#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ddj h LEU -4 N 0.00 0.21 -1.39 1.20 3.38 -1.97 -2.87 115.31 113.87 3ddj h LEU -4 Ca 0.00 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 3ddj h LEU -4 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3ddj h LEU -4 CO 0.00 0.93 -0.13 1.88 0.09 0.00 0.00 178.44 181.21 3ddj h TYR -3 N 0.10 0.25 0.00 1.13 0.05 -1.95 -1.81 116.97 114.74 3ddj h TYR -3 Ca -0.03 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.72 3ddj h TYR -3 Cb 1.41 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 39.08 3ddj h TYR -3 CO 0.02 0.38 -0.10 1.19 -1.05 0.00 0.00 178.16 178.60 3ddj n PHE -2 N -4.27 0.02 0.77 4.88 3.72 -1.19 -3.89 117.46 117.50 3ddj n PHE -2 Ca -0.01 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 3ddj n PHE -2 Cb 0.27 -0.46 0.14 0.00 -0.94 0.00 0.00 39.48 38.49 3ddj n PHE -2 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ddj n GLN -1 N -1.51 2.39 0.00 -1.08 6.02 -0.69 -5.03 117.38 117.47 3ddj n GLN -1 Ca 0.07 -2.05 0.00 0.00 -0.01 0.00 0.00 57.00 55.01 3ddj n GLN -1 Cb 0.34 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.12 3ddj n GLN -1 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ddj n GLY 0 N 1.40 -1.74 3.32 1.08 0.00 -1.17 -5.06 105.19 103.02 3ddj n GLY 0 Ca 0.16 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 3ddj n GLY 0 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ddj s ASN 2 N -2.49 -0.87 0.53 1.61 2.20 -1.26 -4.93 114.94 109.73 3ddj s ASN 2 Ca 0.00 0.91 0.35 0.00 -0.94 0.00 0.00 52.86 53.18 3ddj s ASN 2 Cb 0.00 -1.30 1.90 0.00 -2.00 0.00 0.00 41.25 39.85 3ddj s ASN 2 CO 0.00 -5.25 2.08 -0.29 -2.94 0.00 0.00 177.10 170.70 3ddj h ILE 3 N -3.35 0.00 -0.10 0.54 6.09 -0.53 -1.99 117.51 118.18 3ddj h ILE 3 Ca -0.45 -0.02 0.03 0.00 -1.37 0.00 0.00 64.86 63.04 3ddj h ILE 3 Cb 1.34 0.83 -0.00 0.00 0.47 0.00 0.00 36.82 39.45 3ddj h ILE 3 CO 0.30 0.00 0.10 -0.33 -3.07 0.00 0.00 178.15 175.15 3ddj h GLU 4 N 0.00 0.00 -0.94 2.19 5.08 -1.84 -1.01 114.58 118.06 3ddj h GLU 4 Ca 0.00 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.57 3ddj h GLU 4 Cb 0.03 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.20 3ddj h GLU 4 CO 0.00 0.00 0.61 1.15 -1.00 0.00 0.00 179.01 179.77 3ddj h THR 5 N 0.00 0.67 -0.39 1.13 2.02 -1.73 -3.48 112.91 111.14 3ddj h THR 5 Ca 0.05 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3ddj h THR 5 Cb 0.25 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3ddj h THR 5 CO -0.00 0.09 0.00 0.18 0.37 0.00 0.00 175.52 176.16 3ddj n LEU 6 N -4.57 4.50 -4.05 2.58 4.77 -0.38 -5.15 117.00 114.69 3ddj n LEU 6 Ca 0.21 -2.91 -0.29 0.00 -0.03 0.00 0.00 56.01 52.98 3ddj n LEU 6 Cb 0.69 -0.58 -0.17 0.00 -2.33 0.00 0.00 43.42 41.04 3ddj n LEU 6 CO 0.28 0.67 -0.49 -0.63 -1.33 0.00 0.00 177.39 175.89 3ddj s ILE 8 N -2.67 1.52 0.53 -0.08 1.01 0.52 -4.87 121.20 117.15 3ddj s ILE 8 Ca 0.46 -0.64 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 3ddj s ILE 8 Cb 0.36 -1.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 3ddj s ILE 8 CO 0.12 0.45 0.84 -0.54 0.00 0.00 0.00 174.94 175.81 3ddj s LYS 9 N 1.11 3.32 -1.45 2.79 1.02 -1.26 -1.60 119.74 123.67 3ddj s LYS 9 Ca -0.04 0.16 -0.06 0.00 0.02 0.00 0.00 55.97 56.05 3ddj s LYS 9 Cb -0.14 -2.32 0.05 0.00 -0.52 0.00 0.00 37.83 34.89 3ddj s LYS 9 CO -0.04 -0.41 0.72 0.09 -0.92 0.00 0.00 175.35 174.79 3ddj n ASN 10 N -2.41 -2.25 -4.77 2.83 3.02 -1.26 -4.95 115.26 105.47 3ddj n ASN 10 Ca 0.02 -0.88 -0.31 0.00 -0.03 0.00 0.00 54.58 53.38 3ddj n ASN 10 Cb 0.56 -3.57 0.09 0.00 -0.61 0.00 0.00 39.78 36.25 3ddj n ASN 10 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3ddj s PRO 11 N -6.44 2.24 0.21 3.52 0.04 -1.26 -4.94 135.00 128.38 3ddj s PRO 11 Ca 0.29 1.03 -0.31 0.00 0.04 0.00 0.00 61.00 62.05 3ddj s PRO 11 Cb -0.15 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 3ddj s PRO 11 CO 0.85 -1.62 1.59 -1.25 0.04 0.00 0.00 177.00 176.62 3ddj s PRO 12 N -4.96 4.18 -0.02 0.56 0.04 -1.26 -4.94 135.00 128.61 3ddj s PRO 12 Ca 0.61 2.45 0.04 0.00 0.04 0.00 0.00 61.00 64.14 3ddj s PRO 12 Cb -0.16 -3.10 -0.01 0.00 0.04 0.00 0.00 34.50 31.27 3ddj s PRO 12 CO 0.56 -0.62 -0.14 0.42 0.04 0.00 0.00 177.00 177.26 3ddj s ILE 13 N 0.76 1.12 0.20 0.56 1.01 -1.26 -1.61 121.20 121.97 3ddj s ILE 13 Ca 0.68 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.78 3ddj s ILE 13 Cb -0.46 -0.94 -0.05 0.00 0.01 0.00 0.00 42.46 41.02 3ddj s ILE 13 CO 0.36 0.32 -0.02 -0.76 0.00 0.00 0.00 174.94 174.84 3ddj s LEU 14 N -0.22 2.24 0.44 2.97 1.43 -0.57 -4.96 118.68 120.01 3ddj s LEU 14 Ca 0.03 -1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 51.95 3ddj s LEU 14 Cb -0.07 -0.22 -0.02 0.00 0.03 0.00 0.00 46.19 45.91 3ddj s LEU 14 CO -0.00 -0.49 0.69 -0.94 0.23 0.00 0.00 176.35 175.84 3ddj s SER 15 N -3.24 6.08 0.56 2.29 1.04 -1.25 -1.12 113.70 118.07 3ddj s SER 15 Ca 0.25 0.58 0.31 0.00 0.48 0.00 0.00 55.95 57.56 3ddj s SER 15 Cb 0.05 -1.93 1.67 0.00 0.10 0.00 0.00 66.02 65.92 3ddj s SER 15 CO 0.06 -0.57 2.15 0.07 0.98 0.00 0.00 173.24 175.93 3ddj h LYS 16 N 0.39 0.00 0.00 4.02 2.10 -1.92 -1.82 116.57 119.35 3ddj h LYS 16 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 3ddj h LYS 16 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 3ddj h LYS 16 CO 0.60 0.07 -0.05 0.39 -2.00 0.00 0.00 179.45 178.45 3ddj n GLU 17 N -3.58 0.08 -1.16 0.07 4.71 -1.26 -3.99 120.64 115.52 3ddj n GLU 17 Ca -0.02 0.06 -0.30 0.00 -0.01 0.00 0.00 57.16 56.89 3ddj n GLU 17 Cb 0.18 -1.59 0.12 0.00 -1.01 0.00 0.00 31.44 29.14 3ddj n GLU 17 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3ddj s ASP 18 N -3.45 3.82 0.25 1.62 1.01 -0.68 -4.84 116.67 114.39 3ddj s ASP 18 Ca 0.13 1.72 0.08 0.00 0.71 0.00 0.00 52.55 55.18 3ddj s ASP 18 Cb 0.17 -2.38 -0.04 0.00 1.01 0.00 0.00 42.92 41.68 3ddj s ASP 18 CO 0.57 -2.45 0.10 -0.13 0.21 0.00 0.00 175.17 173.47 3ddj s ARG 19 N -4.88 2.65 0.48 8.23 1.81 -1.26 -1.05 118.95 124.93 3ddj s ARG 19 Ca 0.63 -1.18 0.14 0.00 -1.72 0.00 0.00 55.73 53.59 3ddj s ARG 19 Cb -0.18 -2.40 1.14 0.00 -0.45 0.00 0.00 34.95 33.05 3ddj s ARG 19 CO 0.57 0.40 2.11 -0.07 -0.68 0.00 0.00 175.30 177.63 3ddj h LEU 20 N 1.79 0.12 -0.70 2.53 3.38 -0.60 -2.37 115.31 119.46 3ddj h LEU 20 Ca -0.47 -0.01 0.15 0.00 0.09 0.00 0.00 57.88 57.65 3ddj h LEU 20 Cb 1.24 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.84 3ddj h LEU 20 CO 0.60 0.11 0.08 1.23 0.09 0.00 0.00 178.44 180.55 3ddj h GLY 21 N 0.19 0.87 1.24 0.83 0.00 -0.98 0.97 103.07 106.20 3ddj h GLY 21 Ca 0.04 0.04 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 3ddj h GLY 21 CO -0.01 -0.23 0.24 1.76 0.00 0.00 0.00 176.54 178.31 3ddj h SER 22 N 0.18 0.88 -0.47 0.19 0.02 -1.69 -2.95 113.55 109.72 3ddj h SER 22 Ca 0.39 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 61.14 3ddj h SER 22 Cb 0.66 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 3ddj h SER 22 CO -0.56 0.81 0.05 0.00 -1.14 0.00 0.00 176.83 175.99 3ddj h ALA 23 N 1.32 0.63 -0.56 3.77 0.00 -1.03 -2.62 119.26 120.77 3ddj h ALA 23 Ca 0.22 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3ddj h ALA 23 Cb 0.21 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3ddj h ALA 23 CO -0.02 0.38 0.37 0.74 0.00 0.00 0.00 179.25 180.73 3ddj h PHE 24 N 0.66 0.58 -0.16 0.00 0.04 -0.72 0.01 116.94 117.35 3ddj h PHE 24 Ca 0.14 0.01 -0.17 0.00 2.80 0.00 0.00 57.97 60.75 3ddj h PHE 24 Cb 0.43 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 3ddj h PHE 24 CO 0.03 0.33 -0.62 0.87 -0.60 0.00 0.00 178.31 178.32 3ddj h LYS 25 N 0.59 0.55 -0.00 1.51 1.57 -1.39 -3.34 116.57 116.06 3ddj h LYS 25 Ca 0.23 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3ddj h LYS 25 Cb 0.18 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3ddj h LYS 25 CO -0.06 0.99 -0.67 1.63 -0.57 0.00 0.00 179.45 180.77 3ddj n LYS 26 N -3.93 0.17 0.09 3.15 5.02 -0.81 -4.62 118.16 117.24 3ddj n LYS 26 Ca -0.04 -0.12 0.05 0.00 -2.02 0.00 0.00 58.31 56.17 3ddj n LYS 26 Cb 0.64 -1.50 0.48 0.00 -0.02 0.00 0.00 35.03 34.63 3ddj n LYS 26 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 3ddj h ILE 27 N 0.30 1.09 -0.73 -0.18 6.09 -1.14 -1.69 117.51 121.25 3ddj h ILE 27 Ca 0.00 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 3ddj h ILE 27 Cb 0.52 0.75 0.00 0.00 0.47 0.00 0.00 36.82 38.57 3ddj h ILE 27 CO 0.00 0.10 0.00 0.59 -3.07 0.00 0.00 178.15 175.77 3ddj n ASN 28 N -4.46 4.04 -4.69 2.19 5.03 -1.26 -2.57 115.26 113.53 3ddj n ASN 28 Ca 0.01 -2.04 -0.45 0.00 0.87 0.00 0.00 54.58 52.97 3ddj n ASN 28 Cb 0.10 -0.50 -0.04 0.00 -1.02 0.00 0.00 39.78 38.33 3ddj n ASN 28 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 3ddj n GLU 29 N 1.60 2.39 -0.92 3.52 2.13 -0.64 -0.97 120.64 127.75 3ddj n GLU 29 Ca 0.25 0.87 0.00 0.00 0.66 0.00 0.00 57.16 58.93 3ddj n GLU 29 Cb 0.65 -2.67 0.00 0.00 0.27 0.00 0.00 31.44 29.68 3ddj n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ddj n GLY 30 N 3.73 0.16 2.43 8.31 0.00 -1.26 -2.61 105.19 115.94 3ddj n GLY 30 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 3ddj n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ddj n GLY 31 N -0.48 0.62 0.11 -0.02 0.00 -0.14 -4.92 105.19 100.36 3ddj n GLY 31 Ca 0.00 -0.14 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 3ddj n GLY 31 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3ddj h ILE 32 N 0.00 1.53 0.00 -0.61 2.04 -1.68 -3.48 117.51 115.31 3ddj h ILE 32 Ca -0.40 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.21 3ddj h ILE 32 Cb 1.25 2.95 0.00 0.00 -0.74 0.00 0.00 36.82 40.29 3ddj h ILE 32 CO 0.52 0.63 0.00 0.61 0.00 0.00 0.00 178.15 179.91 3ddj n GLY 33 N 1.34 0.62 3.05 5.37 0.00 -1.06 -5.02 105.19 109.49 3ddj n GLY 33 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 3ddj n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ddj s ARG 34 N -0.07 0.41 -0.15 1.61 3.00 -1.24 -2.03 118.95 120.48 3ddj s ARG 34 Ca 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 55.73 55.27 3ddj s ARG 34 Cb 0.00 0.16 0.01 0.00 0.00 0.00 0.00 34.95 35.13 3ddj s ARG 34 CO 0.00 -0.09 -0.21 0.42 0.00 0.00 0.00 175.30 175.42 3ddj s ILE 35 N -1.41 2.04 0.11 1.52 1.01 0.23 -4.61 121.20 120.08 3ddj s ILE 35 Ca -0.15 -0.96 -0.30 0.00 0.00 0.00 0.00 60.65 59.24 3ddj s ILE 35 Cb -0.09 -1.81 -0.06 0.00 0.01 0.00 0.00 42.46 40.51 3ddj s ILE 35 CO 0.01 0.54 1.14 -0.63 0.00 0.00 0.00 174.94 176.00 3ddj s ILE 36 N 0.92 4.02 -0.25 2.92 1.01 -0.63 -0.78 121.20 128.41 3ddj s ILE 36 Ca -0.04 1.57 -0.08 0.00 0.00 0.00 0.00 60.65 62.10 3ddj s ILE 36 Cb -0.15 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 3ddj s ILE 36 CO -0.04 0.19 0.09 -0.69 0.00 0.00 0.00 174.94 174.49 3ddj s VAL 37 N 0.44 4.51 0.08 2.92 1.01 0.04 -1.51 120.40 127.89 3ddj s VAL 37 Ca 0.54 -0.11 -0.21 0.00 0.00 0.00 0.00 61.98 62.20 3ddj s VAL 37 Cb -0.29 -3.11 0.05 0.00 0.00 0.00 0.00 36.38 33.03 3ddj s VAL 37 CO 0.32 0.34 0.50 0.00 0.00 0.00 0.00 175.10 176.25 3ddj s ALA 38 N 1.51 -1.26 0.00 5.51 0.00 -0.28 -0.28 121.76 126.97 3ddj s ALA 38 Ca 0.06 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.44 3ddj s ALA 38 Cb -0.15 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.49 3ddj s ALA 38 CO 0.05 -0.57 0.00 0.09 0.00 0.00 0.00 175.76 175.33 3ddj n ASN 39 N 0.16 0.00 -0.06 0.00 4.13 -1.26 -3.88 115.26 114.35 3ddj n ASN 39 Ca -0.18 0.00 -0.13 0.00 1.68 0.00 0.00 54.58 55.95 3ddj n ASN 39 Cb 0.62 0.00 -0.12 0.00 -1.54 0.00 0.00 39.78 38.74 3ddj n ASN 39 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 3ddj h GLU 40 N 0.00 -0.01 -6.17 3.52 -0.00 -1.99 -3.47 114.58 106.46 3ddj h GLU 40 Ca 0.00 0.00 -0.59 0.00 -0.00 0.00 0.00 59.36 58.77 3ddj h GLU 40 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 28.68 3ddj h GLU 40 CO 0.00 0.85 -0.56 0.15 -0.00 0.00 0.00 179.01 179.44 3ddj s LYS 41 N -2.60 2.96 0.30 1.06 1.02 -1.26 -4.32 119.74 116.90 3ddj s LYS 41 Ca -0.18 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 54.73 3ddj s LYS 41 Cb -0.02 -2.71 -0.11 0.00 -0.52 0.00 0.00 37.83 34.47 3ddj s LYS 41 CO 0.65 0.51 1.58 -1.50 -0.92 0.00 0.00 175.35 175.67 3ddj s ILE 42 N -1.64 2.09 -0.00 2.17 2.07 -0.44 -4.46 121.20 120.99 3ddj s ILE 42 Ca 0.31 0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.64 3ddj s ILE 42 Cb -0.11 -3.05 -0.01 0.00 0.13 0.00 0.00 42.46 39.42 3ddj s ILE 42 CO 0.24 0.01 0.01 -0.62 -1.91 0.00 0.00 174.94 172.67 3ddj n GLU 43 N 2.00 1.70 -3.74 3.50 1.02 0.62 -4.96 120.64 120.78 3ddj n GLU 43 Ca 0.07 -0.01 -0.02 0.00 -0.02 0.00 0.00 57.16 57.19 3ddj n GLU 43 Cb 0.38 -1.02 -0.01 0.00 -0.02 0.00 0.00 31.44 30.77 3ddj n GLU 43 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3ddj s GLY 44 N -2.56 -0.23 -0.06 0.62 0.00 -0.86 -2.54 107.32 101.70 3ddj s GLY 44 Ca -0.00 0.21 -0.00 0.00 0.00 0.00 0.00 44.72 44.93 3ddj s GLY 44 CO 0.04 0.56 -0.02 -2.27 0.00 0.00 0.00 173.10 171.41 3ddj s LEU 45 N -3.05 0.96 -0.36 0.66 2.96 0.35 -0.78 118.68 119.42 3ddj s LEU 45 Ca 0.15 -0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.88 3ddj s LEU 45 Cb 0.00 -0.42 0.04 0.00 0.50 0.00 0.00 46.19 46.31 3ddj s LEU 45 CO 0.01 -0.13 0.15 -0.22 -1.32 0.00 0.00 176.35 174.84 3ddj s LEU 46 N 1.43 4.52 0.47 -0.68 2.96 0.04 -0.27 118.68 127.15 3ddj s LEU 46 Ca -0.03 -1.14 0.02 0.00 -0.22 0.00 0.00 54.13 52.76 3ddj s LEU 46 Cb -0.13 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.64 3ddj s LEU 46 CO -0.03 -0.36 0.68 0.42 -1.32 0.00 0.00 176.35 175.73 3ddj s THR 47 N 1.45 3.52 0.20 3.68 -4.23 -1.26 -0.60 115.64 118.40 3ddj s THR 47 Ca -0.00 -0.63 -0.10 0.00 -1.18 0.00 0.00 61.69 59.77 3ddj s THR 47 Cb -0.20 -3.29 0.13 0.00 1.34 0.00 0.00 72.50 70.48 3ddj s THR 47 CO 0.04 -0.19 1.83 0.74 -0.54 0.00 0.00 174.62 176.50 3ddj h THR 48 N 0.36 1.04 -0.55 3.99 2.02 -1.80 -1.76 112.91 116.21 3ddj h THR 48 Ca -0.44 -0.26 0.07 0.00 0.77 0.00 0.00 66.41 66.55 3ddj h THR 48 Cb 1.27 0.22 -0.06 0.00 -1.74 0.00 0.00 68.15 67.84 3ddj h THR 48 CO 0.54 0.14 0.23 0.03 0.37 0.00 0.00 175.52 176.84 3ddj h ARG 49 N 0.76 0.43 -0.47 6.66 3.08 -1.95 0.03 114.38 122.92 3ddj h ARG 49 Ca 0.28 -0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.38 3ddj h ARG 49 Cb 0.08 -0.10 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 3ddj h ARG 49 CO -0.13 0.28 0.05 -0.44 -1.07 0.00 0.00 179.97 178.66 3ddj h ASP 50 N 0.44 -0.08 -0.23 7.04 3.32 -1.72 0.41 116.42 125.60 3ddj h ASP 50 Ca 0.26 0.10 -0.19 0.00 0.02 0.00 0.00 57.03 57.22 3ddj h ASP 50 Cb 0.26 0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3ddj h ASP 50 CO -0.24 -0.01 -0.58 -0.07 -1.72 0.00 0.00 179.24 176.62 3ddj h LEU 51 N 0.18 0.94 -1.53 1.55 3.38 -0.88 -2.93 115.31 116.01 3ddj h LEU 51 Ca 0.23 -0.52 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 3ddj h LEU 51 Cb 0.33 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3ddj h LEU 51 CO -0.34 1.31 -0.24 -0.07 0.09 0.00 0.00 178.44 179.18 3ddj h LEU 52 N 0.63 0.00 -1.70 1.67 3.38 -0.55 -2.56 115.31 116.18 3ddj h LEU 52 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ddj h LEU 52 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3ddj h LEU 52 CO 0.13 0.24 0.00 0.77 0.09 0.00 0.00 178.44 179.67 3ddj h SER 53 N 0.00 0.00 -0.45 -0.43 4.64 -0.73 -3.06 113.55 113.51 3ddj h SER 53 Ca -0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 3ddj h SER 53 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3ddj h SER 53 CO 0.03 0.00 0.31 0.71 -0.87 0.00 0.00 176.83 177.01 3ddj h THR 54 N 0.00 0.88 -0.54 2.95 1.35 -1.52 -1.21 112.91 114.83 3ddj h THR 54 Ca 0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 3ddj h THR 54 Cb 0.13 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.19 3ddj h THR 54 CO 0.00 0.04 0.00 1.33 -0.25 0.00 0.00 175.52 176.64 3ddj n VAL 55 N -4.46 2.45 -0.12 6.82 0.24 -1.16 -4.60 118.33 117.50 3ddj n VAL 55 Ca 0.07 -1.43 -0.02 0.00 -2.04 0.00 0.00 64.34 60.92 3ddj n VAL 55 Cb 0.37 -0.16 0.22 0.00 -1.47 0.00 0.00 33.84 32.80 3ddj n VAL 55 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3ddj h GLU 56 N 3.62 0.81 -0.92 7.34 4.39 -1.38 -2.25 114.58 126.19 3ddj h GLU 56 Ca 0.00 -0.14 -0.57 0.00 0.34 0.00 0.00 59.36 58.98 3ddj h GLU 56 Cb 1.75 -0.13 -0.29 0.00 -0.10 0.00 0.00 28.75 29.98 3ddj h GLU 56 CO 0.38 0.70 0.58 -1.13 -1.16 0.00 0.00 179.01 178.38 3ddj n SER 57 N -4.31 5.76 -4.34 1.42 3.41 -1.26 -4.96 113.62 109.34 3ddj n SER 57 Ca 0.04 -3.73 -0.18 0.00 -0.26 0.00 0.00 58.87 54.74 3ddj n SER 57 Cb 0.19 -0.85 -0.10 0.00 -0.26 0.00 0.00 64.21 63.19 3ddj n SER 57 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3ddj s TYR 58 N -3.59 1.64 0.00 7.33 2.02 -0.85 -5.03 117.35 118.87 3ddj s TYR 58 Ca 0.60 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 3ddj s TYR 58 Cb 0.48 -0.86 0.00 0.00 -0.40 0.00 0.00 41.96 41.18 3ddj s TYR 58 CO 0.03 0.19 0.00 0.00 -1.57 0.00 0.00 175.55 174.20 3ddj s SER 64 N 0.00 4.84 0.21 0.00 1.04 -1.26 -4.74 113.70 113.79 3ddj s SER 64 Ca 0.00 0.10 -0.09 0.00 0.48 0.00 0.00 55.95 56.44 3ddj s SER 64 Cb 0.00 -0.77 0.28 0.00 0.10 0.00 0.00 66.02 65.63 3ddj s SER 64 CO 0.00 -1.51 1.76 1.56 0.98 0.00 0.00 173.24 176.03 3ddj h GLN 65 N -0.36 0.48 -0.79 4.02 4.20 -2.00 -2.15 115.11 118.51 3ddj h GLN 65 Ca -0.42 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.25 3ddj h GLN 65 Cb 1.30 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.93 3ddj h GLN 65 CO 0.52 0.32 0.44 0.78 -0.67 0.00 0.00 178.83 180.22 3ddj h GLY 66 N 0.49 1.17 0.99 3.46 0.00 -1.94 -1.06 103.07 106.18 3ddj h GLY 66 Ca 0.31 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 3ddj h GLY 66 CO -0.27 0.50 0.24 -0.55 0.00 0.00 0.00 176.54 176.46 3ddj h ASP 67 N 1.09 0.46 -0.61 0.19 3.32 -1.87 -0.00 116.42 119.00 3ddj h ASP 67 Ca 0.28 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 3ddj h ASP 67 Cb 0.02 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 3ddj h ASP 67 CO -0.05 0.37 0.17 -0.07 -1.72 0.00 0.00 179.24 177.94 3ddj h LEU 68 N 0.52 0.93 -0.49 1.55 3.38 -1.20 -1.51 115.31 118.49 3ddj h LEU 68 Ca 0.14 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3ddj h LEU 68 Cb -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3ddj h LEU 68 CO -0.03 0.89 0.26 0.22 0.09 0.00 0.00 178.44 179.88 3ddj h TYR 69 N 0.95 0.69 -0.51 1.13 3.20 -0.84 -1.12 116.97 120.47 3ddj h TYR 69 Ca 0.21 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 3ddj h TYR 69 Cb 0.32 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3ddj h TYR 69 CO 0.02 0.52 0.12 0.45 -1.64 0.00 0.00 178.16 177.63 3ddj h HIS 70 N 0.66 0.80 -0.17 -3.82 3.86 -0.74 -1.26 115.15 114.48 3ddj h HIS 70 Ca 0.17 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.33 3ddj h HIS 70 Cb 0.06 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 3ddj h HIS 70 CO -0.02 0.68 0.06 0.82 0.86 0.00 0.00 177.93 180.33 3ddj h ILE 71 N 0.75 0.97 -0.85 2.45 2.04 -1.09 -2.08 117.51 119.70 3ddj h ILE 71 Ca 0.17 -0.05 0.10 0.00 1.00 0.00 0.00 64.86 66.07 3ddj h ILE 71 Cb 0.28 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 37.10 3ddj h ILE 71 CO -0.00 0.03 0.55 0.77 0.00 0.00 0.00 178.15 179.50 3ddj h SER 72 N 0.15 0.73 -0.30 1.72 4.64 -0.33 -1.44 113.55 118.73 3ddj h SER 72 Ca 0.07 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3ddj h SER 72 Cb 0.04 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3ddj h SER 72 CO -0.07 0.43 0.00 0.35 -0.87 0.00 0.00 176.83 176.67 3ddj n THR 73 N -4.52 0.38 -2.28 2.95 -2.24 -0.56 -0.48 114.28 107.53 3ddj n THR 73 Ca 0.14 -0.61 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 3ddj n THR 73 Cb 0.32 0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 3ddj n THR 73 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3ddj s THR 74 N -1.62 3.48 0.30 4.28 2.01 -0.54 -4.79 115.64 118.77 3ddj s THR 74 Ca 0.36 1.14 -0.30 0.00 0.31 0.00 0.00 61.69 63.21 3ddj s THR 74 Cb 0.21 -3.73 -0.12 0.00 0.01 0.00 0.00 72.50 68.87 3ddj s THR 74 CO 0.30 0.13 1.51 -2.65 -0.69 0.00 0.00 174.62 173.22 3ddj n PRO 75 N 3.26 2.52 0.14 4.92 -0.02 -1.26 -0.27 135.00 144.28 3ddj n PRO 75 Ca 0.08 0.89 0.11 0.00 -2.02 0.00 0.00 63.50 62.57 3ddj n PRO 75 Cb 0.44 -2.62 0.63 0.00 -0.02 0.00 0.00 33.50 31.92 3ddj n PRO 75 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3ddj h ILE 76 N 3.14 0.93 -0.07 4.25 2.10 -1.25 -1.57 117.51 125.03 3ddj h ILE 76 Ca -0.47 -0.03 0.02 0.00 1.08 0.00 0.00 64.86 65.46 3ddj h ILE 76 Cb 1.24 0.84 -0.00 0.00 -1.09 0.00 0.00 36.82 37.81 3ddj h ILE 76 CO 0.74 0.01 0.13 0.16 -1.08 0.00 0.00 178.15 178.12 3ddj h ILE 77 N 0.08 0.27 0.00 2.19 3.07 -1.83 -2.08 117.51 119.22 3ddj h ILE 77 Ca 0.11 0.00 -0.03 0.00 1.55 0.00 0.00 64.86 66.49 3ddj h ILE 77 Cb 0.33 0.88 -0.00 0.00 -0.27 0.00 0.00 36.82 37.75 3ddj h ILE 77 CO -0.01 0.00 -0.14 0.44 -1.05 0.00 0.00 178.15 177.39 3ddj h ASP 78 N 0.00 0.00 -2.16 2.16 3.32 -1.65 -3.48 116.42 114.61 3ddj h ASP 78 Ca 0.03 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.49 3ddj h ASP 78 Cb 0.30 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.44 3ddj h ASP 78 CO -0.00 0.14 -0.68 -1.22 -1.72 0.00 0.00 179.24 175.75 3ddj n TYR 79 N -3.20 2.95 -4.00 4.55 4.02 -0.78 -5.12 117.16 115.57 3ddj n TYR 79 Ca 0.02 -4.05 -0.33 0.00 -0.01 0.00 0.00 57.90 53.52 3ddj n TYR 79 Cb 0.46 -0.52 -0.14 0.00 -0.02 0.00 0.00 39.34 39.11 3ddj n TYR 79 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3ddj s THR 81 N -2.26 2.56 0.71 -0.72 2.01 0.63 -4.85 115.64 113.71 3ddj s THR 81 Ca 0.39 -1.42 -0.11 0.00 0.31 0.00 0.00 61.69 60.86 3ddj s THR 81 Cb 0.15 -2.44 0.01 0.00 0.01 0.00 0.00 72.50 70.24 3ddj s THR 81 CO -0.03 0.01 1.07 -2.16 -0.69 0.00 0.00 174.62 172.82 3ddj s PRO 82 N 1.20 2.86 -1.29 4.92 0.04 -1.26 -0.50 135.00 140.97 3ddj s PRO 82 Ca -0.06 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 61.65 3ddj s PRO 82 Cb -0.19 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3ddj s PRO 82 CO -0.04 -1.10 0.56 -1.71 0.04 0.00 0.00 177.00 174.75 3ddj n ASN 83 N -3.11 -2.45 -4.78 6.66 5.15 -1.05 -4.88 115.26 110.79 3ddj n ASN 83 Ca 0.07 -1.05 -0.32 0.00 -0.60 0.00 0.00 54.58 52.67 3ddj n ASN 83 Cb 0.55 -2.96 0.06 0.00 -0.53 0.00 0.00 39.78 36.90 3ddj n ASN 83 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3ddj s PRO 84 N -6.48 2.70 0.16 1.20 0.04 -1.26 -4.98 135.00 126.38 3ddj s PRO 84 Ca 0.22 1.25 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3ddj s PRO 84 Cb -0.09 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 3ddj s PRO 84 CO 0.89 -1.31 1.07 0.08 0.04 0.00 0.00 177.00 177.78 3ddj s VAL 85 N -2.62 4.01 0.23 -0.36 1.01 -1.26 -5.03 120.40 116.39 3ddj s VAL 85 Ca 0.64 1.71 0.01 0.00 0.00 0.00 0.00 61.98 64.34 3ddj s VAL 85 Cb -0.18 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 3ddj s VAL 85 CO 0.47 0.28 0.08 0.42 0.00 0.00 0.00 175.10 176.35 3ddj s THR 86 N -0.14 0.54 0.12 3.92 -4.23 -1.26 -4.18 115.64 110.40 3ddj s THR 86 Ca 0.49 -1.99 0.08 0.00 -1.18 0.00 0.00 61.69 59.08 3ddj s THR 86 Cb -0.28 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.03 3ddj s THR 86 CO 0.33 -0.12 -0.18 0.68 -0.54 0.00 0.00 174.62 174.79 3ddj s VAL 87 N -3.77 1.60 0.51 2.29 -7.23 -0.47 -4.99 120.40 108.34 3ddj s VAL 87 Ca 0.35 -1.63 -0.19 0.00 -1.81 0.00 0.00 61.98 58.70 3ddj s VAL 87 Cb 0.07 -1.56 -0.08 0.00 0.56 0.00 0.00 36.38 35.38 3ddj s VAL 87 CO 0.11 -0.19 1.05 -0.31 -0.31 0.00 0.00 175.10 175.44 3ddj s TYR 88 N -1.53 2.98 0.50 2.82 2.02 -1.26 -1.10 117.35 121.78 3ddj s TYR 88 Ca 0.08 1.56 0.34 0.00 -0.37 0.00 0.00 57.07 58.68 3ddj s TYR 88 Cb -0.08 -3.07 1.82 0.00 -0.40 0.00 0.00 41.96 40.22 3ddj s TYR 88 CO 0.04 -0.91 2.19 -2.95 -1.57 0.00 0.00 175.55 172.35 3ddj h ASN 89 N 1.36 0.00 0.04 2.29 -1.07 -1.31 -1.09 115.58 115.80 3ddj h ASN 89 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 3ddj h ASN 89 Cb 1.22 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.47 3ddj h ASN 89 CO 0.59 0.04 -0.04 0.35 0.07 0.00 0.00 177.43 178.44 3ddj n THR 90 N -3.47 0.00 -2.10 6.14 -2.24 -1.26 -3.84 114.28 107.50 3ddj n THR 90 Ca -0.02 -0.20 -0.28 0.00 -2.27 0.00 0.00 64.05 61.29 3ddj n THR 90 Cb 0.16 0.34 0.06 0.00 -2.10 0.00 0.00 70.33 68.79 3ddj n THR 90 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3ddj s SER 91 N -2.09 5.09 0.29 3.42 1.04 -0.41 -4.81 113.70 116.22 3ddj s SER 91 Ca 0.37 0.76 -0.00 0.00 0.48 0.00 0.00 55.95 57.56 3ddj s SER 91 Cb 0.21 -1.49 -0.04 0.00 0.10 0.00 0.00 66.02 64.80 3ddj s SER 91 CO 0.37 -1.48 0.50 1.51 0.98 0.00 0.00 173.24 175.12 3ddj s ASP 92 N -4.44 6.35 0.24 7.02 -4.77 -1.26 0.04 116.67 119.84 3ddj s ASP 92 Ca 0.59 0.46 -0.03 0.00 -3.30 0.00 0.00 52.55 50.26 3ddj s ASP 92 Cb -0.11 -2.03 0.26 0.00 -1.09 0.00 0.00 42.92 39.94 3ddj s ASP 92 CO 0.48 -0.20 1.70 -0.33 0.70 0.00 0.00 175.17 177.52 3ddj h GLU 93 N 1.26 0.81 -0.64 2.11 5.08 -1.92 -3.00 114.58 118.29 3ddj h GLU 93 Ca -0.49 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 57.53 3ddj h GLU 93 Cb 1.21 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 3ddj h GLU 93 CO 0.64 0.87 0.07 0.35 -1.00 0.00 0.00 179.01 179.94 3ddj h PHE 94 N 0.73 1.14 -0.78 4.33 3.04 -1.97 -1.72 116.94 121.71 3ddj h PHE 94 Ca 0.13 -0.17 -0.03 0.00 3.98 0.00 0.00 57.97 61.88 3ddj h PHE 94 Cb 0.57 -0.31 -0.04 0.00 2.56 0.00 0.00 35.95 38.74 3ddj h PHE 94 CO 0.03 0.97 0.36 1.15 -2.02 0.00 0.00 178.31 178.80 3ddj h THR 95 N 0.99 1.25 -0.33 4.41 2.02 -1.95 -1.21 112.91 118.09 3ddj h THR 95 Ca 0.19 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 3ddj h THR 95 Cb 0.47 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 3ddj h THR 95 CO 0.02 0.30 0.20 0.00 0.37 0.00 0.00 175.52 176.41 3ddj h ALA 96 N 1.18 0.43 -0.48 6.16 0.00 -1.36 -0.73 119.26 124.46 3ddj h ALA 96 Ca 0.27 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.18 3ddj h ALA 96 Cb 0.14 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3ddj h ALA 96 CO -0.03 -0.07 0.18 0.82 0.00 0.00 0.00 179.25 180.15 3ddj h ILE 97 N 0.43 0.86 -0.49 0.00 2.04 -1.13 -3.00 117.51 116.21 3ddj h ILE 97 Ca 0.12 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3ddj h ILE 97 Cb 0.02 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 3ddj h ILE 97 CO -0.02 0.07 0.27 -1.13 0.00 0.00 0.00 178.15 177.33 3ddj h ASN 98 N 0.37 0.62 0.00 1.72 -0.73 -0.76 0.44 115.58 117.23 3ddj h ASN 98 Ca 0.23 -0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.30 3ddj h ASN 98 Cb 0.22 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.65 3ddj h ASN 98 CO -0.22 0.53 0.00 -0.38 -0.37 0.00 0.00 177.43 176.99 3ddj n ILE 99 N -4.66 0.00 0.00 2.57 5.41 -0.32 -0.78 119.36 121.58 3ddj n ILE 99 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 3ddj n ILE 99 Cb 0.09 -0.21 0.00 0.00 -0.71 0.00 0.00 39.64 38.81 3ddj n ILE 99 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 3ddj n VAL 101 N 0.08 0.00 0.10 1.39 0.31 0.15 -1.08 118.33 119.27 3ddj n VAL 101 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 3ddj n VAL 101 Cb 0.00 0.00 0.25 0.00 -0.91 0.00 0.00 33.84 33.18 3ddj n VAL 101 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3ddj h THR 102 N 0.00 1.29 -0.09 2.52 1.35 -1.19 -3.21 112.91 113.59 3ddj h THR 102 Ca 0.00 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 3ddj h THR 102 Cb 0.00 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3ddj h THR 102 CO 0.00 0.42 0.00 0.54 -0.25 0.00 0.00 175.52 176.23 3ddj n ARG 103 N -4.06 1.07 -3.18 4.72 1.74 -0.24 -5.02 116.66 111.69 3ddj n ARG 103 Ca -0.01 -1.36 -0.14 0.00 -0.77 0.00 0.00 57.85 55.57 3ddj n ARG 103 Cb 0.45 -1.22 0.07 0.00 -1.02 0.00 0.00 32.46 30.74 3ddj n ARG 103 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3ddj n ASN 104 N 0.58 -5.33 -4.37 0.55 5.15 -1.21 -5.04 115.26 105.59 3ddj n ASN 104 Ca 0.07 -0.64 -0.33 0.00 -0.60 0.00 0.00 54.58 53.09 3ddj n ASN 104 Cb 0.31 -4.87 -0.15 0.00 -0.53 0.00 0.00 39.78 34.54 3ddj n ASN 104 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3ddj s PHE 105 N -3.36 2.72 -1.34 1.20 0.08 -1.26 -5.01 117.98 111.01 3ddj s PHE 105 Ca 0.33 -0.59 0.29 0.00 0.12 0.00 0.00 56.93 57.08 3ddj s PHE 105 Cb -0.04 -1.76 1.25 0.00 -0.57 0.00 0.00 43.02 41.90 3ddj s PHE 105 CO 0.69 -0.14 1.90 0.41 -0.10 0.00 0.00 175.22 177.97 3ddj n GLY 106 N 3.19 -1.23 3.37 4.36 0.00 -1.26 -4.67 105.19 108.96 3ddj n GLY 106 Ca -0.18 -0.19 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 3ddj n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ddj s SER 107 N -2.70 -0.40 -0.10 1.61 1.04 -1.26 -2.42 113.70 109.47 3ddj s SER 107 Ca 0.23 0.14 -0.00 0.00 0.48 0.00 0.00 55.95 56.80 3ddj s SER 107 Cb 0.20 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.81 3ddj s SER 107 CO 0.51 -0.70 -0.07 -0.76 0.98 0.00 0.00 173.24 173.19 3ddj s LEU 108 N -1.96 1.19 0.50 2.42 1.43 0.18 -5.00 118.68 117.44 3ddj s LEU 108 Ca -0.05 -0.28 -0.23 0.00 -1.03 0.00 0.00 54.13 52.54 3ddj s LEU 108 Cb -0.01 -0.80 -0.07 0.00 0.03 0.00 0.00 46.19 45.35 3ddj s LEU 108 CO -0.02 -0.11 1.26 -2.65 0.23 0.00 0.00 176.35 175.07 3ddj n PRO 109 N 4.82 1.67 -4.53 1.29 -0.02 -1.26 -1.49 135.00 135.48 3ddj n PRO 109 Ca -0.13 0.61 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 3ddj n PRO 109 Cb 0.50 -2.43 -0.14 0.00 -0.02 0.00 0.00 33.50 31.41 3ddj n PRO 109 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ddj s VAL 110 N -1.29 3.27 0.16 -1.45 1.01 -0.07 -1.37 120.40 120.66 3ddj s VAL 110 Ca 0.68 -0.57 0.07 0.00 0.00 0.00 0.00 61.98 62.15 3ddj s VAL 110 Cb -0.45 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3ddj s VAL 110 CO 0.53 0.50 -0.14 0.68 0.00 0.00 0.00 175.10 176.66 3ddj s VAL 111 N 0.57 1.55 0.69 2.92 -7.23 -0.26 -0.44 120.40 118.20 3ddj s VAL 111 Ca -0.06 -1.99 -0.08 0.00 -1.81 0.00 0.00 61.98 58.03 3ddj s VAL 111 Cb -0.15 -1.83 0.15 0.00 0.56 0.00 0.00 36.38 35.11 3ddj s VAL 111 CO 0.03 -0.51 0.95 -0.90 -0.31 0.00 0.00 175.10 174.35 3ddj n ASP 112 N 0.04 0.43 0.31 4.85 5.68 -0.21 -0.82 116.55 126.83 3ddj n ASP 112 Ca -0.11 -1.56 0.19 0.00 -0.50 0.00 0.00 54.79 52.80 3ddj n ASP 112 Cb 0.59 -0.69 1.00 0.00 -1.14 0.00 0.00 41.12 40.88 3ddj n ASP 112 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3ddj h ILE 113 N -1.23 0.19 -0.43 2.12 6.09 -1.99 -0.08 117.51 122.17 3ddj h ILE 113 Ca -0.31 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 3ddj h ILE 113 Cb 0.94 1.14 0.00 0.00 0.47 0.00 0.00 36.82 39.37 3ddj h ILE 113 CO 0.25 0.02 0.00 0.59 -3.07 0.00 0.00 178.15 175.94 3ddj n ASN 114 N -3.31 2.69 -0.83 2.19 5.03 -1.26 -4.92 115.26 114.85 3ddj n ASN 114 Ca -0.02 -2.11 -0.10 0.00 0.87 0.00 0.00 54.58 53.22 3ddj n ASN 114 Cb 0.14 -0.36 -0.04 0.00 -1.02 0.00 0.00 39.78 38.50 3ddj n ASN 114 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3ddj n ASP 115 N 0.74 -4.19 -4.72 6.41 2.03 -0.04 -4.81 116.55 111.95 3ddj n ASP 115 Ca 0.15 0.24 -0.39 0.00 0.52 0.00 0.00 54.79 55.31 3ddj n ASP 115 Cb 0.46 -2.67 -0.05 0.00 -0.72 0.00 0.00 41.12 38.15 3ddj n ASP 115 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3ddj s LYS 116 N -3.00 4.42 0.25 -0.67 2.20 -1.26 -1.32 119.74 120.36 3ddj s LYS 116 Ca 0.00 0.85 -0.30 0.00 -0.36 0.00 0.00 55.97 56.16 3ddj s LYS 116 Cb 0.00 -3.43 -0.10 0.00 -1.51 0.00 0.00 37.83 32.80 3ddj s LYS 116 CO 0.00 0.12 1.36 -1.25 -0.36 0.00 0.00 175.35 175.22 3ddj s PRO 117 N 0.61 4.34 0.00 4.03 0.04 -1.26 -1.04 135.00 141.71 3ddj s PRO 117 Ca 0.36 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.59 3ddj s PRO 117 Cb -0.18 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.23 3ddj s PRO 117 CO 0.18 -0.29 0.05 1.33 0.04 0.00 0.00 177.00 178.31 3ddj n VAL 118 N 2.07 0.00 -2.88 -0.36 0.24 0.41 -4.87 118.33 112.93 3ddj n VAL 118 Ca 0.05 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 3ddj n VAL 118 Cb 0.42 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 3ddj n VAL 118 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ddj n GLY 119 N 0.75 -1.27 3.28 7.63 0.00 -1.05 -4.19 105.19 110.34 3ddj n GLY 119 Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 3ddj n GLY 119 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3ddj s ILE 120 N -2.91 0.02 -0.07 -0.61 2.07 -0.63 -0.89 121.20 118.17 3ddj s ILE 120 Ca 0.00 -0.14 0.03 0.00 -1.41 0.00 0.00 60.65 59.12 3ddj s ILE 120 Cb 0.00 -0.58 -0.02 0.00 0.13 0.00 0.00 42.46 41.99 3ddj s ILE 120 CO 0.00 -0.08 -0.15 0.68 -1.91 0.00 0.00 174.94 173.48 3ddj s VAL 121 N -0.31 2.98 0.44 4.00 -7.23 -0.56 -0.36 120.40 119.36 3ddj s VAL 121 Ca -0.04 -0.73 0.04 0.00 -1.81 0.00 0.00 61.98 59.43 3ddj s VAL 121 Cb -0.03 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 3ddj s VAL 121 CO 0.02 0.57 0.03 0.42 -0.31 0.00 0.00 175.10 175.82 3ddj s THR 122 N -0.36 1.43 0.29 5.32 -4.23 -1.26 -0.65 115.64 116.17 3ddj s THR 122 Ca 0.04 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 3ddj s THR 122 Cb -0.12 -2.59 0.28 0.00 1.34 0.00 0.00 72.50 71.41 3ddj s THR 122 CO 0.02 0.00 1.74 -0.33 -0.54 0.00 0.00 174.62 175.51 3ddj h GLU 123 N 1.65 0.56 -0.78 3.99 5.08 -1.85 -2.13 114.58 121.11 3ddj h GLU 123 Ca -0.43 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.00 3ddj h GLU 123 Cb 1.27 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.34 3ddj h GLU 123 CO 0.74 0.37 0.51 -0.09 -1.00 0.00 0.00 179.01 179.55 3ddj h ARG 124 N 0.58 0.68 0.00 2.33 2.43 -1.91 -2.45 114.38 116.05 3ddj h ARG 124 Ca 0.54 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.64 3ddj h ARG 124 Cb 0.89 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.28 3ddj h ARG 124 CO -0.43 0.45 -0.14 0.93 -1.51 0.00 0.00 179.97 179.28 3ddj h GLU 125 N 0.70 0.00 -0.00 0.20 3.07 -1.72 -2.68 114.58 114.16 3ddj h GLU 125 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 3ddj h GLU 125 Cb 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 3ddj h GLU 125 CO -0.14 0.14 -0.33 1.19 -1.40 0.00 0.00 179.01 178.47 3ddj n PHE 126 N -3.33 0.00 0.11 4.33 3.72 -0.92 -3.92 117.46 117.44 3ddj n PHE 126 Ca -0.00 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.47 3ddj n PHE 126 Cb 0.35 -0.33 0.54 0.00 -0.94 0.00 0.00 39.48 39.10 3ddj n PHE 126 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3ddj h LEU 127 N 0.00 0.23 -2.09 4.37 3.38 -1.54 -2.20 115.31 117.46 3ddj h LEU 127 Ca 0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3ddj h LEU 127 Cb 0.50 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3ddj h LEU 127 CO 0.00 0.16 -0.08 -0.07 0.09 0.00 0.00 178.44 178.55 3ddj h LEU 128 N 0.27 0.00 -2.49 1.67 3.38 -1.77 -2.70 115.31 113.66 3ddj h LEU 128 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3ddj h LEU 128 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 3ddj h LEU 128 CO -0.02 0.08 -0.02 -0.07 0.09 0.00 0.00 178.44 178.49 3ddj h LEU 129 N 0.00 0.00 -1.59 1.67 4.07 -1.66 -2.22 115.31 115.59 3ddj h LEU 129 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3ddj h LEU 129 Cb 0.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.92 3ddj h LEU 129 CO 0.01 0.02 0.00 1.88 -1.08 0.00 0.00 178.44 179.27 3ddj h TYR 130 N 0.00 0.00 -0.81 1.13 0.05 -1.66 -2.97 116.97 112.71 3ddj h TYR 130 Ca -0.00 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.79 3ddj h TYR 130 Cb 0.13 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.83 3ddj h TYR 130 CO 0.00 0.00 0.53 0.87 -1.05 0.00 0.00 178.16 178.51 3ddj h LYS 131 N 0.00 1.05 -0.11 4.88 1.57 -1.60 -2.48 116.57 119.87 3ddj h LYS 131 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3ddj h LYS 131 Cb 0.46 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3ddj h LYS 131 CO 0.00 0.69 0.00 -0.25 -0.57 0.00 0.00 179.45 179.32 3ddj n ASP 132 N -4.42 1.16 -4.70 0.86 8.00 -1.12 -4.92 116.55 111.40 3ddj n ASP 132 Ca 0.09 -1.62 -0.29 0.00 0.71 0.00 0.00 54.79 53.68 3ddj n ASP 132 Cb 0.04 -0.07 -0.08 0.00 -0.02 0.00 0.00 41.12 40.99 3ddj n ASP 132 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ddj s LEU 133 N -1.57 3.50 0.68 0.64 1.43 -0.93 -4.66 118.68 117.76 3ddj s LEU 133 Ca 0.31 -0.19 -0.17 0.00 -1.03 0.00 0.00 54.13 53.05 3ddj s LEU 133 Cb 0.16 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 44.18 3ddj s LEU 133 CO 0.25 0.15 1.23 0.47 0.23 0.00 0.00 176.35 178.68 3ddj n ASP 134 N 0.39 1.68 -4.55 2.29 8.00 -1.26 -4.96 116.55 118.14 3ddj n ASP 134 Ca -0.10 0.78 -0.41 0.00 0.71 0.00 0.00 54.79 55.76 3ddj n ASP 134 Cb 0.52 -1.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.07 3ddj n ASP 134 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3ddj s GLU 135 N -3.43 3.47 -0.26 -1.24 2.02 -1.26 -4.82 118.70 113.18 3ddj s GLU 135 Ca 0.80 -0.90 -0.11 0.00 0.02 0.00 0.00 54.97 54.78 3ddj s GLU 135 Cb -0.37 -5.00 -0.14 0.00 0.10 0.00 0.00 34.13 28.72 3ddj s GLU 135 CO 0.43 -2.17 -0.25 -0.89 0.02 0.00 0.00 175.26 172.40 3ddj n ILE 136 N 6.68 1.53 -5.19 -1.63 5.41 -1.26 -5.01 119.36 119.89 3ddj n ILE 136 Ca 0.24 -0.40 -0.32 0.00 1.00 0.00 0.00 62.75 63.27 3ddj n ILE 136 Cb 0.50 -1.79 -0.15 0.00 -0.71 0.00 0.00 39.64 37.48 3ddj n ILE 136 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 3ddj s PHE 137 N -2.50 2.45 0.53 1.39 0.08 -1.26 -5.06 117.98 113.60 3ddj s PHE 137 Ca -0.37 -0.46 -0.12 0.00 0.12 0.00 0.00 56.93 56.10 3ddj s PHE 137 Cb 0.13 -1.56 -0.06 0.00 -0.57 0.00 0.00 43.02 40.95 3ddj s PHE 137 CO 0.53 -0.05 0.93 -1.25 -0.10 0.00 0.00 175.22 175.29 3ddj s PRO 138 N -0.48 3.74 0.31 0.24 0.04 -1.26 -0.69 135.00 136.88 3ddj s PRO 138 Ca 0.06 0.68 0.07 0.00 0.04 0.00 0.00 61.00 61.85 3ddj s PRO 138 Cb -0.11 -2.20 0.79 0.00 0.04 0.00 0.00 34.50 33.02 3ddj s PRO 138 CO 0.01 -0.32 1.76 0.28 0.04 0.00 0.00 177.00 178.76 3ddj h VAL 139 N 0.42 0.64 -1.03 -0.36 2.07 -0.75 -2.03 116.25 115.21 3ddj h VAL 139 Ca -0.46 -0.23 0.26 0.00 0.82 0.00 0.00 66.70 67.08 3ddj h VAL 139 Cb 1.19 -0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 30.76 3ddj h VAL 139 CO 0.62 0.12 0.66 0.50 0.02 0.00 0.00 177.57 179.50 3ddj h LYS 140 N 0.68 0.40 -0.09 1.57 3.64 -0.83 -1.64 116.57 120.30 3ddj h LYS 140 Ca 0.60 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.83 3ddj h LYS 140 Cb 1.02 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3ddj h LYS 140 CO -0.42 0.26 -0.52 0.28 -2.27 0.00 0.00 179.45 176.78 3ddj h VAL 141 N 0.41 1.35 -2.60 2.00 2.07 -1.65 -3.48 116.25 114.35 3ddj h VAL 141 Ca 0.58 -1.78 -0.70 0.00 0.82 0.00 0.00 66.70 65.62 3ddj h VAL 141 Cb 1.46 1.86 -0.35 0.00 -1.52 0.00 0.00 31.29 32.73 3ddj h VAL 141 CO -0.29 0.53 0.06 0.49 0.02 0.00 0.00 177.57 178.39 3ddj n PHE 142 N -3.94 3.07 -4.66 1.57 3.72 -0.62 -5.12 117.46 111.48 3ddj n PHE 142 Ca -0.02 -3.45 -0.23 0.00 -0.05 0.00 0.00 57.45 53.70 3ddj n PHE 142 Cb 0.55 -0.91 -0.16 0.00 -0.94 0.00 0.00 39.48 38.02 3ddj n PHE 142 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3ddj s SER 144 N -2.00 1.75 -0.00 4.37 0.01 0.13 -4.87 113.70 113.09 3ddj s SER 144 Ca 0.35 -0.28 0.11 0.00 1.31 0.00 0.00 55.95 57.44 3ddj s SER 144 Cb 0.09 -0.40 -0.12 0.00 0.21 0.00 0.00 66.02 65.79 3ddj s SER 144 CO 0.03 0.13 0.47 0.35 0.41 0.00 0.00 173.24 174.64 3ddj n THR 145 N 3.07 0.00 -3.23 1.44 -2.24 -1.26 -1.53 114.28 110.53 3ddj n THR 145 Ca -0.17 -0.23 -0.44 0.00 -2.27 0.00 0.00 64.05 60.94 3ddj n THR 145 Cb 0.54 0.97 -0.00 0.00 -2.10 0.00 0.00 70.33 69.74 3ddj n THR 145 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ddj n LYS 146 N -1.29 3.84 -2.85 -0.78 5.02 -1.26 -4.76 118.16 116.07 3ddj n LYS 146 Ca 0.02 -4.50 -0.41 0.00 -2.02 0.00 0.00 58.31 51.40 3ddj n LYS 146 Cb 0.18 -2.52 -0.04 0.00 -0.02 0.00 0.00 35.03 32.63 3ddj n LYS 146 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ddj s VAL 147 N -1.88 4.91 -0.17 -0.18 1.01 -1.26 -4.99 120.40 117.84 3ddj s VAL 147 Ca 0.31 1.76 -0.29 0.00 0.00 0.00 0.00 61.98 63.76 3ddj s VAL 147 Cb -0.04 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 3ddj s VAL 147 CO -0.01 0.12 1.14 -1.58 0.00 0.00 0.00 175.10 174.77 3ddj s GLN 148 N 1.43 4.28 0.50 2.72 2.00 -1.26 -5.03 119.66 124.31 3ddj s GLN 148 Ca 0.43 1.51 0.03 0.00 -2.00 0.00 0.00 55.36 55.34 3ddj s GLN 148 Cb -0.18 -3.67 -0.01 0.00 0.80 0.00 0.00 33.01 29.95 3ddj s GLN 148 CO 0.19 -0.60 0.11 0.95 -0.50 0.00 0.00 175.29 175.44 3ddj s THR 149 N 3.07 1.44 -0.01 -0.34 -4.23 -1.26 -3.99 115.64 110.31 3ddj s THR 149 Ca 0.50 -1.86 -0.08 0.00 -1.18 0.00 0.00 61.69 59.07 3ddj s THR 149 Cb -0.19 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.36 3ddj s THR 149 CO 0.12 0.00 0.17 -0.51 -0.54 0.00 0.00 174.62 173.86 3ddj s ILE 150 N -2.82 0.07 0.33 2.99 2.07 -0.64 -4.97 121.20 118.23 3ddj s ILE 150 Ca 0.17 -0.55 -0.26 0.00 -1.41 0.00 0.00 60.65 58.61 3ddj s ILE 150 Cb 0.02 -0.43 -0.09 0.00 0.13 0.00 0.00 42.46 42.08 3ddj s ILE 150 CO 0.10 -0.30 1.00 -0.47 -1.91 0.00 0.00 174.94 173.36 3ddj s TYR 151 N -1.13 3.57 0.51 3.50 5.04 -1.26 -0.74 117.35 126.84 3ddj s TYR 151 Ca -0.12 1.74 0.35 0.00 -2.44 0.00 0.00 57.07 56.60 3ddj s TYR 151 Cb -0.06 -3.04 1.89 0.00 0.35 0.00 0.00 41.96 41.10 3ddj s TYR 151 CO 0.02 -0.14 2.22 1.57 -1.34 0.00 0.00 175.55 177.88 3ddj h LYS 152 N 3.12 0.00 -0.11 4.97 2.10 -1.55 -2.44 116.57 122.65 3ddj h LYS 152 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 3ddj h LYS 152 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3ddj h LYS 152 CO 0.65 0.03 0.00 0.39 -2.00 0.00 0.00 179.45 178.52 3ddj n GLU 153 N -3.43 1.99 -2.16 0.07 -0.58 -1.26 -1.40 120.64 113.87 3ddj n GLU 153 Ca -0.02 -1.46 -0.40 0.00 -0.42 0.00 0.00 57.16 54.85 3ddj n GLU 153 Cb 0.15 -1.46 -0.02 0.00 -0.57 0.00 0.00 31.44 29.54 3ddj n GLU 153 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3ddj s VAL 154 N -1.87 2.81 0.35 2.62 1.01 -0.92 -4.67 120.40 119.72 3ddj s VAL 154 Ca 0.34 0.80 -0.28 0.00 0.00 0.00 0.00 61.98 62.84 3ddj s VAL 154 Cb 0.20 -3.51 -0.11 0.00 0.00 0.00 0.00 36.38 32.97 3ddj s VAL 154 CO 0.31 0.18 1.39 -0.13 0.00 0.00 0.00 175.10 176.84 3ddj s ARG 155 N -1.83 4.25 0.28 2.72 0.52 -1.26 -0.04 118.95 123.58 3ddj s ARG 155 Ca 0.50 2.37 0.00 0.00 -0.52 0.00 0.00 55.73 58.08 3ddj s ARG 155 Cb -0.38 -3.03 0.51 0.00 0.52 0.00 0.00 34.95 32.57 3ddj s ARG 155 CO 0.50 -0.34 1.85 1.25 0.02 0.00 0.00 175.30 178.58 3ddj h LEU 156 N 3.31 0.95 -1.42 2.53 5.85 -1.29 -2.00 115.31 123.23 3ddj h LEU 156 Ca -0.50 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.27 3ddj h LEU 156 Cb 1.23 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 3ddj h LEU 156 CO 0.66 0.53 0.36 -2.24 -0.34 0.00 0.00 178.44 177.41 3ddj h ASP 157 N 1.04 0.65 -0.37 1.25 2.03 -1.82 -0.80 116.42 118.41 3ddj h ASP 157 Ca 0.48 -0.02 -0.16 0.00 -0.73 0.00 0.00 57.03 56.59 3ddj h ASP 157 Cb 0.41 -0.16 -0.01 0.00 -0.83 0.00 0.00 39.33 38.74 3ddj h ASP 157 CO -0.24 0.48 -0.40 1.56 -1.03 0.00 0.00 179.24 179.61 3ddj h GLN 158 N 0.76 0.93 -0.63 4.15 4.20 -1.77 -1.93 115.11 120.82 3ddj h GLN 158 Ca 0.20 -0.50 0.08 0.00 0.06 0.00 0.00 58.65 58.50 3ddj h GLN 158 Cb -0.07 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.67 3ddj h GLN 158 CO -0.04 1.15 0.29 0.00 -0.67 0.00 0.00 178.83 179.56 3ddj h ALA 159 N 0.78 0.83 -0.22 3.87 0.00 -0.79 -2.30 119.26 121.43 3ddj h ALA 159 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3ddj h ALA 159 Cb 1.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3ddj h ALA 159 CO 0.10 -0.10 0.09 0.28 0.00 0.00 0.00 179.25 179.62 3ddj h VAL 160 N 0.52 1.17 -0.65 0.00 2.07 -0.95 -2.80 116.25 115.60 3ddj h VAL 160 Ca 0.30 -0.51 0.10 0.00 0.82 0.00 0.00 66.70 67.42 3ddj h VAL 160 Cb 0.31 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 31.09 3ddj h VAL 160 CO -0.25 0.17 0.25 0.11 0.02 0.00 0.00 177.57 177.87 3ddj h LYS 161 N 0.20 0.42 -1.00 1.57 1.57 -1.14 -1.27 116.57 116.92 3ddj h LYS 161 Ca 0.07 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3ddj h LYS 161 Cb 0.18 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3ddj h LYS 161 CO -0.01 0.28 0.00 -0.11 -0.57 0.00 0.00 179.45 179.04 3ddj n LEU 162 N -4.99 0.64 0.00 2.94 7.94 -0.88 -0.91 117.00 121.75 3ddj n LEU 162 Ca 0.10 -0.32 0.00 0.00 -1.11 0.00 0.00 56.01 54.68 3ddj n LEU 162 Cb 0.31 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.10 3ddj n LEU 162 CO 0.21 0.12 0.00 0.18 -1.11 0.00 0.00 177.39 176.79 3ddj n LEU 164 N 0.59 0.00 -0.07 -1.96 4.77 -0.48 -1.48 117.00 118.37 3ddj n LEU 164 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 3ddj n LEU 164 Cb 0.12 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.17 3ddj n LEU 164 CO 0.00 0.00 0.83 -0.09 -1.33 0.00 0.00 177.39 176.80 3ddj h ARG 165 N 0.00 0.36 -0.01 3.23 2.43 -1.26 -3.07 114.38 116.05 3ddj h ARG 165 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3ddj h ARG 165 Cb 0.00 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3ddj h ARG 165 CO 0.00 0.45 -0.23 0.54 -1.51 0.00 0.00 179.97 179.22 3ddj n ARG 166 N -4.76 0.96 -2.89 0.20 1.74 -0.55 -4.96 116.66 106.40 3ddj n ARG 166 Ca -0.03 -0.58 -0.12 0.00 -0.77 0.00 0.00 57.85 56.35 3ddj n ARG 166 Cb 0.16 -1.49 0.03 0.00 -1.02 0.00 0.00 32.46 30.14 3ddj n ARG 166 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ddj n GLY 167 N 1.32 0.11 3.61 -0.13 0.00 -1.16 -5.04 105.19 103.90 3ddj n GLY 167 Ca 0.13 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 3ddj n GLY 167 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ddj s PHE 168 N -3.04 2.93 -0.62 1.61 0.08 -1.26 -5.01 117.98 112.67 3ddj s PHE 168 Ca 0.24 -0.01 0.25 0.00 0.12 0.00 0.00 56.93 57.53 3ddj s PHE 168 Cb -0.11 -1.63 0.53 0.00 -0.57 0.00 0.00 43.02 41.24 3ddj s PHE 168 CO 0.30 0.39 1.55 0.00 -0.10 0.00 0.00 175.22 177.36 3ddj h ARG 169 N 4.53 0.00 -2.70 0.44 3.08 -1.96 -3.40 114.38 114.37 3ddj h ARG 169 Ca -0.49 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.45 3ddj h ARG 169 Cb 1.17 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.99 3ddj h ARG 169 CO 0.54 0.00 -0.19 1.03 -1.07 0.00 0.00 179.97 180.28 3ddj s ARG 170 N -3.16 0.58 -0.12 0.04 0.52 -1.26 -1.02 118.95 114.53 3ddj s ARG 170 Ca 0.08 0.43 -0.00 0.00 -0.52 0.00 0.00 55.73 55.72 3ddj s ARG 170 Cb 0.11 0.27 0.02 0.00 0.52 0.00 0.00 34.95 35.88 3ddj s ARG 170 CO 0.66 -0.10 -0.09 -0.51 0.02 0.00 0.00 175.30 175.28 3ddj s LEU 171 N -0.16 1.28 0.48 2.53 1.43 0.43 -4.97 118.68 119.70 3ddj s LEU 171 Ca -0.03 -0.34 -0.24 0.00 -1.03 0.00 0.00 54.13 52.49 3ddj s LEU 171 Cb -0.03 -0.90 -0.07 0.00 0.03 0.00 0.00 46.19 45.22 3ddj s LEU 171 CO 0.02 -0.10 1.39 -2.84 0.23 0.00 0.00 176.35 175.05 3ddj s PRO 172 N 1.64 3.49 -0.13 1.29 0.02 -1.26 -1.15 135.00 138.91 3ddj s PRO 172 Ca 0.04 2.33 -0.05 0.00 0.02 0.00 0.00 61.00 63.35 3ddj s PRO 172 Cb -0.13 -2.51 -0.04 0.00 0.02 0.00 0.00 34.50 31.85 3ddj s PRO 172 CO -0.08 -0.94 0.04 0.08 -0.33 0.00 0.00 177.00 175.77 3ddj s VAL 173 N -1.25 4.61 0.28 3.83 1.01 0.38 -1.62 120.40 127.65 3ddj s VAL 173 Ca 0.65 -0.12 0.12 0.00 0.00 0.00 0.00 61.98 62.63 3ddj s VAL 173 Cb -0.42 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 3ddj s VAL 173 CO 0.53 0.54 -0.18 0.27 0.00 0.00 0.00 175.10 176.26 3ddj s ILE 174 N -0.31 2.57 0.00 2.22 -4.36 0.08 -0.92 121.20 120.47 3ddj s ILE 174 Ca 0.08 -2.35 0.00 0.00 -0.26 0.00 0.00 60.65 58.12 3ddj s ILE 174 Cb -0.12 -2.37 0.00 0.00 1.25 0.00 0.00 42.46 41.22 3ddj s ILE 174 CO 0.02 -0.39 0.00 -0.90 0.24 0.00 0.00 174.94 173.91 3ddj n ASP 175 N -0.66 0.34 0.29 4.36 5.68 -0.60 -1.28 116.55 124.67 3ddj n ASP 175 Ca -0.05 -0.59 0.15 0.00 -0.50 0.00 0.00 54.79 53.80 3ddj n ASP 175 Cb 0.60 0.00 0.89 0.00 -1.14 0.00 0.00 41.12 41.47 3ddj n ASP 175 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3ddj h ASP 176 N 0.00 0.00 -0.42 -1.12 3.32 -2.02 -1.88 116.42 114.30 3ddj h ASP 176 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3ddj h ASP 176 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3ddj h ASP 176 CO 0.00 0.00 0.02 0.47 -1.72 0.00 0.00 179.24 178.01 3ddj n ASP 177 N -3.91 4.67 -1.79 6.45 8.00 -1.26 -4.93 116.55 123.79 3ddj n ASP 177 Ca -0.03 -3.02 -0.17 0.00 0.71 0.00 0.00 54.79 52.28 3ddj n ASP 177 Cb 0.10 -0.62 -0.05 0.00 -0.02 0.00 0.00 41.12 40.52 3ddj n ASP 177 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ddj n ASN 178 N -0.05 -4.76 -4.83 -2.24 3.02 -0.71 -4.95 115.26 100.75 3ddj n ASN 178 Ca 0.26 0.32 -0.34 0.00 -0.03 0.00 0.00 54.58 54.78 3ddj n ASN 178 Cb 1.06 -4.19 -0.06 0.00 -0.61 0.00 0.00 39.78 35.98 3ddj n ASN 178 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ddj s LYS 179 N -3.96 4.16 -0.05 3.52 -0.14 -1.26 -4.36 119.74 117.64 3ddj s LYS 179 Ca 0.00 0.83 -0.30 0.00 -1.36 0.00 0.00 55.97 55.14 3ddj s LYS 179 Cb 0.00 -2.63 -0.03 0.00 -1.68 0.00 0.00 37.83 33.49 3ddj s LYS 179 CO 0.00 0.25 1.08 0.08 -0.76 0.00 0.00 175.35 176.00 3ddj s VAL 180 N -1.78 4.57 0.00 3.17 1.01 -0.65 -1.56 120.40 125.17 3ddj s VAL 180 Ca 0.50 1.85 0.00 0.00 0.00 0.00 0.00 61.98 64.33 3ddj s VAL 180 Cb -0.13 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.05 3ddj s VAL 180 CO 0.19 0.05 0.35 1.33 0.00 0.00 0.00 175.10 177.02 3ddj n VAL 181 N 4.37 0.00 -1.05 2.92 0.24 -0.10 -4.98 118.33 119.73 3ddj n VAL 181 Ca 0.09 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 3ddj n VAL 181 Cb 0.48 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.89 3ddj n VAL 181 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ddj n GLY 182 N 0.25 -1.77 2.77 7.63 0.00 -1.23 -4.75 105.19 108.10 3ddj n GLY 182 Ca 0.00 -1.11 -0.17 0.00 0.00 0.00 0.00 46.02 44.74 3ddj n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ddj s ILE 183 N -2.30 -0.09 -0.13 -0.61 1.01 -0.37 -0.47 121.20 118.23 3ddj s ILE 183 Ca 0.00 0.29 -0.06 0.00 0.00 0.00 0.00 60.65 60.88 3ddj s ILE 183 Cb 0.00 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.29 3ddj s ILE 183 CO 0.00 0.12 0.09 0.54 0.00 0.00 0.00 174.94 175.69 3ddj s VAL 184 N 1.54 5.07 0.23 2.92 0.11 -0.30 -0.42 120.40 129.54 3ddj s VAL 184 Ca -0.04 0.05 0.04 0.00 -2.93 0.00 0.00 61.98 59.10 3ddj s VAL 184 Cb -0.12 -3.21 -0.05 0.00 -1.53 0.00 0.00 36.38 31.46 3ddj s VAL 184 CO -0.04 0.57 -0.03 0.42 -3.33 0.00 0.00 175.10 172.70 3ddj s THR 185 N -0.63 1.18 0.40 5.04 -4.23 -1.26 -0.43 115.64 115.71 3ddj s THR 185 Ca 0.12 -2.06 0.21 0.00 -1.18 0.00 0.00 61.69 58.79 3ddj s THR 185 Cb -0.12 -2.31 0.23 0.00 1.34 0.00 0.00 72.50 71.64 3ddj s THR 185 CO 0.02 -0.37 2.00 -0.37 -0.54 0.00 0.00 174.62 175.36 3ddj h VAL 186 N 2.47 0.83 -0.13 2.29 -1.51 -1.43 -1.33 116.25 117.44 3ddj h VAL 186 Ca -0.38 -0.71 -0.03 0.00 -1.23 0.00 0.00 66.70 64.35 3ddj h VAL 186 Cb 1.22 1.42 -0.00 0.00 -2.13 0.00 0.00 31.29 31.80 3ddj h VAL 186 CO 0.65 0.18 -0.03 0.58 -1.23 0.00 0.00 177.57 177.72 3ddj h VAL 187 N 0.00 1.29 -0.47 7.19 2.07 -1.96 -0.21 116.25 124.16 3ddj h VAL 187 Ca -0.00 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 66.63 3ddj h VAL 187 Cb 0.40 1.68 -0.09 0.00 -1.52 0.00 0.00 31.29 31.77 3ddj h VAL 187 CO 0.02 0.28 -0.14 0.78 0.02 0.00 0.00 177.57 178.53 3ddj h ASN 188 N -0.07 -0.52 -0.42 0.57 -0.26 -1.78 -2.07 115.58 111.03 3ddj h ASN 188 Ca 0.03 0.15 -0.04 0.00 -0.56 0.00 0.00 56.30 55.88 3ddj h ASN 188 Cb 0.46 0.32 -0.02 0.00 -1.06 0.00 0.00 38.32 38.02 3ddj h ASN 188 CO 0.01 -0.18 0.10 0.00 -1.06 0.00 0.00 177.43 176.30 3ddj h ALA 189 N 1.40 0.55 0.00 -0.83 0.00 -1.05 -2.94 119.26 116.40 3ddj h ALA 189 Ca 0.23 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 3ddj h ALA 189 Cb 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3ddj h ALA 189 CO -0.50 0.24 -0.55 0.97 0.00 0.00 0.00 179.25 179.41 3ddj h ILE 190 N 0.54 1.34 -0.82 0.00 6.09 -0.93 -0.89 117.51 122.85 3ddj h ILE 190 Ca 0.13 -1.90 -0.02 0.00 -1.37 0.00 0.00 64.86 61.70 3ddj h ILE 190 Cb 0.32 2.04 -0.04 0.00 0.47 0.00 0.00 36.82 39.61 3ddj h ILE 190 CO 0.00 0.54 0.45 0.11 -3.07 0.00 0.00 178.15 176.18 3ddj h LYS 191 N 0.00 1.14 -0.26 2.19 1.57 -1.26 0.17 116.57 120.11 3ddj h LYS 191 Ca -0.01 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.52 3ddj h LYS 191 Cb 1.00 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 3ddj h LYS 191 CO 0.07 0.84 -0.30 1.96 -0.57 0.00 0.00 179.45 181.44 3ddj h GLN 192 N 1.13 0.67 -0.51 3.15 1.08 -1.30 -2.36 115.11 116.98 3ddj h GLN 192 Ca 0.29 -0.37 -0.11 0.00 -1.45 0.00 0.00 58.65 57.01 3ddj h GLN 192 Cb 0.03 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3ddj h GLN 192 CO -0.05 0.98 -0.11 1.25 -0.95 0.00 0.00 178.83 179.95 3ddj h LEU 193 N 0.39 0.94 -0.79 1.46 5.85 -0.95 -1.35 115.31 120.86 3ddj h LEU 193 Ca 0.04 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.51 3ddj h LEU 193 Cb 0.88 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 3ddj h LEU 193 CO 0.07 1.06 0.48 0.00 -0.34 0.00 0.00 178.44 179.72 3ddj h ALA 194 N 1.02 1.06 -0.31 1.25 0.00 -0.62 0.33 119.26 122.00 3ddj h ALA 194 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3ddj h ALA 194 Cb 0.65 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3ddj h ALA 194 CO 0.04 0.23 0.11 0.87 0.00 0.00 0.00 179.25 180.51 3ddj h LYS 195 N 0.90 0.47 -0.70 0.00 1.57 -1.00 -0.42 116.57 117.40 3ddj h LYS 195 Ca 0.34 -0.09 0.06 0.00 -1.87 0.00 0.00 60.65 59.09 3ddj h LYS 195 Cb 0.13 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 3ddj h LYS 195 CO -0.16 0.50 0.39 0.00 -0.57 0.00 0.00 179.45 179.62 3ddj h ALA 196 N 0.95 0.95 -0.33 3.86 0.00 -0.61 -0.87 119.26 123.21 3ddj h ALA 196 Ca 0.10 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3ddj h ALA 196 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ddj h ALA 196 CO -0.01 0.07 -0.04 0.28 0.00 0.00 0.00 179.25 179.55 3ddj h VAL 197 N 0.72 1.27 -0.86 0.00 2.07 -0.83 0.40 116.25 119.02 3ddj h VAL 197 Ca 0.32 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 3ddj h VAL 197 Cb 0.21 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3ddj h VAL 197 CO -0.19 0.34 0.47 -0.78 0.02 0.00 0.00 177.57 177.43 3ddj h ASP 198 N 0.40 1.08 -0.08 0.57 3.58 -0.68 -3.01 116.42 118.29 3ddj h ASP 198 Ca 0.09 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.43 3ddj h ASP 198 Cb 0.52 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.29 3ddj h ASP 198 CO 0.03 0.88 0.00 0.29 -2.88 0.00 0.00 179.24 177.55 3ddj n LYS 199 N -4.36 2.28 -4.05 0.28 4.76 -0.37 -4.96 118.16 111.76 3ddj n LYS 199 Ca 0.09 -1.95 -0.27 0.00 -2.87 0.00 0.00 58.31 53.31 3ddj n LYS 199 Cb 0.10 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 31.79 3ddj n LYS 199 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3ddj n LEU 200 N 1.34 -1.93 -3.66 -0.35 4.77 -0.02 -4.95 117.00 112.22 3ddj n LEU 200 Ca 0.14 -1.07 -0.29 0.00 -0.03 0.00 0.00 56.01 54.76 3ddj n LEU 200 Cb 0.59 -2.08 -0.15 0.00 -2.33 0.00 0.00 43.42 39.45 3ddj n LEU 200 CO 0.15 0.44 -0.33 -0.62 -1.33 0.00 0.00 177.39 175.69 3ddj s ASP 201 N -4.34 3.72 0.61 -1.43 -1.08 -0.34 -4.65 116.67 109.15 3ddj s ASP 201 Ca 0.03 -1.42 0.37 0.00 -0.52 0.00 0.00 52.55 51.01 3ddj s ASP 201 Cb -0.01 -0.63 1.97 0.00 -1.46 0.00 0.00 42.92 42.79 3ddj s ASP 201 CO 0.92 -0.41 2.23 -0.65 0.52 0.00 0.00 175.17 177.77 3ddj h PRO 202 N 8.23 0.00 -0.25 4.34 0.11 -1.85 -2.96 132.00 139.62 3ddj h PRO 202 Ca -0.16 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.01 3ddj h PRO 202 Cb 1.02 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3ddj h PRO 202 CO 0.45 0.02 0.18 -0.44 -0.21 0.00 0.00 178.00 178.00 3ddj h ASP 203 N 0.00 0.04 0.07 -2.05 3.32 -1.95 0.98 116.42 116.83 3ddj h ASP 203 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ddj h ASP 203 Cb 0.15 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 3ddj h ASP 203 CO 0.00 0.02 -0.01 1.88 -1.72 0.00 0.00 179.24 179.42 3ddj h TYR 204 N 0.04 0.00 0.00 4.55 0.05 -1.84 -0.34 116.97 119.43 3ddj h TYR 204 Ca 0.12 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.81 3ddj h TYR 204 Cb 0.42 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 3ddj h TYR 204 CO -0.00 0.01 -0.94 0.34 -1.05 0.00 0.00 178.16 176.52 3ddj n PHE 205 N -3.39 0.00 0.22 4.88 7.35 -0.44 -4.63 117.46 121.44 3ddj n PHE 205 Ca -0.03 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 56.77 3ddj n PHE 205 Cb 0.10 -0.29 0.42 0.00 0.35 0.00 0.00 39.48 40.06 3ddj n PHE 205 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 3ddj h TYR 206 N -0.40 0.00 -0.25 -5.13 0.05 -0.97 -3.13 116.97 107.14 3ddj h TYR 206 Ca -0.12 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.66 3ddj h TYR 206 Cb 0.77 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.51 3ddj h TYR 206 CO -0.11 0.19 0.00 0.41 -1.05 0.00 0.00 178.16 177.60 3ddj n GLY 207 N 0.34 0.58 3.65 3.88 0.00 -0.14 -4.86 105.19 108.64 3ddj n GLY 207 Ca 0.01 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 3ddj n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ddj s LYS 208 N -1.68 2.76 0.29 1.61 -0.14 -1.18 -4.99 119.74 116.40 3ddj s LYS 208 Ca 0.32 -0.60 0.07 0.00 -1.36 0.00 0.00 55.97 54.39 3ddj s LYS 208 Cb 0.17 -2.64 -0.03 0.00 -1.68 0.00 0.00 37.83 33.65 3ddj s LYS 208 CO 0.25 0.63 0.31 0.14 -0.76 0.00 0.00 175.35 175.93 3ddj s VAL 209 N -1.02 4.22 0.21 3.17 -7.23 -1.26 -0.95 120.40 117.55 3ddj s VAL 209 Ca 0.18 -1.23 -0.09 0.00 -1.81 0.00 0.00 61.98 59.02 3ddj s VAL 209 Cb -0.11 -3.42 0.17 0.00 0.56 0.00 0.00 36.38 33.58 3ddj s VAL 209 CO 0.08 -0.25 1.70 0.58 -0.31 0.00 0.00 175.10 176.90 3ddj h VAL 210 N 1.23 0.61 0.00 1.32 2.07 -0.52 -1.65 116.25 119.31 3ddj h VAL 210 Ca -0.47 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 3ddj h VAL 210 Cb 1.25 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3ddj h VAL 210 CO 0.58 0.05 -0.07 0.07 0.02 0.00 0.00 177.57 178.22 3ddj h LYS 211 N 0.25 0.00 0.00 1.57 2.10 -1.51 -2.05 116.57 116.93 3ddj h LYS 211 Ca 0.33 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.92 3ddj h LYS 211 Cb 0.50 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.82 3ddj h LYS 211 CO -0.43 0.07 -0.26 -0.44 -2.00 0.00 0.00 179.45 176.39 3ddj h ASP 212 N 0.00 0.00 -2.16 7.07 3.32 -1.58 -3.49 116.42 119.58 3ddj h ASP 212 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 3ddj h ASP 212 Cb 0.16 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.30 3ddj h ASP 212 CO 0.01 0.26 -0.85 1.33 -1.72 0.00 0.00 179.24 178.27 3ddj n VAL 213 N -4.10 1.61 -4.07 -1.35 0.24 -0.77 -5.04 118.33 104.83 3ddj n VAL 213 Ca -0.02 -5.07 -0.35 0.00 -2.04 0.00 0.00 64.34 56.87 3ddj n VAL 213 Cb 0.32 -1.24 -0.09 0.00 -1.47 0.00 0.00 33.84 31.35 3ddj n VAL 213 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3ddj s VAL 215 N -3.19 4.76 -1.39 3.34 1.01 0.43 -4.85 120.40 120.52 3ddj s VAL 215 Ca 0.43 -0.05 0.12 0.00 0.00 0.00 0.00 61.98 62.48 3ddj s VAL 215 Cb 0.27 -3.11 0.06 0.00 0.00 0.00 0.00 36.38 33.60 3ddj s VAL 215 CO -0.10 0.51 0.82 0.35 0.00 0.00 0.00 175.10 176.69 3ddj n THR 216 N 3.05 0.00 -2.85 3.92 -2.24 -1.26 -1.24 114.28 113.66 3ddj n THR 216 Ca -0.17 -0.45 -0.43 0.00 -2.27 0.00 0.00 64.05 60.73 3ddj n THR 216 Cb 0.53 1.22 -0.04 0.00 -2.10 0.00 0.00 70.33 69.93 3ddj n THR 216 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3ddj s ASN 217 N -1.22 6.62 -0.38 3.42 0.01 -1.26 -4.84 114.94 117.28 3ddj s ASN 217 Ca 0.13 0.45 -0.18 0.00 -0.71 0.00 0.00 52.86 52.55 3ddj s ASN 217 Cb 0.10 -2.44 0.01 0.00 0.41 0.00 0.00 41.25 39.33 3ddj s ASN 217 CO 0.21 -0.85 0.48 -0.76 -1.51 0.00 0.00 177.10 174.66 3ddj s LEU 218 N 3.40 4.56 -0.31 0.60 1.43 -1.26 -4.91 118.68 122.19 3ddj s LEU 218 Ca 0.36 -0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 53.06 3ddj s LEU 218 Cb -0.12 -2.49 0.02 0.00 0.03 0.00 0.00 46.19 43.63 3ddj s LEU 218 CO 0.19 -0.53 0.09 -0.69 0.23 0.00 0.00 176.35 175.65 3ddj s VAL 219 N 2.29 3.92 0.32 -1.59 1.01 -1.26 -5.07 120.40 120.02 3ddj s VAL 219 Ca 0.16 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.37 3ddj s VAL 219 Cb -0.16 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 3ddj s VAL 219 CO 0.14 -0.02 0.12 0.42 0.00 0.00 0.00 175.10 175.75 3ddj s THR 220 N 1.47 3.20 -0.00 3.92 -4.23 -1.26 -1.47 115.64 117.27 3ddj s THR 220 Ca 0.01 -1.72 -0.11 0.00 -1.18 0.00 0.00 61.69 58.70 3ddj s THR 220 Cb -0.18 -2.98 0.01 0.00 1.34 0.00 0.00 72.50 70.69 3ddj s THR 220 CO 0.03 -0.23 0.21 -0.51 -0.54 0.00 0.00 174.62 173.58 3ddj s ILE 221 N -2.39 0.07 0.19 2.99 2.07 -0.58 -4.86 121.20 118.69 3ddj s ILE 221 Ca 0.36 -0.60 -0.30 0.00 -1.41 0.00 0.00 60.65 58.70 3ddj s ILE 221 Cb -0.04 -0.51 -0.08 0.00 0.13 0.00 0.00 42.46 41.96 3ddj s ILE 221 CO 0.22 -0.33 1.25 -0.62 -1.91 0.00 0.00 174.94 173.56 3ddj s ASP 222 N -1.37 6.99 0.48 4.50 -1.08 -1.26 -4.47 116.67 120.45 3ddj s ASP 222 Ca -0.14 2.31 0.32 0.00 -0.52 0.00 0.00 52.55 54.53 3ddj s ASP 222 Cb -0.07 -2.61 1.66 0.00 -1.46 0.00 0.00 42.92 40.45 3ddj s ASP 222 CO 0.03 -0.45 1.99 1.05 0.52 0.00 0.00 175.17 178.30 3ddj h GLU 223 N 5.33 0.00 -0.01 4.34 4.11 -1.96 -2.06 114.58 124.33 3ddj h GLU 223 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 3ddj h GLU 223 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3ddj h GLU 223 CO 0.76 0.00 -0.43 1.28 0.07 0.00 0.00 179.01 180.68 3ddj n LEU 224 N -2.68 1.05 -4.76 3.06 4.77 -1.26 -0.17 117.00 117.02 3ddj n LEU 224 Ca -0.01 -0.30 -0.35 0.00 -0.03 0.00 0.00 56.01 55.32 3ddj n LEU 224 Cb 0.11 -0.12 0.04 0.00 -2.33 0.00 0.00 43.42 41.12 3ddj n LEU 224 CO 0.17 0.21 0.79 0.00 -1.33 0.00 0.00 177.39 177.23 3ddj s ALA 225 N -2.68 2.48 0.59 -1.18 0.00 -0.78 -4.71 121.76 115.49 3ddj s ALA 225 Ca 0.18 0.81 -0.18 0.00 0.00 0.00 0.00 51.96 52.77 3ddj s ALA 225 Cb 0.18 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 3ddj s ALA 225 CO 0.61 -1.23 1.16 -1.54 0.00 0.00 0.00 175.76 174.76 3ddj s SER 226 N -2.00 5.35 0.58 0.00 1.04 -1.26 -0.58 113.70 116.83 3ddj s SER 226 Ca 0.73 2.24 0.29 0.00 0.48 0.00 0.00 55.95 59.69 3ddj s SER 226 Cb -0.26 -2.58 1.79 0.00 0.10 0.00 0.00 66.02 65.07 3ddj s SER 226 CO 0.36 -1.48 2.25 -0.37 0.98 0.00 0.00 173.24 174.98 3ddj h VAL 227 N 0.83 0.54 -0.31 5.02 -1.51 -1.18 -2.22 116.25 117.42 3ddj h VAL 227 Ca -0.50 -0.03 -0.04 0.00 -1.23 0.00 0.00 66.70 64.90 3ddj h VAL 227 Cb 1.27 1.02 -0.01 0.00 -2.13 0.00 0.00 31.29 31.44 3ddj h VAL 227 CO 0.55 0.01 0.04 0.78 -1.23 0.00 0.00 177.57 177.72 3ddj h ASN 228 N 0.00 0.50 -0.86 4.19 4.21 -1.91 -0.31 115.58 121.40 3ddj h ASN 228 Ca -0.00 -0.27 0.00 0.00 1.21 0.00 0.00 56.30 57.25 3ddj h ASN 228 Cb 0.02 -0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 37.04 3ddj h ASN 228 CO 0.00 0.64 0.55 0.03 -1.29 0.00 0.00 177.43 177.37 3ddj h ARG 229 N 0.34 1.14 -0.14 0.81 3.08 -1.82 -1.22 114.38 116.57 3ddj h ARG 229 Ca 0.09 -0.08 0.03 0.00 0.07 0.00 0.00 59.98 60.09 3ddj h ARG 229 Cb 0.36 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3ddj h ARG 229 CO 0.01 0.77 -0.06 0.00 -1.07 0.00 0.00 179.97 179.62 3ddj h ALA 230 N 1.30 0.06 -0.42 0.04 0.00 -1.09 -1.55 119.26 117.61 3ddj h ALA 230 Ca 0.31 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.33 3ddj h ALA 230 Cb -0.11 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3ddj h ALA 230 CO -0.07 -0.51 0.14 0.00 0.00 0.00 0.00 179.25 178.82 3ddj h ALA 231 N 1.09 0.50 -0.77 0.00 0.00 -0.76 -2.86 119.26 116.46 3ddj h ALA 231 Ca 0.07 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ddj h ALA 231 Cb 0.15 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3ddj h ALA 231 CO -0.17 -0.25 0.46 0.00 0.00 0.00 0.00 179.25 179.30 3ddj h ALA 232 N 1.28 0.98 0.00 0.00 0.00 -1.02 -1.68 119.26 118.81 3ddj h ALA 232 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ddj h ALA 232 Cb 0.19 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3ddj h ALA 232 CO -0.21 0.45 0.00 -1.91 0.00 0.00 0.00 179.25 177.58 3ddj n GLU 233 N -4.49 0.46 0.00 0.00 2.13 -0.60 -1.60 120.64 116.55 3ddj n GLU 233 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 3ddj n GLU 233 Cb 0.06 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 30.50 3ddj n GLU 233 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 3ddj n ILE 235 N 0.75 0.00 -0.22 6.31 5.41 -0.63 -0.61 119.36 130.36 3ddj n ILE 235 Ca 0.00 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.67 3ddj n ILE 235 Cb 0.23 0.00 0.03 0.00 -0.71 0.00 0.00 39.64 39.18 3ddj n ILE 235 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 176.55 176.18 3ddj h VAL 236 N 0.00 1.26 -0.01 1.39 -1.51 -1.58 -2.65 116.25 113.16 3ddj h VAL 236 Ca 0.00 -1.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.45 3ddj h VAL 236 Cb 0.00 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 29.88 3ddj h VAL 236 CO 0.00 0.38 -0.11 0.29 -1.23 0.00 0.00 177.57 176.90 3ddj n LYS 237 N -4.27 0.84 -3.65 5.19 4.76 0.22 -4.94 118.16 116.31 3ddj n LYS 237 Ca 0.03 -0.33 -0.21 0.00 -2.87 0.00 0.00 58.31 54.94 3ddj n LYS 237 Cb 0.29 -1.49 0.04 0.00 -1.84 0.00 0.00 35.03 32.03 3ddj n LYS 237 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3ddj n ARG 238 N -0.80 -4.68 -4.20 1.97 1.74 -1.00 -4.99 116.66 104.71 3ddj n ARG 238 Ca 0.15 0.64 -0.12 0.00 -0.77 0.00 0.00 57.85 57.76 3ddj n ARG 238 Cb 0.28 -5.20 -0.10 0.00 -1.02 0.00 0.00 32.46 26.42 3ddj n ARG 238 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 3ddj s ILE 239 N -3.62 0.49 -0.83 0.55 -4.36 -1.26 -5.06 121.20 107.12 3ddj s ILE 239 Ca 0.06 -1.94 0.09 0.00 -0.26 0.00 0.00 60.65 58.59 3ddj s ILE 239 Cb -0.01 -2.01 0.23 0.00 1.25 0.00 0.00 42.46 41.91 3ddj s ILE 239 CO 0.80 -0.55 1.15 0.61 0.24 0.00 0.00 174.94 177.19 3ddj n GLY 240 N -0.16 2.31 3.32 6.27 0.00 -1.26 -4.60 105.19 111.07 3ddj n GLY 240 Ca -0.07 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 3ddj n GLY 240 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ddj s SER 241 N -0.97 -0.27 0.00 1.61 1.04 -1.26 -1.08 113.70 112.77 3ddj s SER 241 Ca 0.18 -0.04 0.03 0.00 0.48 0.00 0.00 55.95 56.60 3ddj s SER 241 Cb 0.10 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.63 3ddj s SER 241 CO 0.13 -0.68 -0.10 -0.76 0.98 0.00 0.00 173.24 172.80 3ddj s LEU 242 N -2.09 2.05 0.08 2.42 1.43 -0.11 -4.92 118.68 117.54 3ddj s LEU 242 Ca -0.04 -0.24 -0.14 0.00 -1.03 0.00 0.00 54.13 52.68 3ddj s LEU 242 Cb -0.01 -0.50 -0.06 0.00 0.03 0.00 0.00 46.19 45.65 3ddj s LEU 242 CO -0.03 0.09 0.47 -0.76 0.23 0.00 0.00 176.35 176.35 3ddj s LEU 243 N -0.44 4.41 -0.23 1.79 1.43 -0.54 -1.76 118.68 123.34 3ddj s LEU 243 Ca 0.03 1.00 -0.05 0.00 -1.03 0.00 0.00 54.13 54.08 3ddj s LEU 243 Cb -0.05 -2.95 -0.01 0.00 0.03 0.00 0.00 46.19 43.21 3ddj s LEU 243 CO -0.00 0.21 -0.02 -0.63 0.23 0.00 0.00 176.35 176.14 3ddj s ILE 244 N -1.29 3.57 0.08 -0.59 1.09 0.35 -1.53 121.20 122.88 3ddj s ILE 244 Ca 0.31 -0.42 0.05 0.00 -1.10 0.00 0.00 60.65 59.49 3ddj s ILE 244 Cb -0.16 -2.64 -0.04 0.00 -1.06 0.00 0.00 42.46 38.57 3ddj s ILE 244 CO 0.17 0.41 -0.03 -0.76 -0.10 0.00 0.00 174.94 174.63 3ddj s LEU 245 N 1.49 3.36 0.86 2.97 1.43 -1.26 -0.76 118.68 126.76 3ddj s LEU 245 Ca 0.06 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 3ddj s LEU 245 Cb -0.14 -2.08 0.11 0.00 0.03 0.00 0.00 46.19 44.11 3ddj s LEU 245 CO -0.02 0.19 1.12 0.20 0.23 0.00 0.00 176.35 178.07 3ddj s ASN 246 N -2.15 3.95 0.45 2.29 0.01 0.14 -4.75 114.94 114.88 3ddj s ASN 246 Ca 0.24 1.12 0.14 0.00 -0.71 0.00 0.00 52.86 53.65 3ddj s ASN 246 Cb -0.11 -1.77 1.08 0.00 0.41 0.00 0.00 41.25 40.85 3ddj s ASN 246 CO 0.16 -2.29 2.02 0.07 -1.51 0.00 0.00 177.10 175.55 3ddj h LYS 247 N -1.31 0.32 -0.28 -0.60 2.10 -2.00 -0.41 116.57 114.39 3ddj h LYS 247 Ca -0.49 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 3ddj h LYS 247 Cb 1.30 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 3ddj h LYS 247 CO 0.61 0.21 0.00 -0.40 -2.00 0.00 0.00 179.45 177.87 3ddj n ASP 248 N -4.47 1.48 -0.32 7.07 5.68 -1.26 -4.90 116.55 119.83 3ddj n ASP 248 Ca 0.07 -2.00 -0.04 0.00 -0.50 0.00 0.00 54.79 52.31 3ddj n ASP 248 Cb 0.30 -0.19 -0.02 0.00 -1.14 0.00 0.00 41.12 40.07 3ddj n ASP 248 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3ddj n ASN 249 N 0.31 -4.03 -4.88 -1.12 3.02 -0.16 -4.87 115.26 103.51 3ddj n ASN 249 Ca 0.09 0.10 -0.30 0.00 -0.03 0.00 0.00 54.58 54.44 3ddj n ASN 249 Cb 0.23 -1.90 0.01 0.00 -0.61 0.00 0.00 39.78 37.52 3ddj n ASN 249 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3ddj s THR 250 N -1.98 4.50 0.15 3.41 -4.23 -1.26 -1.63 115.64 114.60 3ddj s THR 250 Ca 0.00 0.66 -0.30 0.00 -1.18 0.00 0.00 61.69 60.87 3ddj s THR 250 Cb 0.00 -3.79 -0.07 0.00 1.34 0.00 0.00 72.50 69.98 3ddj s THR 250 CO 0.00 -0.99 0.98 -0.51 -0.54 0.00 0.00 174.62 173.57 3ddj s ILE 251 N -3.12 4.31 -0.16 2.99 1.10 -1.26 0.27 121.20 125.32 3ddj s ILE 251 Ca 0.54 2.00 -0.04 0.00 -0.51 0.00 0.00 60.65 62.64 3ddj s ILE 251 Cb -0.11 -4.27 -0.09 0.00 0.15 0.00 0.00 42.46 38.14 3ddj s ILE 251 CO 0.52 0.34 -0.18 -1.14 -2.11 0.00 0.00 174.94 172.37 3ddj n ARG 252 N 2.47 0.38 -3.83 3.50 0.63 0.06 -4.72 116.66 115.14 3ddj n ARG 252 Ca 0.02 0.12 -0.08 0.00 -0.92 0.00 0.00 57.85 56.99 3ddj n ARG 252 Cb 0.48 -1.21 0.01 0.00 0.45 0.00 0.00 32.46 32.19 3ddj n ARG 252 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3ddj s GLY 253 N -5.42 0.17 -0.02 5.14 0.00 -0.57 -4.53 107.32 102.10 3ddj s GLY 253 Ca -0.22 -0.55 0.01 0.00 0.00 0.00 0.00 44.72 43.95 3ddj s GLY 253 CO 0.33 -0.16 -0.03 -1.50 0.00 0.00 0.00 173.10 171.74 3ddj s ILE 254 N -2.95 0.32 -0.06 0.90 2.07 -0.58 -0.49 121.20 120.40 3ddj s ILE 254 Ca 0.14 -0.10 0.04 0.00 -1.41 0.00 0.00 60.65 59.32 3ddj s ILE 254 Cb -0.05 -0.32 -0.00 0.00 0.13 0.00 0.00 42.46 42.22 3ddj s ILE 254 CO 0.09 0.13 -0.20 -0.51 -1.91 0.00 0.00 174.94 172.54 3ddj s ILE 255 N 0.34 1.70 0.38 2.00 2.07 -0.72 -0.70 121.20 126.28 3ddj s ILE 255 Ca -0.04 -0.84 0.07 0.00 -1.41 0.00 0.00 60.65 58.43 3ddj s ILE 255 Cb -0.07 -1.47 -0.07 0.00 0.13 0.00 0.00 42.46 40.98 3ddj s ILE 255 CO -0.01 0.48 0.00 0.42 -1.91 0.00 0.00 174.94 173.93 3ddj s THR 256 N 0.17 1.86 0.55 4.00 -4.23 -1.26 -0.93 115.64 115.79 3ddj s THR 256 Ca -0.09 -2.03 0.32 0.00 -1.18 0.00 0.00 61.69 58.70 3ddj s THR 256 Cb -0.14 -2.90 0.35 0.00 1.34 0.00 0.00 72.50 71.15 3ddj s THR 256 CO 0.05 -0.04 2.22 1.05 -0.54 0.00 0.00 174.62 177.36 3ddj h GLU 257 N 1.89 0.00 -0.24 3.99 4.11 -1.48 -1.06 114.58 121.78 3ddj h GLU 257 Ca -0.43 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.97 3ddj h GLU 257 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3ddj h GLU 257 CO 0.77 0.03 0.02 -0.09 0.07 0.00 0.00 179.01 179.82 3ddj h ARG 258 N 0.00 0.42 -0.88 1.06 9.65 -1.94 -1.80 114.38 120.88 3ddj h ARG 258 Ca -0.00 -0.12 0.04 0.00 -1.10 0.00 0.00 59.98 58.80 3ddj h ARG 258 Cb 0.10 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 3ddj h ARG 258 CO 0.00 0.57 0.56 -0.44 2.80 0.00 0.00 179.97 183.46 3ddj h ASP 259 N 0.21 0.93 -0.01 -3.80 3.32 -1.59 -1.29 116.42 114.18 3ddj h ASP 259 Ca 0.07 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 3ddj h ASP 259 Cb 0.36 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3ddj h ASP 259 CO 0.01 0.63 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.90 3ddj h LEU 260 N 1.09 0.37 -0.44 1.55 3.38 -1.16 -0.55 115.31 119.54 3ddj h LEU 260 Ca 0.35 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 3ddj h LEU 260 Cb 0.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3ddj h LEU 260 CO -0.13 0.58 -0.03 0.25 0.09 0.00 0.00 178.44 179.21 3ddj h LEU 261 N 0.34 0.79 -0.22 1.67 5.85 -0.73 0.18 115.31 123.21 3ddj h LEU 261 Ca 0.06 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.47 3ddj h LEU 261 Cb 0.54 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3ddj h LEU 261 CO 0.04 0.93 0.11 0.40 -0.34 0.00 0.00 178.44 179.58 3ddj h ILE 262 N 0.64 1.01 -0.76 4.05 2.04 -0.99 -1.38 117.51 122.11 3ddj h ILE 262 Ca 0.12 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.91 3ddj h ILE 262 Cb 0.54 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 3ddj h ILE 262 CO 0.03 0.04 0.51 0.00 0.00 0.00 0.00 178.15 178.73 3ddj h ALA 263 N 1.10 0.97 -0.76 1.87 0.00 -1.04 -2.14 119.26 119.27 3ddj h ALA 263 Ca 0.09 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3ddj h ALA 263 Cb 0.01 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3ddj h ALA 263 CO -0.05 0.39 0.38 1.25 0.00 0.00 0.00 179.25 181.22 3ddj h LEU 264 N 1.04 0.98 -0.27 0.00 5.85 -0.56 0.18 115.31 122.53 3ddj h LEU 264 Ca 0.28 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.91 3ddj h LEU 264 Cb -0.12 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.63 3ddj h LEU 264 CO -0.06 0.82 0.07 -0.74 -0.34 0.00 0.00 178.44 178.19 3ddj h HIS 265 N 1.06 0.13 -0.49 1.25 2.76 -0.99 -0.11 115.15 118.77 3ddj h HIS 265 Ca 0.26 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.44 3ddj h HIS 265 Cb 0.09 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 3ddj h HIS 265 CO 0.01 0.05 0.29 0.45 -1.30 0.00 0.00 177.93 177.43 3ddj h HIS 266 N 0.19 0.64 -0.46 5.26 3.86 -0.92 -0.86 115.15 122.86 3ddj h HIS 266 Ca 0.12 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.35 3ddj h HIS 266 Cb 0.11 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.34 3ddj h HIS 266 CO -0.14 0.45 0.28 0.82 0.86 0.00 0.00 177.93 180.19 3ddj h ILE 267 N 0.65 1.05 -0.14 2.45 2.04 -0.58 -3.19 117.51 119.80 3ddj h ILE 267 Ca 0.17 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 3ddj h ILE 267 Cb -0.00 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 3ddj h ILE 267 CO -0.03 0.10 -0.00 -0.07 0.00 0.00 0.00 178.15 178.15 3ddj h LEU 268 N 0.56 0.24 -1.25 1.44 3.38 -0.81 0.06 115.31 118.93 3ddj h LEU 268 Ca 0.18 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3ddj h LEU 268 Cb 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3ddj h LEU 268 CO -0.08 0.50 0.00 0.52 0.09 0.00 0.00 178.44 179.47 3ddj n VAL 269 N -4.76 0.00 0.00 1.22 0.31 -0.35 -2.00 118.33 112.75 3ddj n VAL 269 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 3ddj n VAL 269 Cb 0.22 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.05 3ddj n VAL 269 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3ddj n GLU 271 N 0.53 0.00 -0.14 5.55 1.02 0.01 -2.89 120.64 124.72 3ddj n GLU 271 Ca 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.06 3ddj n GLU 271 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3ddj n GLU 271 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3ddj h LYS 272 N 0.00 0.60 -0.23 3.49 1.57 -1.66 -3.16 116.57 117.18 3ddj h LYS 272 Ca 0.00 -0.08 -0.20 0.00 -1.87 0.00 0.00 60.65 58.50 3ddj h LYS 272 Cb 0.00 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.20 3ddj h LYS 272 CO 0.00 0.50 -0.64 0.74 -0.57 0.00 0.00 179.45 179.48 3ddj h PHE 273 N 0.55 1.08 0.00 -1.35 0.04 -1.83 -3.29 116.94 112.14 3ddj h PHE 273 Ca 0.15 -0.43 -0.03 0.00 2.80 0.00 0.00 57.97 60.47 3ddj h PHE 273 Cb 0.08 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 3ddj h PHE 273 CO -0.02 1.26 -0.12 -0.22 -0.60 0.00 0.00 178.31 178.61 3ddj h LYS 274 N 0.59 0.00 0.00 1.51 3.64 -1.88 -0.72 116.57 119.72 3ddj h LYS 274 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3ddj h LYS 274 Cb 1.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3ddj h LYS 274 CO 0.14 0.12 0.00 -0.85 -2.27 0.00 0.00 179.45 176.59 3ddj n GLU 275 N -3.99 0.10 0.00 1.90 0.28 -1.20 -5.11 120.64 112.63 3ddj n GLU 275 Ca -0.02 0.24 0.05 0.00 -0.16 0.00 0.00 57.16 57.26 3ddj n GLU 275 Cb 0.21 -1.65 0.27 0.00 1.43 0.00 0.00 31.44 31.70 3ddj n GLU 275 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60