 0.01 -0.05 0.00 0.00 -2.79 0.00 0.00 177.10 174.27 2yuj n TYR 159 N 2.63 -1.32 -1.25 0.43 4.11 -1.26 -4.96 117.16 115.55 2yuj n TYR 159 Ca -0.15 0.00 -0.28 0.00 -0.00 0.00 0.00 57.90 57.46 2yuj n TYR 159 Cb 0.58 0.26 0.05 0.00 -0.00 0.00 0.00 39.34 40.23 2yuj n TYR 159 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 2yuj n ASN 160 N -2.12 7.16 -2.44 9.48 5.15 -1.26 -4.80 115.26 126.42 2yuj n ASN 160 Ca 0.00 -3.49 -0.19 0.00 -0.60 0.00 0.00 54.58 50.30 2yuj n ASN 160 Cb 0.00 -1.04 -0.01 0.00 -0.53 0.00 0.00 39.78 38.20 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2yuj n GLU 161 N -0.28 -1.95 -3.67 1.20 -0.58 -1.26 -4.96 120.64 109.13 2yuj n GLU 161 Ca 0.49 0.92 -0.12 0.00 -0.42 0.00 0.00 57.16 58.03 2yuj n GLU 161 Cb 0.58 -5.58 -0.12 0.00 -0.57 0.00 0.00 31.44 25.74 2yuj n GLU 161 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2yuj s LYS 162 N -5.08 0.20 -1.03 3.49 1.02 -1.26 -5.09 119.74 111.99 2yuj s LYS 162 Ca 0.02 0.77 -0.22 0.00 0.02 0.00 0.00 55.97 56.55 2yuj s LYS 162 Cb -0.01 0.02 0.06 0.00 -0.52 0.00 0.00 37.83 37.38 2yuj s LYS 162 CO 0.02 -0.25 1.43 0.42 -0.92 0.00 0.00 175.35 176.05 2yuj s ILE 163 N 2.20 4.06 0.96 2.17 1.09 -1.26 -4.20 121.20 126.22 2yuj s ILE 163 Ca -0.02 -0.98 -0.12 0.00 -1.10 0.00 0.00 60.65 58.43 2yuj s ILE 163 Cb -0.11 -5.03 0.17 0.00 -1.06 0.00 0.00 42.46 36.42 2yuj s ILE 163 CO -0.10 -1.88 1.09 -0.31 -0.10 0.00 0.00 174.94 173.64 2yuj s TYR 164 N 4.57 2.05 -0.05 3.97 1.51 -0.35 -4.86 117.35 124.20 2yuj s TYR 164 Ca 0.45 1.24 0.05 0.00 -1.01 0.00 0.00 57.07 57.80 2yuj s TYR 164 Cb -0.00 -3.18 -0.02 0.00 -0.11 0.00 0.00 41.96 38.64 2yuj s TYR 164 CO -0.08 -2.77 -0.20 -1.21 -1.11 0.00 0.00 175.55 170.17 2yuj s GLU 165 N -4.84 2.50 -0.03 -0.62 0.41 -1.26 -3.22 118.70 111.64 2yuj s GLU 165 Ca 0.65 -0.81 -0.17 0.00 -0.41 0.00 0.00 54.97 54.23 2yuj s GLU 165 Cb -0.20 -2.26 0.03 0.00 -1.78 0.00 0.00 34.13 29.93 2yuj s GLU 165 CO 0.58 0.51 0.37 -0.51 -0.49 0.00 0.00 175.26 175.72 2yuj s LEU 166 N -0.45 0.59 -0.03 1.80 1.43 -1.24 -3.57 118.68 117.21 2yuj s LEU 166 Ca 0.05 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.39 2yuj s LEU 166 Cb -0.12 1.47 0.03 0.00 0.03 0.00 0.00 46.19 47.60 2yuj s LEU 166 CO 0.01 -0.45 0.01 -0.60 0.23 0.00 0.00 176.35 175.56 2yuj s ARG 167 N -1.19 0.15 -0.32 1.70 3.52 -1.21 -1.50 118.95 120.10 2yuj s ARG 167 Ca -0.12 0.13 -0.29 0.00 -0.13 0.00 0.00 55.73 55.32 2yuj s ARG 167 Cb -0.04 -0.39 -0.00 0.00 -1.56 0.00 0.00 34.95 32.95 2yuj s ARG 167 CO 0.05 -0.15 1.41 0.08 -0.81 0.00 0.00 175.30 175.88 2yuj s VAL 168 N 1.08 3.96 -0.00 7.11 1.01 -1.20 -1.03 120.40 131.32 2yuj s VAL 168 Ca -0.09 1.05 -0.23 0.00 0.00 0.00 0.00 61.98 62.71 2yuj s VAL 168 Cb -0.13 -4.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.05 2yuj s VAL 168 CO -0.02 -0.53 0.94 0.24 0.00 0.00 0.00 175.10 175.73 2yuj h MET 169 N 10.14 -0.79 -4.09 2.72 2.86 -0.88 -2.05 114.93 122.84 2yuj h MET 169 Ca -0.28 0.05 -0.14 0.00 -2.06 0.00 0.00 59.70 57.27 2yuj h MET 169 Cb 1.11 0.18 -0.13 0.00 0.06 0.00 0.00 31.60 32.82 2yuj h MET 169 CO 1.04 -0.52 -0.43 -2.00 1.06 0.00 0.00 176.91 176.06 2yuj s GLU 170 N -4.22 1.12 0.14 1.72 2.12 -0.79 -4.56 118.70 114.23 2yuj s GLU 170 Ca -0.12 -1.30 -0.17 0.00 0.36 0.00 0.00 54.97 53.74 2yuj s GLU 170 Cb 0.01 0.33 0.04 0.00 0.26 0.00 0.00 34.13 34.77 2yuj s GLU 170 CO 0.36 -0.39 0.44 0.95 -0.54 0.00 0.00 175.26 176.09 2yuj s THR 171 N -4.01 0.05 0.05 -1.70 -4.23 -1.26 0.76 115.64 105.31 2yuj s THR 171 Ca 0.22 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 2yuj s THR 171 Cb 0.05 -1.25 -0.03 0.00 1.34 0.00 0.00 72.50 72.60 2yuj s THR 171 CO 0.02 -0.24 -0.04 -0.54 -0.54 0.00 0.00 174.62 173.27 2yuj s LYS 172 N -3.82 0.59 0.43 3.99 1.02 0.86 -4.20 119.74 118.62 2yuj s LYS 172 Ca 0.04 -1.07 0.28 0.00 0.02 0.00 0.00 55.97 55.24 2yuj s LYS 172 Cb 0.01 0.03 0.93 0.00 -0.52 0.00 0.00 37.83 38.29 2yuj s LYS 172 CO -0.10 -0.06 1.80 -1.00 -0.92 0.00 0.00 175.35 175.08 2yuj h PRO 173 N 3.57 0.00 -4.94 -1.68 0.13 -1.87 -3.24 132.00 123.96 2yuj h PRO 173 Ca -0.34 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.42 2yuj h PRO 173 Cb 1.17 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.15 2yuj h PRO 173 CO 0.58 0.00 -0.61 0.34 -0.23 0.00 0.00 178.00 178.07 2yuj s ASP 174 N -5.47 1.39 0.21 1.44 -1.08 -1.26 -5.05 116.67 106.86 2yuj s ASP 174 Ca 0.05 -1.38 -0.09 0.00 -0.52 0.00 0.00 52.55 50.61 2yuj s ASP 174 Cb 0.08 0.12 0.25 0.00 -1.46 0.00 0.00 42.92 41.91 2yuj s ASP 174 CO 0.56 -0.71 1.82 0.07 0.52 0.00 0.00 175.17 177.44 2yuj h LYS 175 N 2.34 0.74 -5.05 4.34 2.10 -1.93 -3.39 116.57 115.73 2yuj h LYS 175 Ca -0.39 -0.04 -0.64 0.00 -2.00 0.00 0.00 60.65 57.57 2yuj h LYS 175 Cb 1.25 -0.17 -0.16 0.00 -0.90 0.00 0.00 32.23 32.25 2yuj h LYS 175 CO 0.62 0.49 -0.27 0.00 -2.00 0.00 0.00 179.45 178.29 2yuj s ALA 176 N -6.09 3.53 0.03 0.07 0.00 -1.26 -3.25 121.76 114.78 2yuj s ALA 176 Ca -0.13 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2yuj s ALA 176 Cb 0.16 -2.76 -0.02 0.00 0.00 0.00 0.00 23.12 20.50 2yuj s ALA 176 CO 0.77 -0.86 -0.04 0.14 0.00 0.00 0.00 175.76 175.77 2yuj s VAL 177 N 2.04 0.17 -0.69 0.00 -7.23 -1.12 -4.73 120.40 108.85 2yuj s VAL 177 Ca 0.13 -1.03 -0.09 0.00 -1.81 0.00 0.00 61.98 59.17 2yuj s VAL 177 Cb -0.16 -0.44 0.18 0.00 0.56 0.00 0.00 36.38 36.51 2yuj s VAL 177 CO 0.11 -0.55 0.58 -0.55 -0.31 0.00 0.00 175.10 174.38 2yuj s SER 178 N -1.65 6.03 -1.14 4.85 0.15 0.05 -1.98 113.70 120.02 2yuj s SER 178 Ca -0.13 -2.60 -0.16 0.00 0.70 0.00 0.00 55.95 53.76 2yuj s SER 178 Cb -0.08 -2.05 0.14 0.00 -1.71 0.00 0.00 66.02 62.32 2yuj s SER 178 CO -0.02 -0.53 1.40 0.27 1.20 0.00 0.00 173.24 175.56 2yuj s ILE 179 N 0.32 4.74 -0.49 6.45 -4.36 -0.98 -3.12 121.20 123.76 2yuj s ILE 179 Ca 0.15 -2.12 -0.03 0.00 -0.26 0.00 0.00 60.65 58.39 2yuj s ILE 179 Cb -0.17 -4.93 0.13 0.00 1.25 0.00 0.00 42.46 38.74 2yuj s ILE 179 CO -0.05 -1.68 0.29 -0.63 0.24 0.00 0.00 174.94 173.11 2yuj s ILE 180 N 2.50 3.44 -0.38 8.37 1.01 -1.26 -4.56 121.20 130.33 2yuj s ILE 180 Ca 0.42 -2.39 -0.12 0.00 0.00 0.00 0.00 60.65 58.57 2yuj s ILE 180 Cb -0.02 -3.32 0.01 0.00 0.01 0.00 0.00 42.46 39.15 2yuj s ILE 180 CO -0.02 -0.76 0.45 -0.62 0.00 0.00 0.00 174.94 173.99 2yuj n GLU 181 N 4.19 -2.42 -3.58 2.79 1.02 -1.26 -5.07 120.64 116.31 2yuj n GLU 181 Ca 0.01 2.13 -0.10 0.00 -0.02 0.00 0.00 57.16 59.19 2yuj n GLU 181 Cb 0.40 -5.32 -0.05 0.00 -0.02 0.00 0.00 31.44 26.44 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yuj s ASP 183 N -1.03 6.46 0.05 0.00 1.11 -1.26 -5.07 116.67 116.93 2yuj s ASP 183 Ca -0.01 0.53 0.04 0.00 0.18 0.00 0.00 52.55 53.29 2yuj s ASP 183 Cb -0.01 -2.21 -0.03 0.00 1.07 0.00 0.00 42.92 41.74 2yuj s ASP 183 CO 0.00 0.01 -0.11 0.00 1.18 0.00 0.00 175.17 176.25 2yuj s MET 184 N 0.87 0.70 -1.06 8.23 0.23 -1.26 -4.89 119.30 122.11 2yuj s MET 184 Ca 0.18 -0.84 -0.22 0.00 -1.03 0.00 0.00 55.69 53.78 2yuj s MET 184 Cb -0.14 -0.60 0.03 0.00 -1.53 0.00 0.00 34.83 32.59 2yuj s MET 184 CO 0.06 0.13 1.60 1.21 -2.03 0.00 0.00 175.02 175.99 2yuj s ASN 185 N -1.59 6.29 0.21 -1.18 2.47 0.18 -4.97 114.94 116.36 2yuj s ASN 185 Ca -0.05 -1.52 -0.30 0.00 0.42 0.00 0.00 52.86 51.42 2yuj s ASN 185 Cb -0.10 -2.57 -0.08 0.00 -1.45 0.00 0.00 41.25 37.05 2yuj s ASN 185 CO 0.01 -1.70 1.14 -0.69 -3.72 0.00 0.00 177.10 172.14 2yuj s VAL 186 N 5.87 3.62 0.47 -5.21 1.01 -1.26 -3.70 120.40 121.21 2yuj s VAL 186 Ca 0.52 1.46 0.05 0.00 0.00 0.00 0.00 61.98 64.01 2yuj s VAL 186 Cb -0.00 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2yuj s VAL 186 CO -0.05 0.28 0.20 -1.81 0.00 0.00 0.00 175.10 173.72 2yuj s ASP 187 N -0.27 4.41 0.04 3.32 1.11 -0.42 -4.97 116.67 119.89 2yuj s ASP 187 Ca 0.49 -1.25 -0.00 0.00 0.18 0.00 0.00 52.55 51.97 2yuj s ASP 187 Cb -0.31 -0.02 -0.03 0.00 1.07 0.00 0.00 42.92 43.62 2yuj s ASP 187 CO 0.38 -0.76 -0.04 -0.36 1.18 0.00 0.00 175.17 175.57 2yuj s PHE 188 N -2.71 0.46 -0.37 4.23 0.40 -1.26 -3.09 117.98 115.64 2yuj s PHE 188 Ca 0.32 -0.81 0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2yuj s PHE 188 Cb 0.02 -0.32 0.16 0.00 0.51 0.00 0.00 43.02 43.39 2yuj s PHE 188 CO 0.18 -0.27 0.43 0.34 0.70 0.00 0.00 175.22 176.60 2yuj s ASP 189 N -2.28 0.61 0.00 1.36 -1.08 -1.10 -4.92 116.67 109.26 2yuj s ASP 189 Ca -0.03 -1.35 0.19 0.00 -0.52 0.00 0.00 52.55 50.84 2yuj s ASP 189 Cb -0.00 0.86 0.15 0.00 -1.46 0.00 0.00 42.92 42.47 2yuj s ASP 189 CO -0.05 -0.25 1.10 0.00 0.52 0.00 0.00 175.17 176.48