#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cue n THR 18 N 0.00 0.00 -4.48 5.15 -2.24 -1.26 -4.63 114.28 106.82 1cue n THR 18 Ca 0.00 -0.03 -0.27 0.00 -2.27 0.00 0.00 64.05 61.47 1cue n THR 18 Cb 0.00 -0.18 -0.17 0.00 -2.10 0.00 0.00 70.33 67.89 1cue n THR 18 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1cue s THR 19 N -2.65 1.36 -0.07 4.28 2.01 -1.26 0.22 115.64 119.53 1cue s THR 19 Ca 0.24 -0.57 -0.03 0.00 0.31 0.00 0.00 61.69 61.64 1cue s THR 19 Cb 0.20 -1.25 0.04 0.00 0.01 0.00 0.00 72.50 71.50 1cue s THR 19 CO 0.51 0.41 0.15 -0.13 -0.69 0.00 0.00 174.62 174.87 1cue s ARG 20 N 0.92 0.09 -0.34 4.92 1.81 -1.26 -4.95 118.95 120.15 1cue s ARG 20 Ca -0.09 0.39 0.15 0.00 -1.72 0.00 0.00 55.73 54.47 1cue s ARG 20 Cb -0.15 -0.19 0.46 0.00 -0.45 0.00 0.00 34.95 34.62 1cue s ARG 20 CO 0.00 -0.18 1.02 -0.25 -0.68 0.00 0.00 175.30 175.21 1cue n ASP 21 N 4.32 2.29 0.00 0.23 8.00 -1.25 -1.80 116.55 128.35 1cue n ASP 21 Ca -0.24 -2.87 0.00 0.00 0.71 0.00 0.00 54.79 52.39 1cue n ASP 21 Cb 0.51 -0.50 0.31 0.00 -0.02 0.00 0.00 41.12 41.42 1cue n ASP 21 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1cue h ASP 22 N 2.82 0.48 -0.13 -2.24 3.32 -1.70 -0.63 116.42 118.35 1cue h ASP 22 Ca -0.00 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 56.89 1cue h ASP 22 Cb 1.16 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1cue h ASP 22 CO 0.54 0.54 -0.23 0.25 -1.72 0.00 0.00 179.24 178.62 1cue h LEU 23 N 0.50 0.42 -0.70 1.55 5.85 -1.91 0.21 115.31 121.23 1cue h LEU 23 Ca 0.11 -0.55 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 1cue h LEU 23 Cb 0.30 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1cue h LEU 23 CO 0.01 0.89 0.31 0.40 -0.34 0.00 0.00 178.44 179.70 1cue h ILE 24 N -0.03 1.24 0.00 4.05 2.04 -1.90 -2.59 117.51 120.32 1cue h ILE 24 Ca 0.01 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1cue h ILE 24 Cb 0.81 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1cue h ILE 24 CO 0.05 0.29 -0.22 0.78 0.00 0.00 0.00 178.15 179.06 1cue h ASN 25 N 0.99 0.00 -3.97 1.72 2.35 -1.13 -3.47 115.58 112.07 1cue h ASN 25 Ca 0.24 -0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.47 1cue h ASN 25 Cb 0.17 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.61 1cue h ASN 25 CO -0.02 0.00 0.53 -0.83 -1.65 0.00 0.00 177.43 175.46 1cue s GLY 26 N -4.23 2.85 -0.07 2.83 0.00 0.74 -4.98 107.32 104.47 1cue s GLY 26 Ca 0.05 1.05 -0.23 0.00 0.00 0.00 0.00 44.72 45.59 1cue s GLY 26 CO 0.69 1.56 0.68 -1.31 0.00 0.00 0.00 173.10 174.72 1cue s ASN 27 N -1.10 6.96 0.36 1.64 -0.87 -1.26 -4.93 114.94 115.75 1cue s ASN 27 Ca 0.60 1.16 0.03 0.00 -1.57 0.00 0.00 52.86 53.08 1cue s ASN 27 Cb -0.33 -2.40 0.67 0.00 -0.02 0.00 0.00 41.25 39.17 1cue s ASN 27 CO 0.40 -0.09 2.02 -1.28 -2.57 0.00 0.00 177.10 175.58 1cue h SER 28 N 6.69 0.69 0.73 -1.22 0.87 -1.94 -1.19 113.55 118.18 1cue h SER 28 Ca -0.41 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 1cue h SER 28 Cb 1.20 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1cue h SER 28 CO 0.75 0.50 0.00 0.00 -0.53 0.00 0.00 176.83 177.55 1cue h ALA 29 N 1.62 1.00 -2.12 6.23 0.00 -1.91 -3.16 119.26 120.92 1cue h ALA 29 Ca 0.22 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.57 1cue h ALA 29 Cb -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.29 1cue h ALA 29 CO -0.05 0.00 -0.76 -1.13 0.00 0.00 0.00 179.25 177.31 1cue n SER 30 N -2.63 3.79 -4.73 0.00 3.41 -0.46 -5.08 113.62 107.92 1cue n SER 30 Ca 0.01 -3.55 -0.42 0.00 -0.26 0.00 0.00 58.87 54.65 1cue n SER 30 Cb 0.23 -0.56 -0.03 0.00 -0.26 0.00 0.00 64.21 63.60 1cue n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cue s ALA 32 N 0.78 1.04 -0.10 0.00 0.00 -1.26 -4.98 121.76 117.24 1cue s ALA 32 Ca 0.70 -0.19 0.15 0.00 0.00 0.00 0.00 51.96 52.62 1cue s ALA 32 Cb -0.48 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 19.37 1cue s ALA 32 CO 0.37 -2.76 1.02 -0.44 0.00 0.00 0.00 175.76 173.95 1cue h ASP 33 N -1.84 0.00 -3.57 0.00 3.32 -1.52 -3.43 116.42 109.38 1cue h ASP 33 Ca -0.53 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.05 1cue h ASP 33 Cb 1.31 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.53 1cue h ASP 33 CO 0.55 0.63 -0.80 -0.69 -1.72 0.00 0.00 179.24 177.21 1cue s VAL 34 N -2.89 0.91 -0.13 -1.35 1.01 -0.99 -0.37 120.40 116.59 1cue s VAL 34 Ca -0.01 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.62 1cue s VAL 34 Cb 0.08 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1cue s VAL 34 CO 0.80 0.30 -0.18 -0.63 0.00 0.00 0.00 175.10 175.38 1cue s ILE 35 N 0.56 1.75 -0.21 2.22 1.01 -0.62 -1.33 121.20 124.58 1cue s ILE 35 Ca -0.10 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 59.69 1cue s ILE 35 Cb -0.13 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 1cue s ILE 35 CO 0.02 0.49 0.07 0.12 0.00 0.00 0.00 174.94 175.64 1cue s PHE 36 N 1.03 3.19 -0.21 3.97 5.36 0.22 -1.42 117.98 130.12 1cue s PHE 36 Ca -0.04 -0.08 -0.04 0.00 -0.96 0.00 0.00 56.93 55.82 1cue s PHE 36 Cb -0.15 -2.15 -0.01 0.00 -0.34 0.00 0.00 43.02 40.37 1cue s PHE 36 CO -0.04 -0.04 -0.05 0.42 -1.46 0.00 0.00 175.22 174.06 1cue s ILE 37 N 0.88 3.42 -0.04 3.12 1.01 -0.84 -0.73 121.20 128.01 1cue s ILE 37 Ca 0.04 -0.49 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1cue s ILE 37 Cb -0.14 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 1cue s ILE 37 CO 0.03 0.44 -0.20 -0.47 0.00 0.00 0.00 174.94 174.73 1cue s TYR 38 N 1.28 1.97 -0.13 3.97 5.04 0.01 -2.65 117.35 126.85 1cue s TYR 38 Ca 0.03 -0.54 -0.01 0.00 -2.44 0.00 0.00 57.07 54.12 1cue s TYR 38 Cb -0.14 -1.31 -0.02 0.00 0.35 0.00 0.00 41.96 40.84 1cue s TYR 38 CO -0.02 -0.16 -0.11 0.00 -1.34 0.00 0.00 175.55 173.92 1cue s ALA 39 N -0.12 2.69 0.79 3.97 0.00 -0.54 -0.94 121.76 127.60 1cue s ALA 39 Ca -0.02 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 50.95 1cue s ALA 39 Cb -0.12 -1.27 0.06 0.00 0.00 0.00 0.00 23.12 21.80 1cue s ALA 39 CO 0.02 0.25 1.16 -0.98 0.00 0.00 0.00 175.76 176.21 1cue s ARG 40 N 0.32 2.17 0.63 0.00 1.70 -1.26 -1.53 118.95 120.99 1cue s ARG 40 Ca -0.09 0.22 -0.08 0.00 -0.47 0.00 0.00 55.73 55.30 1cue s ARG 40 Cb -0.16 -1.96 0.14 0.00 -0.57 0.00 0.00 34.95 32.40 1cue s ARG 40 CO 0.05 -1.47 0.86 0.41 -1.08 0.00 0.00 175.30 174.07 1cue n GLY 41 N -3.18 -0.81 3.76 3.88 0.00 -1.17 -2.30 105.19 105.36 1cue n GLY 41 Ca 0.08 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 1cue n GLY 41 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cue s SER 42 N -4.22 6.82 -0.13 1.61 0.01 -1.26 -3.10 113.70 113.43 1cue s SER 42 Ca 0.51 2.60 0.00 0.00 1.31 0.00 0.00 55.95 60.37 1cue s SER 42 Cb -0.02 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.57 1cue s SER 42 CO 0.35 -0.52 0.00 0.41 0.41 0.00 0.00 173.24 173.89 1cue n THR 43 N 1.30 0.00 -2.29 1.44 -1.04 -0.11 -4.98 114.28 108.60 1cue n THR 43 Ca 0.02 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.73 1cue n THR 43 Cb 0.42 -0.80 -0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1cue n THR 43 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1cue s GLU 44 N -1.60 3.64 0.60 -2.82 2.02 -1.18 -5.05 118.70 114.31 1cue s GLU 44 Ca 0.00 0.55 -0.00 0.00 0.02 0.00 0.00 54.97 55.54 1cue s GLU 44 Cb 0.00 -2.22 0.05 0.00 0.10 0.00 0.00 34.13 32.06 1cue s GLU 44 CO 0.00 -0.36 0.84 0.95 0.02 0.00 0.00 175.26 176.71 1cue s THR 45 N -2.89 2.53 0.00 3.63 -4.23 -1.26 -4.86 115.64 108.57 1cue s THR 45 Ca 0.52 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 60.44 1cue s THR 45 Cb -0.11 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.79 1cue s THR 45 CO 0.46 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 1cue n GLY 46 N -2.50 1.11 0.23 3.99 0.00 -1.26 -1.52 105.19 105.24 1cue n GLY 46 Ca 0.09 -0.58 0.02 0.00 0.00 0.00 0.00 46.02 45.55 1cue n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cue n ASN 47 N -2.95 2.00 -0.02 1.61 2.04 0.13 -4.68 115.26 113.39 1cue n ASN 47 Ca 0.00 -1.70 0.02 0.00 -0.44 0.00 0.00 54.58 52.46 1cue n ASN 47 Cb 0.00 -0.06 -0.10 0.00 -2.53 0.00 0.00 39.78 37.10 1cue n ASN 47 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1cue n LEU 48 N 0.03 0.00 0.00 -4.53 4.77 0.45 -3.76 117.00 113.96 1cue n LEU 48 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1cue n LEU 48 Cb 0.24 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1cue n LEU 48 CO 0.03 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 1cue n GLY 49 N 1.96 1.09 0.13 -0.72 0.00 -0.57 -2.65 105.19 104.43 1cue n GLY 49 Ca -0.08 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.40 1cue n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1cue h THR 50 N 0.00 0.02 0.00 2.61 1.35 -1.98 -3.39 112.91 111.52 1cue h THR 50 Ca 0.00 -1.04 -0.32 0.00 -0.55 0.00 0.00 66.41 64.50 1cue h THR 50 Cb 0.00 1.58 -0.06 0.00 -1.73 0.00 0.00 68.15 67.94 1cue h THR 50 CO 0.00 0.01 -2.21 0.18 -0.25 0.00 0.00 175.52 173.25 1cue n LEU 51 N -2.74 1.59 -0.14 3.87 4.77 -1.26 -4.71 117.00 118.38 1cue n LEU 51 Ca 0.00 -0.06 -0.04 0.00 -0.03 0.00 0.00 56.01 55.88 1cue n LEU 51 Cb 0.56 -0.21 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 1cue n LEU 51 CO 0.39 0.66 0.72 1.23 -1.33 0.00 0.00 177.39 179.06 1cue h GLY 52 N 2.46 0.15 0.31 -0.72 0.00 -1.70 -2.73 103.07 100.84 1cue h GLY 52 Ca -0.47 0.26 0.14 0.00 0.00 0.00 0.00 47.33 47.25 1cue h GLY 52 CO -0.03 -0.21 0.54 -2.55 0.00 0.00 0.00 176.54 174.29 1cue h PRO 53 N -0.10 0.76 -0.16 4.80 0.11 -1.81 -0.36 132.00 135.23 1cue h PRO 53 Ca 0.22 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 1cue h PRO 53 Cb 0.44 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 1cue h PRO 53 CO -0.53 0.50 0.10 0.77 -0.21 0.00 0.00 178.00 178.63 1cue h SER 54 N 0.78 0.19 0.01 -2.05 0.02 -1.78 0.38 113.55 111.10 1cue h SER 54 Ca 0.49 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.41 1cue h SER 54 Cb 0.63 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1cue h SER 54 CO -0.33 0.17 -0.00 0.40 -1.14 0.00 0.00 176.83 175.93 1cue h ILE 55 N 0.20 1.25 -0.63 3.27 2.04 -1.40 -2.84 117.51 119.40 1cue h ILE 55 Ca 0.06 -0.76 0.12 0.00 1.00 0.00 0.00 64.86 65.27 1cue h ILE 55 Cb 0.01 1.77 -0.09 0.00 -0.74 0.00 0.00 36.82 37.77 1cue h ILE 55 CO -0.01 0.20 0.15 0.00 0.00 0.00 0.00 178.15 178.49 1cue h ALA 56 N 0.65 0.77 -0.58 1.87 0.00 -0.80 -1.69 119.26 119.49 1cue h ALA 56 Ca -0.00 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1cue h ALA 56 Cb 0.33 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1cue h ALA 56 CO 0.00 -0.29 0.38 0.77 0.00 0.00 0.00 179.25 180.11 1cue h SER 57 N 0.29 0.65 0.31 0.00 0.02 -0.80 -1.44 113.55 112.59 1cue h SER 57 Ca 0.33 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.18 1cue h SER 57 Cb 0.50 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1cue h SER 57 CO -0.41 0.47 -0.38 0.78 -1.14 0.00 0.00 176.83 176.15 1cue h ASN 58 N 0.78 0.10 -0.18 3.07 2.35 -1.10 -1.31 115.58 119.29 1cue h ASN 58 Ca 0.21 -0.04 -0.20 0.00 -0.55 0.00 0.00 56.30 55.73 1cue h ASN 58 Cb -0.08 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1cue h ASN 58 CO -0.05 0.48 -0.63 -0.07 -1.65 0.00 0.00 177.43 175.51 1cue h LEU 59 N 0.09 0.91 -0.78 1.61 3.38 -0.50 -1.93 115.31 118.08 1cue h LEU 59 Ca 0.01 -0.53 0.06 0.00 0.09 0.00 0.00 57.88 57.51 1cue h LEU 59 Cb 0.72 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 1cue h LEU 59 CO 0.05 1.31 0.47 -0.33 0.09 0.00 0.00 178.44 180.04 1cue h GLU 60 N 0.58 0.83 -0.58 1.13 5.08 -1.10 -1.02 114.58 119.51 1cue h GLU 60 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1cue h GLU 60 Cb 1.24 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.28 1cue h GLU 60 CO 0.13 0.55 0.37 0.77 -1.00 0.00 0.00 179.01 179.84 1cue h SER 61 N 0.86 0.67 0.07 1.42 0.02 -0.93 0.57 113.55 116.24 1cue h SER 61 Ca 0.34 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.17 1cue h SER 61 Cb 0.17 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1cue h SER 61 CO -0.17 0.50 -0.30 0.00 -1.14 0.00 0.00 176.83 175.71 1cue h ALA 62 N 1.20 1.16 0.00 3.77 0.00 -0.52 -3.35 119.26 121.51 1cue h ALA 62 Ca 0.21 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1cue h ALA 62 Cb -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1cue h ALA 62 CO -0.04 0.54 0.00 1.19 0.00 0.00 0.00 179.25 180.94 1cue n PHE 63 N -4.10 0.00 0.00 0.00 3.72 -0.48 -5.12 117.46 111.49 1cue n PHE 63 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1cue n PHE 63 Cb 0.42 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 1cue n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1cue n GLY 64 N 0.56 -0.92 0.33 1.37 0.00 0.20 -3.31 105.19 103.42 1cue n GLY 64 Ca 0.00 -1.50 0.09 0.00 0.00 0.00 0.00 46.02 44.61 1cue n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cue h LYS 65 N 0.00 0.70 -0.00 1.61 1.79 -1.91 -1.04 116.57 117.71 1cue h LYS 65 Ca 0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1cue h LYS 65 Cb 0.00 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.49 1cue h LYS 65 CO 0.00 0.46 -0.27 -0.25 -1.08 0.00 0.00 179.45 178.31 1cue n ASP 66 N -4.81 0.44 0.03 0.86 8.00 -1.26 -3.72 116.55 116.09 1cue n ASP 66 Ca 0.19 -0.22 0.13 0.00 0.71 0.00 0.00 54.79 55.60 1cue n ASP 66 Cb 0.47 -0.01 0.37 0.00 -0.02 0.00 0.00 41.12 41.93 1cue n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cue n GLY 67 N 1.44 -1.42 2.78 0.44 0.00 -0.40 -4.43 105.19 103.60 1cue n GLY 67 Ca 0.08 -0.21 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 1cue n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cue s VAL 68 N -3.05 -0.20 -0.11 1.61 0.11 -1.21 -1.54 120.40 116.01 1cue s VAL 68 Ca 0.11 0.38 -0.16 0.00 -2.93 0.00 0.00 61.98 59.37 1cue s VAL 68 Cb 0.16 -0.24 -0.05 0.00 -1.53 0.00 0.00 36.38 34.73 1cue s VAL 68 CO 0.64 0.16 0.41 0.26 -3.33 0.00 0.00 175.10 173.24 1cue s TRP 69 N 2.22 3.53 -0.18 1.54 0.51 -0.44 -4.91 118.94 121.21 1cue s TRP 69 Ca 0.03 0.82 -0.02 0.00 -2.12 0.00 0.00 56.10 54.82 1cue s TRP 69 Cb -0.12 -2.45 -0.00 0.00 -0.81 0.00 0.00 33.47 30.09 1cue s TRP 69 CO -0.05 0.27 -0.11 -1.50 -0.51 0.00 0.00 176.95 175.05 1cue s ILE 70 N 0.30 2.97 -0.16 2.03 1.10 -1.26 -0.61 121.20 125.57 1cue s ILE 70 Ca 0.23 -0.65 0.00 0.00 -0.51 0.00 0.00 60.65 59.72 1cue s ILE 70 Cb -0.15 -2.30 0.03 0.00 0.15 0.00 0.00 42.46 40.19 1cue s ILE 70 CO 0.09 0.48 -0.11 -1.58 -2.11 0.00 0.00 174.94 171.71 1cue s GLN 71 N 1.09 2.01 0.37 3.50 2.00 0.09 -1.65 119.66 127.06 1cue s GLN 71 Ca 0.00 -0.59 -0.04 0.00 -2.00 0.00 0.00 55.36 52.73 1cue s GLN 71 Cb -0.15 -2.11 -0.04 0.00 0.80 0.00 0.00 33.01 31.51 1cue s GLN 71 CO -0.03 -0.32 0.63 0.20 -0.50 0.00 0.00 175.29 175.27 1cue s GLY 72 N 1.51 1.60 -0.47 2.59 0.00 -0.74 -0.81 107.32 111.01 1cue s GLY 72 Ca 0.03 -0.63 -0.25 0.00 0.00 0.00 0.00 44.72 43.87 1cue s GLY 72 CO -0.09 -0.52 0.90 0.14 0.00 0.00 0.00 173.10 173.52 1cue s VAL 73 N -2.35 4.50 0.00 1.40 1.01 -0.12 -4.82 120.40 120.02 1cue s VAL 73 Ca 0.44 0.63 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1cue s VAL 73 Cb -0.10 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 31.86 1cue s VAL 73 CO 0.36 -0.84 0.00 0.61 0.00 0.00 0.00 175.10 175.23 1cue n GLY 74 N 4.97 1.37 7.00 4.51 0.00 -1.26 -4.75 105.19 117.02 1cue n GLY 74 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1cue n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cue n GLY 75 N 5.00 2.91 0.13 -0.02 0.00 -1.26 -0.48 105.19 111.47 1cue n GLY 75 Ca 0.00 0.30 0.13 0.00 0.00 0.00 0.00 46.02 46.45 1cue n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cue h ALA 76 N -0.71 1.00 -1.65 4.61 0.00 -1.95 -3.41 119.26 117.15 1cue h ALA 76 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1cue h ALA 76 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 1cue h ALA 76 CO 0.00 0.00 0.92 -0.47 0.00 0.00 0.00 179.25 179.70 1cue s TYR 77 N -3.17 2.68 -0.39 0.00 5.04 0.37 -4.57 117.35 117.31 1cue s TYR 77 Ca 0.09 0.44 0.23 0.00 -2.44 0.00 0.00 57.07 55.39 1cue s TYR 77 Cb 0.11 -4.44 0.18 0.00 0.35 0.00 0.00 41.96 38.16 1cue s TYR 77 CO 0.56 -1.48 1.26 -0.09 -1.34 0.00 0.00 175.55 174.46 1cue h ARG 78 N 9.44 0.00 -6.23 4.97 9.65 -1.85 -3.43 114.38 126.93 1cue h ARG 78 Ca -0.25 0.00 -0.45 0.00 -1.10 0.00 0.00 59.98 58.19 1cue h ARG 78 Cb 1.06 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.65 1cue h ARG 78 CO 1.16 0.00 -0.83 0.00 2.80 0.00 0.00 179.97 183.10 1cue n ALA 79 N -2.07 -1.88 -2.56 2.80 0.00 -1.26 -4.81 120.51 110.74 1cue n ALA 79 Ca 0.02 -0.13 -0.43 0.00 0.00 0.00 0.00 53.44 52.90 1cue n ALA 79 Cb 0.52 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.66 1cue n ALA 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cue s THR 80 N -3.67 4.51 0.28 0.00 2.01 -1.26 -0.93 115.64 116.58 1cue s THR 80 Ca 0.13 1.82 0.01 0.00 0.31 0.00 0.00 61.69 63.96 1cue s THR 80 Cb -0.06 -4.17 0.31 0.00 0.01 0.00 0.00 72.50 68.58 1cue s THR 80 CO 0.83 -0.11 1.64 0.25 -0.69 0.00 0.00 174.62 176.55 1cue h LEU 81 N 9.13 -0.04 -1.75 4.42 5.85 -1.93 -1.13 115.31 129.86 1cue h LEU 81 Ca -0.25 0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.73 1cue h LEU 81 Cb 1.10 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 1cue h LEU 81 CO 0.94 -0.16 0.29 1.23 -0.34 0.00 0.00 178.44 180.40 1cue h GLY 82 N 0.20 0.38 1.91 3.75 0.00 -2.03 -2.36 103.07 104.92 1cue h GLY 82 Ca 0.54 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1cue h GLY 82 CO -0.66 0.09 0.00 1.22 0.00 0.00 0.00 176.54 177.19 1cue n ASP 83 N -4.47 0.00 0.31 0.19 8.00 -0.43 -1.52 116.55 118.63 1cue n ASP 83 Ca 0.06 0.43 0.20 0.00 0.71 0.00 0.00 54.79 56.18 1cue n ASP 83 Cb 0.28 -0.46 0.94 0.00 -0.02 0.00 0.00 41.12 41.86 1cue n ASP 83 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1cue h ASN 84 N 0.00 0.00 0.68 -2.24 2.35 -1.58 -2.22 115.58 112.56 1cue h ASN 84 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1cue h ASN 84 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1cue h ASN 84 CO 0.00 0.01 -0.24 0.00 -1.65 0.00 0.00 177.43 175.55 1cue n ALA 85 N -2.10 2.94 -1.28 -0.83 0.00 -0.57 -4.35 120.51 114.33 1cue n ALA 85 Ca -0.01 -0.24 -0.32 0.00 0.00 0.00 0.00 53.44 52.87 1cue n ALA 85 Cb 0.20 -1.29 0.09 0.00 0.00 0.00 0.00 19.45 18.44 1cue n ALA 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cue s LEU 86 N -2.92 3.17 0.28 0.00 1.02 -0.85 -4.87 118.68 114.52 1cue s LEU 86 Ca 0.15 2.02 -0.08 0.00 0.02 0.00 0.00 54.13 56.24 1cue s LEU 86 Cb 0.18 -4.55 0.46 0.00 0.02 0.00 0.00 46.19 42.30 1cue s LEU 86 CO 0.60 -2.09 1.57 -0.65 0.02 0.00 0.00 176.35 175.80 1cue h PRO 87 N -0.70 0.00 -0.59 1.29 0.11 -1.89 0.73 132.00 130.95 1cue h PRO 87 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1cue h PRO 87 Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1cue h PRO 87 CO 0.51 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.84 1cue n ARG 88 N -5.60 2.62 -1.15 1.05 1.74 -1.26 -4.89 116.66 109.17 1cue n ARG 88 Ca 0.16 -2.11 -0.05 0.00 -0.77 0.00 0.00 57.85 55.08 1cue n ARG 88 Cb 0.50 -1.56 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 1cue n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1cue n GLY 89 N 1.23 0.75 3.68 -0.13 0.00 0.25 -4.73 105.19 106.24 1cue n GLY 89 Ca 0.19 -0.44 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 1cue n GLY 89 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1cue s THR 90 N -2.06 0.00 0.60 2.61 -1.32 -1.15 -4.25 115.64 110.07 1cue s THR 90 Ca 0.00 -0.51 -0.13 0.00 -1.21 0.00 0.00 61.69 59.84 1cue s THR 90 Cb 0.00 -1.64 -0.04 0.00 -1.51 0.00 0.00 72.50 69.31 1cue s THR 90 CO 0.00 0.00 1.02 -0.94 -2.21 0.00 0.00 174.62 172.49 1cue s SER 91 N -2.81 6.18 0.22 8.08 1.04 -1.26 -4.72 113.70 120.43 1cue s SER 91 Ca 0.09 1.53 -0.02 0.00 0.48 0.00 0.00 55.95 58.03 1cue s SER 91 Cb -0.02 -2.49 0.22 0.00 0.10 0.00 0.00 66.02 63.83 1cue s SER 91 CO -0.01 -0.90 1.62 0.28 0.98 0.00 0.00 173.24 175.21 1cue h SER 92 N 0.08 0.66 -0.97 7.02 0.02 -2.00 -2.76 113.55 115.60 1cue h SER 92 Ca -0.45 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.26 1cue h SER 92 Cb 1.19 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.50 1cue h SER 92 CO 0.61 0.94 0.64 0.00 -1.14 0.00 0.00 176.83 177.87 1cue h ALA 93 N 1.10 1.35 -0.33 3.77 0.00 -1.95 0.42 119.26 123.62 1cue h ALA 93 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1cue h ALA 93 Cb 0.82 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1cue h ALA 93 CO 0.07 0.57 -0.03 0.00 0.00 0.00 0.00 179.25 179.86 1cue h ALA 94 N 1.42 0.45 -0.63 0.00 0.00 -1.75 -1.62 119.26 117.13 1cue h ALA 94 Ca 0.38 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 55.13 1cue h ALA 94 Cb -0.04 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.55 1cue h ALA 94 CO -0.11 0.24 0.21 0.82 0.00 0.00 0.00 179.25 180.40 1cue h ILE 95 N 0.39 0.71 -0.64 0.00 2.04 -1.20 -1.21 117.51 117.60 1cue h ILE 95 Ca 0.09 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1cue h ILE 95 Cb 0.50 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1cue h ILE 95 CO 0.02 0.07 0.23 -0.09 0.00 0.00 0.00 178.15 178.38 1cue h ARG 96 N 0.37 0.96 -0.40 2.37 2.43 -0.85 -1.23 114.38 118.03 1cue h ARG 96 Ca 0.33 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1cue h ARG 96 Cb 0.44 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1cue h ARG 96 CO -0.35 0.81 0.14 1.49 -1.51 0.00 0.00 179.97 180.55 1cue h GLU 97 N 0.94 0.60 0.07 0.20 4.57 -0.27 -1.98 114.58 118.71 1cue h GLU 97 Ca 0.21 -0.12 -0.28 0.00 -1.18 0.00 0.00 59.36 58.00 1cue h GLU 97 Cb 0.23 -0.09 0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1cue h GLU 97 CO -0.01 0.59 -1.15 1.98 -1.18 0.00 0.00 179.01 179.23 1cue h MET 98 N 0.49 0.59 -0.94 1.92 4.05 -0.98 -2.87 114.93 117.19 1cue h MET 98 Ca 0.13 -0.73 0.17 0.00 -0.28 0.00 0.00 59.70 58.99 1cue h MET 98 Cb 0.22 0.23 -0.10 0.00 -0.80 0.00 0.00 31.60 31.15 1cue h MET 98 CO -0.01 1.31 0.53 1.25 0.23 0.00 0.00 176.91 180.23 1cue h LEU 99 N 0.29 0.67 -1.20 3.39 5.85 -1.25 0.86 115.31 123.91 1cue h LEU 99 Ca -0.15 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.60 1cue h LEU 99 Cb 1.81 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.82 1cue h LEU 99 CO 0.22 0.25 -0.29 1.23 -0.34 0.00 0.00 178.44 179.50 1cue h GLY 100 N 0.70 0.00 1.26 3.75 0.00 -1.15 -1.49 103.07 106.15 1cue h GLY 100 Ca 0.53 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.58 1cue h GLY 100 CO -0.38 0.00 -1.12 1.41 0.00 0.00 0.00 176.54 176.45 1cue h LEU 101 N 0.00 0.86 -0.95 3.11 3.38 -0.70 -0.50 115.31 120.51 1cue h LEU 101 Ca -0.00 -0.73 0.01 0.00 0.09 0.00 0.00 57.88 57.24 1cue h LEU 101 Cb 0.73 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 1cue h LEU 101 CO 0.04 1.54 0.62 -0.26 0.09 0.00 0.00 178.44 180.47 1cue h PHE 102 N 0.33 1.20 -0.21 1.13 0.04 -0.90 -0.54 116.94 117.99 1cue h PHE 102 Ca -0.15 0.03 -0.19 0.00 2.80 0.00 0.00 57.97 60.46 1cue h PHE 102 Cb 1.78 -0.40 -0.00 0.00 2.20 0.00 0.00 35.95 39.53 1cue h PHE 102 CO 0.10 0.76 -0.61 1.96 -0.60 0.00 0.00 178.31 179.92 1cue h GLN 103 N 1.29 0.71 -0.96 1.51 4.20 -1.22 -2.05 115.11 118.58 1cue h GLN 103 Ca 0.35 -0.49 0.09 0.00 0.06 0.00 0.00 58.65 58.66 1cue h GLN 103 Cb -0.14 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 27.63 1cue h GLN 103 CO -0.07 1.11 0.60 1.96 -0.67 0.00 0.00 178.83 181.75 1cue h GLN 104 N 0.53 0.99 -0.28 1.46 4.20 -0.91 -2.48 115.11 118.63 1cue h GLN 104 Ca -0.01 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.65 1cue h GLN 104 Cb 1.20 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 1cue h GLN 104 CO 0.12 0.66 0.16 0.00 -0.67 0.00 0.00 178.83 179.11 1cue h ALA 105 N 1.48 0.35 -0.12 3.87 0.00 -0.43 -0.83 119.26 123.57 1cue h ALA 105 Ca 0.45 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.27 1cue h ALA 105 Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1cue h ALA 105 CO -0.22 -0.21 -0.27 -0.97 0.00 0.00 0.00 179.25 177.58 1cue h ASN 106 N 0.34 0.22 0.00 0.00 -1.24 -1.28 -0.35 115.58 113.27 1cue h ASN 106 Ca 0.11 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.05 1cue h ASN 106 Cb -0.01 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 38.98 1cue h ASN 106 CO -0.05 0.50 -0.17 0.74 -1.29 0.00 0.00 177.43 177.17 1cue h THR 107 N 0.20 0.10 -0.53 -3.57 2.02 -1.21 -3.13 112.91 106.78 1cue h THR 107 Ca 0.03 -1.08 0.11 0.00 0.77 0.00 0.00 66.41 66.24 1cue h THR 107 Cb 0.59 0.19 -0.10 0.00 -1.74 0.00 0.00 68.15 67.10 1cue h THR 107 CO 0.04 0.03 -0.10 0.11 0.37 0.00 0.00 175.52 175.98 1cue h LYS 108 N -1.00 0.03 -2.65 6.66 1.57 -1.21 -3.38 116.57 116.59 1cue h LYS 108 Ca -0.01 -0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.17 1cue h LYS 108 Cb 0.21 -0.01 -0.39 0.00 0.08 0.00 0.00 32.23 32.12 1cue h LYS 108 CO -0.00 0.02 -0.83 0.00 -0.57 0.00 0.00 179.45 178.06 1cue h PRO 110 N 5.93 0.00 -0.27 0.00 0.13 -1.69 -3.16 132.00 132.93 1cue h PRO 110 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1cue h PRO 110 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1cue h PRO 110 CO 0.45 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.97 1cue n ASP 111 N -2.93 3.23 -4.76 1.44 8.00 -1.26 -4.94 116.55 115.33 1cue n ASP 111 Ca -0.02 -1.96 -0.39 0.00 0.71 0.00 0.00 54.79 53.13 1cue n ASP 111 Cb 0.14 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 41.01 1cue n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cue s ALA 112 N -1.57 3.32 0.11 2.24 0.00 -1.20 -4.21 121.76 120.45 1cue s ALA 112 Ca 0.34 0.61 -0.24 0.00 0.00 0.00 0.00 51.96 52.66 1cue s ALA 112 Cb 0.21 -3.21 -0.07 0.00 0.00 0.00 0.00 23.12 20.05 1cue s ALA 112 CO 0.30 0.20 0.73 0.99 0.00 0.00 0.00 175.76 177.97 1cue s THR 113 N -1.26 4.54 0.10 0.00 2.01 0.50 -4.92 115.64 116.60 1cue s THR 113 Ca 0.43 1.57 0.03 0.00 0.31 0.00 0.00 61.69 64.04 1cue s THR 113 Cb -0.25 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 1cue s THR 113 CO 0.31 0.49 0.09 -0.76 -0.69 0.00 0.00 174.62 174.06 1cue s LEU 114 N -0.86 3.82 0.03 4.42 1.43 -0.77 -1.60 118.68 125.15 1cue s LEU 114 Ca 0.35 -0.03 -0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1cue s LEU 114 Cb -0.22 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.50 1cue s LEU 114 CO 0.24 0.15 -0.03 0.27 0.23 0.00 0.00 176.35 177.21 1cue s ILE 115 N -1.46 0.16 0.08 -0.59 -4.36 -0.51 -0.24 121.20 114.28 1cue s ILE 115 Ca 0.30 -1.19 -0.03 0.00 -0.26 0.00 0.00 60.65 59.47 1cue s ILE 115 Cb -0.12 -0.65 -0.03 0.00 1.25 0.00 0.00 42.46 42.91 1cue s ILE 115 CO 0.22 -0.65 0.05 0.00 0.24 0.00 0.00 174.94 174.80 1cue s ALA 116 N -2.20 0.45 0.17 2.27 0.00 -1.08 -2.00 121.76 119.38 1cue s ALA 116 Ca -0.09 -1.16 -0.23 0.00 0.00 0.00 0.00 51.96 50.47 1cue s ALA 116 Cb -0.05 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.63 1cue s ALA 116 CO -0.04 -0.44 0.68 0.20 0.00 0.00 0.00 175.76 176.16 1cue s GLY 117 N -2.95 -0.47 -0.03 0.00 0.00 -1.08 -2.05 107.32 100.74 1cue s GLY 117 Ca 0.12 0.36 -0.29 0.00 0.00 0.00 0.00 44.72 44.91 1cue s GLY 117 CO -0.07 0.12 0.84 -0.32 0.00 0.00 0.00 173.10 173.68 1cue s GLY 118 N -2.76 -0.45 -0.07 0.20 0.00 -0.62 -1.47 107.32 102.14 1cue s GLY 118 Ca 0.04 1.28 0.04 0.00 0.00 0.00 0.00 44.72 46.08 1cue s GLY 118 CO -0.08 0.61 -0.19 -0.47 0.00 0.00 0.00 173.10 172.97 1cue s TYR 119 N -2.31 2.04 0.00 1.90 5.04 -0.58 -1.53 117.35 121.90 1cue s TYR 119 Ca -0.00 -0.73 0.00 0.00 -2.44 0.00 0.00 57.07 53.90 1cue s TYR 119 Cb -0.01 -1.39 0.00 0.00 0.35 0.00 0.00 41.96 40.92 1cue s TYR 119 CO -0.03 -0.29 0.00 0.45 -1.34 0.00 0.00 175.55 174.34 1cue n SER 120 N 3.42 0.00 -0.25 4.32 2.88 -0.72 -1.07 113.62 122.21 1cue n SER 120 Ca -0.20 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.32 1cue n SER 120 Cb 0.52 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.07 1cue n SER 120 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1cue h LEU 121 N 0.00 0.69 -2.43 2.46 6.46 -1.86 -0.09 115.31 120.54 1cue h LEU 121 Ca 0.00 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1cue h LEU 121 Cb 0.00 -0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 39.79 1cue h LEU 121 CO 0.00 0.47 -0.02 1.23 -0.62 0.00 0.00 178.44 179.51 1cue h GLY 122 N 0.83 0.00 1.17 3.75 0.00 -0.67 0.40 103.07 108.54 1cue h GLY 122 Ca 0.29 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.37 1cue h GLY 122 CO -0.12 0.00 -0.93 0.00 0.00 0.00 0.00 176.54 175.48 1cue h ALA 123 N 1.98 0.18 -0.40 3.60 0.00 -1.05 0.30 119.26 123.89 1cue h ALA 123 Ca -0.00 -0.66 -0.12 0.00 0.00 0.00 0.00 54.91 54.13 1cue h ALA 123 Cb 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1cue h ALA 123 CO 0.00 0.66 -0.23 0.00 0.00 0.00 0.00 179.25 179.69 1cue h ALA 124 N 0.44 0.85 -0.55 0.00 0.00 -0.94 -0.51 119.26 118.55 1cue h ALA 124 Ca -0.10 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1cue h ALA 124 Cb 1.58 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1cue h ALA 124 CO 0.19 0.64 -0.08 1.25 0.00 0.00 0.00 179.25 181.25 1cue h LEU 125 N 0.69 1.02 -0.42 0.00 5.85 -0.22 -1.13 115.31 121.11 1cue h LEU 125 Ca 0.09 -0.34 -0.07 0.00 0.84 0.00 0.00 57.88 58.41 1cue h LEU 125 Cb 0.75 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1cue h LEU 125 CO 0.06 1.12 -0.00 0.00 -0.34 0.00 0.00 178.44 179.27 1cue h ALA 126 N 0.94 0.56 -0.63 1.25 0.00 -0.70 -0.60 119.26 120.07 1cue h ALA 126 Ca 0.15 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1cue h ALA 126 Cb 0.64 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1cue h ALA 126 CO 0.04 0.35 0.14 0.00 0.00 0.00 0.00 179.25 179.79 1cue h ALA 127 N 0.89 0.84 -0.56 0.00 0.00 -0.92 -2.37 119.26 117.14 1cue h ALA 127 Ca 0.12 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 1cue h ALA 127 Cb 0.49 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1cue h ALA 127 CO 0.02 0.56 -0.05 0.00 0.00 0.00 0.00 179.25 179.78 1cue h ALA 128 N 1.05 0.76 -0.20 0.00 0.00 -0.97 -1.09 119.26 118.81 1cue h ALA 128 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1cue h ALA 128 Cb 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1cue h ALA 128 CO 0.00 0.64 0.13 0.77 0.00 0.00 0.00 179.25 180.79 1cue h SER 129 N 0.91 0.24 -0.37 0.00 0.02 -1.02 -2.40 113.55 110.93 1cue h SER 129 Ca 0.15 -0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 1cue h SER 129 Cb 0.62 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1cue h SER 129 CO 0.04 0.19 -0.34 0.40 -1.14 0.00 0.00 176.83 175.97 1cue h ILE 130 N 0.26 1.27 -0.87 3.27 2.04 -1.34 0.18 117.51 122.33 1cue h ILE 130 Ca 0.07 -1.51 0.03 0.00 1.00 0.00 0.00 64.86 64.45 1cue h ILE 130 Cb -0.01 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1cue h ILE 130 CO -0.02 0.51 0.57 -0.08 0.00 0.00 0.00 178.15 179.13 1cue h GLU 131 N 0.76 1.07 0.00 2.37 4.81 -1.11 -2.90 114.58 119.58 1cue h GLU 131 Ca 0.07 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1cue h GLU 131 Cb 0.92 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1cue h GLU 131 CO 0.09 0.71 -0.49 -0.25 -0.73 0.00 0.00 179.01 178.33 1cue n ASP 132 N -4.43 0.68 -4.69 1.04 8.00 -0.91 -4.92 116.55 111.32 1cue n ASP 132 Ca 0.11 0.18 -0.36 0.00 0.71 0.00 0.00 54.79 55.43 1cue n ASP 132 Cb 0.09 -0.01 0.08 0.00 -0.02 0.00 0.00 41.12 41.25 1cue n ASP 132 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1cue n LEU 133 N -2.07 5.04 -4.72 0.64 4.77 0.00 -4.92 117.00 115.75 1cue n LEU 133 Ca 0.04 0.75 -0.42 0.00 -0.03 0.00 0.00 56.01 56.35 1cue n LEU 133 Cb 0.43 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 39.98 1cue n LEU 133 CO 0.35 -1.41 1.25 -0.62 -1.33 0.00 0.00 177.39 175.62 1cue s ASP 134 N -1.54 6.57 0.36 -1.43 2.15 -1.26 -4.80 116.67 116.72 1cue s ASP 134 Ca 0.79 2.64 0.18 0.00 0.43 0.00 0.00 52.55 56.59 1cue s ASP 134 Cb -0.36 -2.59 1.26 0.00 -0.30 0.00 0.00 42.92 40.93 1cue s ASP 134 CO 0.44 -0.84 1.58 -1.28 -0.17 0.00 0.00 175.17 174.91 1cue h SER 135 N 6.85 0.22 1.21 -0.34 0.87 -1.94 0.16 113.55 120.59 1cue h SER 135 Ca -0.43 0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1cue h SER 135 Cb 1.20 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 63.46 1cue h SER 135 CO 0.92 -0.42 0.00 0.00 -0.53 0.00 0.00 176.83 176.80 1cue h ALA 136 N 1.99 1.00 0.08 6.23 0.00 -1.99 -2.11 119.26 124.46 1cue h ALA 136 Ca 0.81 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 55.36 1cue h ALA 136 Cb 2.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.86 1cue h ALA 136 CO -0.78 0.00 -2.06 -0.89 0.00 0.00 0.00 179.25 175.51 1cue n ILE 137 N -2.62 1.69 -0.20 0.00 5.41 0.37 -4.01 119.36 120.01 1cue n ILE 137 Ca 0.03 -0.67 -0.02 0.00 1.00 0.00 0.00 62.75 63.09 1cue n ILE 137 Cb 0.35 -1.54 0.09 0.00 -0.71 0.00 0.00 39.64 37.83 1cue n ILE 137 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1cue h ARG 138 N 0.05 0.48 0.00 0.38 2.43 -0.99 -1.24 114.38 115.49 1cue h ARG 138 Ca -0.44 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1cue h ARG 138 Cb 2.02 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.46 1cue h ARG 138 CO 0.05 0.32 0.00 -0.25 -1.51 0.00 0.00 179.97 178.58 1cue n ASP 139 N -4.91 0.38 0.01 -3.80 8.00 -0.80 -0.94 116.55 114.49 1cue n ASP 139 Ca 0.07 0.62 0.13 0.00 0.71 0.00 0.00 54.79 56.32 1cue n ASP 139 Cb 0.21 -0.69 0.42 0.00 -0.02 0.00 0.00 41.12 41.04 1cue n ASP 139 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cue n LYS 140 N -1.95 0.05 -2.76 -1.24 5.02 -0.47 -4.75 118.16 112.05 1cue n LYS 140 Ca 0.01 0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.90 1cue n LYS 140 Cb 0.13 -1.54 -0.04 0.00 -0.02 0.00 0.00 35.03 33.57 1cue n LYS 140 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1cue s ILE 141 N -3.02 4.18 -0.76 -0.18 1.01 -0.12 -1.84 121.20 120.47 1cue s ILE 141 Ca 0.12 0.10 0.22 0.00 0.00 0.00 0.00 60.65 61.08 1cue s ILE 141 Cb 0.17 -4.70 0.21 0.00 0.01 0.00 0.00 42.46 38.16 1cue s ILE 141 CO 0.62 -1.44 1.67 0.00 0.00 0.00 0.00 174.94 175.78 1cue n ALA 142 N 8.07 1.84 -3.64 9.38 0.00 0.67 -4.81 120.51 132.02 1cue n ALA 142 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.39 1cue n ALA 142 Cb 0.47 -1.36 -0.07 0.00 0.00 0.00 0.00 19.45 18.49 1cue n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1cue s GLY 143 N -3.30 0.10 -0.01 0.00 0.00 -1.26 -4.72 107.32 98.12 1cue s GLY 143 Ca 0.07 3.03 0.04 0.00 0.00 0.00 0.00 44.72 47.86 1cue s GLY 143 CO 0.40 1.75 -0.13 -1.59 0.00 0.00 0.00 173.10 173.54 1cue s THR 144 N -0.09 0.99 -0.06 0.90 2.01 0.50 -2.64 115.64 117.26 1cue s THR 144 Ca 0.05 -0.54 0.04 0.00 0.31 0.00 0.00 61.69 61.56 1cue s THR 144 Cb -0.04 -0.83 -0.00 0.00 0.01 0.00 0.00 72.50 71.63 1cue s THR 144 CO -0.10 0.28 -0.20 0.68 -0.69 0.00 0.00 174.62 174.59 1cue s VAL 145 N -0.28 1.68 -0.08 3.82 -7.23 -0.87 -0.83 120.40 116.62 1cue s VAL 145 Ca 0.04 -0.83 0.03 0.00 -1.81 0.00 0.00 61.98 59.41 1cue s VAL 145 Cb -0.05 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.45 1cue s VAL 145 CO -0.00 0.48 -0.18 -0.76 -0.31 0.00 0.00 175.10 174.32 1cue s LEU 146 N 0.14 1.85 -0.14 1.32 1.43 -0.05 -1.59 118.68 121.65 1cue s LEU 146 Ca -0.09 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 1cue s LEU 146 Cb -0.14 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.97 1cue s LEU 146 CO 0.04 0.09 -0.10 -0.36 0.23 0.00 0.00 176.35 176.25 1cue s PHE 147 N 0.49 2.87 -1.30 0.29 0.08 -0.58 -0.24 117.98 119.59 1cue s PHE 147 Ca -0.16 -0.55 -0.03 0.00 0.12 0.00 0.00 56.93 56.31 1cue s PHE 147 Cb -0.17 -1.88 -0.00 0.00 -0.57 0.00 0.00 43.02 40.40 1cue s PHE 147 CO 0.06 -0.16 0.65 0.41 -0.10 0.00 0.00 175.22 176.07 1cue n GLY 148 N 3.53 -0.40 3.58 4.36 0.00 0.55 -1.75 105.19 115.05 1cue n GLY 148 Ca -0.18 0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1cue n GLY 148 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1cue s TYR 149 N -3.71 1.88 0.62 1.61 5.04 -1.26 -3.27 117.35 118.26 1cue s TYR 149 Ca 0.09 0.68 0.37 0.00 -2.44 0.00 0.00 57.07 55.76 1cue s TYR 149 Cb -0.03 -4.16 2.10 0.00 0.35 0.00 0.00 41.96 40.23 1cue s TYR 149 CO 0.84 -2.50 2.31 1.79 -1.34 0.00 0.00 175.55 176.64 1cue h THR 150 N 6.75 0.27 -0.74 4.34 1.35 -1.75 -0.49 112.91 122.64 1cue h THR 150 Ca -0.29 -0.02 -0.30 0.00 -0.55 0.00 0.00 66.41 65.24 1cue h THR 150 Cb 1.15 1.02 -0.18 0.00 -1.73 0.00 0.00 68.15 68.41 1cue h THR 150 CO 1.12 0.00 0.33 0.29 -0.25 0.00 0.00 175.52 177.01 1cue n LYS 151 N -3.47 2.89 0.30 4.72 4.76 -1.26 -4.73 118.16 121.38 1cue n LYS 151 Ca -0.03 -3.07 -0.15 0.00 -2.87 0.00 0.00 58.31 52.19 1cue n LYS 151 Cb 0.08 -2.12 -0.08 0.00 -1.84 0.00 0.00 35.03 31.07 1cue n LYS 151 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1cue h ASN 152 N 1.80 -0.66 -0.48 4.39 -0.73 -1.29 0.35 115.58 118.95 1cue h ASN 152 Ca 0.37 -0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.49 1cue h ASN 152 Cb 2.36 0.17 -0.02 0.00 0.27 0.00 0.00 38.32 41.10 1cue h ASN 152 CO 0.78 -0.33 0.28 0.25 -0.37 0.00 0.00 177.43 178.04 1cue h LEU 153 N -1.01 0.60 -1.04 0.34 5.85 -1.78 0.89 115.31 119.16 1cue h LEU 153 Ca -0.08 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 1cue h LEU 153 Cb 0.66 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1cue h LEU 153 CO 0.13 0.50 0.26 1.56 -0.34 0.00 0.00 178.44 180.55 1cue h GLN 154 N 0.64 0.94 -0.65 1.25 7.50 -1.86 -2.06 115.11 120.88 1cue h GLN 154 Ca 0.17 -0.15 0.00 0.00 0.50 0.00 0.00 58.65 59.17 1cue h GLN 154 Cb 0.03 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 27.39 1cue h GLN 154 CO -0.03 0.77 0.00 0.09 -1.50 0.00 0.00 178.83 178.16 1cue n ASN 155 N -4.31 4.39 -4.07 1.46 3.02 0.10 -4.98 115.26 110.88 1cue n ASN 155 Ca 0.06 -2.30 -0.33 0.00 -0.03 0.00 0.00 54.58 51.97 1cue n ASN 155 Cb 0.17 -0.53 -0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1cue n ASN 155 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1cue n ARG 156 N 1.21 -4.29 -1.00 3.52 5.12 0.17 -1.61 116.66 119.79 1cue n ARG 156 Ca 0.25 0.48 0.00 0.00 -1.93 0.00 0.00 57.85 56.65 1cue n ARG 156 Cb 0.78 -5.29 0.00 0.00 -1.16 0.00 0.00 32.46 26.79 1cue n ARG 156 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1cue n GLY 157 N -1.53 0.58 3.56 -0.13 0.00 -0.39 -5.02 105.19 102.26 1cue n GLY 157 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 1cue n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cue s ARG 158 N -0.08 1.90 -0.22 1.61 1.81 -0.64 -4.91 118.95 118.43 1cue s ARG 158 Ca 0.00 -1.77 -0.10 0.00 -1.72 0.00 0.00 55.73 52.14 1cue s ARG 158 Cb 0.00 -1.84 -0.05 0.00 -0.45 0.00 0.00 34.95 32.61 1cue s ARG 158 CO 0.00 0.23 0.14 0.42 -0.68 0.00 0.00 175.30 175.41 1cue s ILE 159 N -2.52 5.35 0.31 1.52 1.01 -1.26 -4.80 121.20 120.82 1cue s ILE 159 Ca 0.32 0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.85 1cue s ILE 159 Cb -0.02 -3.46 -0.11 0.00 0.01 0.00 0.00 42.46 38.87 1cue s ILE 159 CO 0.17 0.40 1.58 -2.65 0.00 0.00 0.00 174.94 174.44 1cue n PRO 160 N 3.86 2.71 -1.80 2.79 -0.02 -1.26 -2.37 135.00 138.90 1cue n PRO 160 Ca -0.16 0.96 -0.15 0.00 -2.02 0.00 0.00 63.50 62.14 1cue n PRO 160 Cb 0.52 -2.73 -0.04 0.00 -0.02 0.00 0.00 33.50 31.23 1cue n PRO 160 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1cue n ASN 161 N 1.81 -4.66 -3.87 2.55 3.02 -1.26 -4.00 115.26 108.85 1cue n ASN 161 Ca 0.07 0.20 -0.18 0.00 -0.03 0.00 0.00 54.58 54.64 1cue n ASN 161 Cb 0.37 -3.61 -0.16 0.00 -0.61 0.00 0.00 39.78 35.77 1cue n ASN 161 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1cue s TYR 162 N -2.63 0.53 0.18 3.10 5.04 -1.00 -5.02 117.35 117.56 1cue s TYR 162 Ca 0.00 -0.11 -0.33 0.00 -2.44 0.00 0.00 57.07 54.20 1cue s TYR 162 Cb 0.00 -0.52 -0.15 0.00 0.35 0.00 0.00 41.96 41.64 1cue s TYR 162 CO 0.00 -0.14 1.25 -0.35 -1.34 0.00 0.00 175.55 174.97 1cue n PRO 163 N 3.96 1.41 0.02 4.97 -0.04 -1.26 -4.60 135.00 139.45 1cue n PRO 163 Ca -0.25 0.50 0.06 0.00 -0.04 0.00 0.00 63.50 63.77 1cue n PRO 163 Cb 0.51 -2.06 0.47 0.00 -0.04 0.00 0.00 33.50 32.38 1cue n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cue h ALA 164 N 3.77 1.81 0.00 0.55 0.00 -1.94 -2.65 119.26 120.80 1cue h ALA 164 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1cue h ALA 164 Cb 1.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1cue h ALA 164 CO 0.73 0.15 0.00 -0.40 0.00 0.00 0.00 179.25 179.73 1cue n ASP 165 N -4.48 0.33 -0.87 0.00 5.75 -1.26 -2.61 116.55 113.41 1cue n ASP 165 Ca 0.04 0.58 0.10 0.00 -0.01 0.00 0.00 54.79 55.50 1cue n ASP 165 Cb 0.12 -0.65 0.11 0.00 -1.03 0.00 0.00 41.12 39.68 1cue n ASP 165 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1cue n ARG 166 N -1.86 1.99 -4.49 0.11 1.74 -1.00 -4.97 116.66 108.18 1cue n ARG 166 Ca 0.03 -1.84 -0.34 0.00 -0.77 0.00 0.00 57.85 54.93 1cue n ARG 166 Cb 0.20 -1.41 -0.11 0.00 -1.02 0.00 0.00 32.46 30.12 1cue n ARG 166 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1cue s THR 167 N -1.63 3.92 -0.02 0.55 2.01 -1.07 -0.37 115.64 119.03 1cue s THR 167 Ca 0.27 -0.38 0.01 0.00 0.31 0.00 0.00 61.69 61.90 1cue s THR 167 Cb 0.18 -2.65 0.01 0.00 0.01 0.00 0.00 72.50 70.05 1cue s THR 167 CO 0.26 0.56 -0.04 -0.75 -0.69 0.00 0.00 174.62 173.97 1cue s LYS 168 N -0.40 0.54 -0.08 4.92 2.20 -0.01 -4.95 119.74 121.95 1cue s LYS 168 Ca 0.07 -0.10 0.05 0.00 -0.36 0.00 0.00 55.97 55.62 1cue s LYS 168 Cb -0.12 -0.57 -0.01 0.00 -1.51 0.00 0.00 37.83 35.62 1cue s LYS 168 CO 0.02 -0.01 -0.24 0.08 -0.36 0.00 0.00 175.35 174.85 1cue s VAL 169 N 0.49 2.13 -0.34 4.02 1.01 -1.26 -0.87 120.40 125.57 1cue s VAL 169 Ca -0.06 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 1cue s VAL 169 Cb -0.09 -1.80 0.06 0.00 0.00 0.00 0.00 36.38 34.55 1cue s VAL 169 CO -0.00 0.56 0.09 -0.36 0.00 0.00 0.00 175.10 175.39 1cue s PHE 170 N 0.13 3.33 -0.19 5.22 0.08 0.66 -4.96 117.98 122.26 1cue s PHE 170 Ca -0.12 -1.83 0.00 0.00 0.12 0.00 0.00 56.93 55.10 1cue s PHE 170 Cb -0.16 -2.44 0.05 0.00 -0.57 0.00 0.00 43.02 39.89 1cue s PHE 170 CO 0.07 -0.82 -0.07 0.00 -0.10 0.00 0.00 175.22 174.30 1cue s ASN 172 N 1.52 6.92 0.23 0.00 0.01 -1.26 -4.99 114.94 117.37 1cue s ASN 172 Ca -0.01 1.90 -0.32 0.00 -0.71 0.00 0.00 52.86 53.72 1cue s ASN 172 Cb -0.16 -2.57 -0.12 0.00 0.41 0.00 0.00 41.25 38.81 1cue s ASN 172 CO -0.08 -0.37 1.67 0.41 -1.51 0.00 0.00 177.10 177.22 1cue n THR 173 N -0.11 0.33 -0.68 1.60 -1.04 -1.26 -1.49 114.28 111.64 1cue n THR 173 Ca 0.05 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1cue n THR 173 Cb 0.51 -1.95 0.00 0.00 -1.82 0.00 0.00 70.33 67.07 1cue n THR 173 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1cue n GLY 174 N 3.35 0.78 3.49 3.41 0.00 -1.26 -4.79 105.19 110.16 1cue n GLY 174 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1cue n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cue s ASP 175 N -2.65 6.32 0.53 1.61 -1.08 -0.55 -4.55 116.67 116.30 1cue s ASP 175 Ca 0.00 -1.17 0.32 0.00 -0.52 0.00 0.00 52.55 51.17 1cue s ASP 175 Cb 0.00 -2.47 1.48 0.00 -1.46 0.00 0.00 42.92 40.47 1cue s ASP 175 CO 0.00 -1.46 1.88 -0.07 0.52 0.00 0.00 175.17 176.05 1cue h LEU 176 N 11.73 0.01 -2.21 -1.34 3.38 -1.88 -1.04 115.31 123.96 1cue h LEU 176 Ca -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1cue h LEU 176 Cb 1.05 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1cue h LEU 176 CO 1.23 0.00 -0.01 -0.37 0.09 0.00 0.00 178.44 179.38 1cue h VAL 177 N 0.01 0.06 0.00 1.22 -1.51 -1.71 -1.20 116.25 113.13 1cue h VAL 177 Ca 0.44 -0.28 -0.01 0.00 -1.23 0.00 0.00 66.70 65.61 1cue h VAL 177 Cb 1.74 1.26 -0.00 0.00 -2.13 0.00 0.00 31.29 32.16 1cue h VAL 177 CO -0.01 0.01 -0.07 0.00 -1.23 0.00 0.00 177.57 176.27 1cue n THR 179 N -3.12 2.56 -0.57 0.00 -1.04 -0.52 -2.67 114.28 108.92 1cue n THR 179 Ca 0.04 -3.35 0.00 0.00 -2.04 0.00 0.00 64.05 58.70 1cue n THR 179 Cb 0.56 -0.63 0.00 0.00 -1.82 0.00 0.00 70.33 68.44 1cue n THR 179 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1cue n GLY 180 N -0.98 0.74 3.87 3.41 0.00 -1.21 -4.97 105.19 106.05 1cue n GLY 180 Ca 0.36 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.12 1cue n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1cue s SER 181 N -2.36 4.60 -0.12 1.61 0.15 -0.81 -5.03 113.70 111.75 1cue s SER 181 Ca 0.00 -1.22 0.14 0.00 0.70 0.00 0.00 55.95 55.57 1cue s SER 181 Cb 0.00 0.24 0.29 0.00 -1.71 0.00 0.00 66.02 64.84 1cue s SER 181 CO 0.00 -0.98 1.15 0.18 1.20 0.00 0.00 173.24 174.79 1cue n LEU 182 N -1.64 1.97 -4.73 3.45 4.77 -1.26 -3.84 117.00 115.72 1cue n LEU 182 Ca -0.03 -2.90 -0.40 0.00 -0.03 0.00 0.00 56.01 52.65 1cue n LEU 182 Cb 0.64 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1cue n LEU 182 CO 0.40 0.81 0.51 -0.63 -1.33 0.00 0.00 177.39 177.16 1cue s ILE 183 N -2.29 4.80 -0.42 -0.08 -1.09 -1.26 -4.98 121.20 115.89 1cue s ILE 183 Ca 0.29 1.72 -0.20 0.00 -2.23 0.00 0.00 60.65 60.23 1cue s ILE 183 Cb 0.27 -4.16 0.02 0.00 -1.58 0.00 0.00 42.46 37.01 1cue s ILE 183 CO -0.02 0.29 0.62 -0.69 -1.23 0.00 0.00 174.94 173.91 1cue s VAL 184 N 0.36 4.87 0.47 2.92 1.01 -1.26 -4.07 120.40 124.70 1cue s VAL 184 Ca 0.42 0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.64 1cue s VAL 184 Cb -0.20 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.03 1cue s VAL 184 CO 0.24 -0.51 0.44 0.00 0.00 0.00 0.00 175.10 175.27 1cue s ALA 185 N 2.72 4.25 0.14 5.51 0.00 -1.26 -5.04 121.76 128.08 1cue s ALA 185 Ca 0.22 -1.75 -0.22 0.00 0.00 0.00 0.00 51.96 50.21 1cue s ALA 185 Cb -0.14 -1.01 0.02 0.00 0.00 0.00 0.00 23.12 21.99 1cue s ALA 185 CO 0.18 -0.36 1.65 0.00 0.00 0.00 0.00 175.76 177.22 1cue h ALA 186 N 0.84 -0.06 -0.36 0.00 0.00 -1.97 -2.56 119.26 115.15 1cue h ALA 186 Ca -0.39 0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.70 1cue h ALA 186 Cb 1.28 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 1cue h ALA 186 CO 0.55 -0.62 0.62 -1.35 0.00 0.00 0.00 179.25 178.46 1cue h PRO 187 N -0.20 0.00 0.00 0.00 0.11 -1.87 0.67 132.00 130.71 1cue h PRO 187 Ca 0.13 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.19 1cue h PRO 187 Cb 0.39 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1cue h PRO 187 CO -0.33 0.00 -0.21 1.25 -0.21 0.00 0.00 178.00 178.50 1cue h HIS 188 N 0.00 0.00 -0.56 0.65 2.76 -1.75 -2.36 115.15 113.89 1cue h HIS 188 Ca 0.17 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 1cue h HIS 188 Cb 1.42 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.38 1cue h HIS 188 CO 0.00 0.21 0.00 1.28 -1.30 0.00 0.00 177.93 178.12 1cue n LEU 189 N -3.54 3.30 -2.49 0.26 4.32 0.23 -4.64 117.00 114.42 1cue n LEU 189 Ca -0.01 -1.65 -0.29 0.00 -0.02 0.00 0.00 56.01 54.04 1cue n LEU 189 Cb 0.36 -0.42 0.01 0.00 -1.62 0.00 0.00 43.42 41.75 1cue n LEU 189 CO 0.33 0.75 0.41 0.00 -1.22 0.00 0.00 177.39 177.65 1cue n ALA 190 N 1.11 5.30 0.11 -1.18 0.00 -0.89 -4.67 120.51 120.29 1cue n ALA 190 Ca 0.20 -4.23 0.07 0.00 0.00 0.00 0.00 53.44 49.48 1cue n ALA 190 Cb 0.55 -0.75 0.15 0.00 0.00 0.00 0.00 19.45 19.39 1cue n ALA 190 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1cue n TYR 191 N -0.52 0.37 -0.11 0.00 4.01 -1.26 -4.69 117.16 114.95 1cue n TYR 191 Ca 0.42 -0.30 -0.06 0.00 -0.16 0.00 0.00 57.90 57.80 1cue n TYR 191 Cb 0.63 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.65 1cue n TYR 191 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1cue h GLY 192 N 2.80 0.00 0.35 2.72 0.00 -1.95 -1.38 103.07 105.62 1cue h GLY 192 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 47.33 47.69 1cue h GLY 192 CO 0.00 -0.20 -0.04 -2.55 0.00 0.00 0.00 176.54 173.74 1cue h PRO 193 N -0.16 0.05 -0.37 4.80 0.11 -1.99 -1.90 132.00 132.53 1cue h PRO 193 Ca 0.19 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.33 1cue h PRO 193 Cb 0.46 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.53 1cue h PRO 193 CO -0.49 0.03 0.16 -0.44 -0.21 0.00 0.00 178.00 177.05 1cue h ASP 194 N 0.05 0.21 0.33 -2.05 3.32 -1.75 -1.28 116.42 115.26 1cue h ASP 194 Ca 0.17 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1cue h ASP 194 Cb 0.26 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1cue h ASP 194 CO -0.33 0.16 -0.07 0.00 -1.72 0.00 0.00 179.24 177.28 1cue h ALA 195 N 1.21 1.22 0.00 3.45 0.00 -0.91 -2.26 119.26 121.98 1cue h ALA 195 Ca 0.16 -0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.79 1cue h ALA 195 Cb 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1cue h ALA 195 CO -0.14 0.08 -1.30 0.00 0.00 0.00 0.00 179.25 177.90 1cue h ARG 196 N 0.00 0.00 0.00 0.00 3.08 -0.46 -3.26 114.38 113.74 1cue h ARG 196 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cue h ARG 196 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1cue h ARG 196 CO 0.01 0.60 0.00 0.41 -1.07 0.00 0.00 179.97 179.92 1cue n GLY 197 N 1.42 0.26 0.21 0.04 0.00 -0.72 -4.87 105.19 101.53 1cue n GLY 197 Ca -0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 1cue n GLY 197 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1cue h PRO 198 N 0.00 0.14 0.11 1.61 0.11 -1.75 -1.84 132.00 130.39 1cue h PRO 198 Ca 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1cue h PRO 198 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 1cue h PRO 198 CO 0.00 0.10 -0.05 0.00 -0.21 0.00 0.00 178.00 177.83 1cue h ALA 199 N 1.46 -0.15 -0.85 -0.75 0.00 -1.71 -0.31 119.26 116.94 1cue h ALA 199 Ca 0.27 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1cue h ALA 199 Cb 0.41 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 1cue h ALA 199 CO -0.42 -0.42 0.51 -1.00 0.00 0.00 0.00 179.25 177.92 1cue h PRO 200 N -0.49 0.86 -0.46 0.00 0.13 -1.77 -1.80 132.00 128.48 1cue h PRO 200 Ca -0.02 -0.05 0.07 0.00 -0.87 0.00 0.00 66.00 65.13 1cue h PRO 200 Cb 0.40 -0.19 -0.06 0.00 0.13 0.00 0.00 31.00 31.27 1cue h PRO 200 CO 0.03 0.57 0.10 1.49 -0.23 0.00 0.00 178.00 179.96 1cue h GLU 201 N 0.89 0.24 0.03 0.86 4.81 -1.11 0.11 114.58 120.40 1cue h GLU 201 Ca 0.39 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.60 1cue h GLU 201 Cb 0.27 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1cue h GLU 201 CO -0.21 0.16 -0.02 0.35 -0.73 0.00 0.00 179.01 178.56 1cue h PHE 202 N 0.24 -0.04 -0.51 0.92 3.57 -0.52 -1.81 116.94 118.79 1cue h PHE 202 Ca 0.22 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.75 1cue h PHE 202 Cb 0.28 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1cue h PHE 202 CO -0.21 0.01 0.29 -0.07 -2.23 0.00 0.00 178.31 176.10 1cue h LEU 203 N -0.08 0.45 -0.95 0.59 3.38 -0.88 -0.36 115.31 117.45 1cue h LEU 203 Ca -0.00 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1cue h LEU 203 Cb 0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1cue h LEU 203 CO 0.01 0.32 0.07 0.40 0.09 0.00 0.00 178.44 179.32 1cue h ILE 204 N 0.57 1.24 -0.37 1.22 2.04 -0.73 -1.69 117.51 119.78 1cue h ILE 204 Ca 0.21 -0.92 -0.14 0.00 1.00 0.00 0.00 64.86 65.01 1cue h ILE 204 Cb 0.06 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1cue h ILE 204 CO -0.11 0.33 -0.32 -0.08 0.00 0.00 0.00 178.15 177.96 1cue h GLU 205 N 0.79 0.88 -0.13 2.37 4.81 -0.94 -0.38 114.58 121.98 1cue h GLU 205 Ca 0.16 -0.45 -0.14 0.00 -0.13 0.00 0.00 59.36 58.81 1cue h GLU 205 Cb 0.38 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1cue h GLU 205 CO 0.01 1.09 -0.52 0.87 -0.73 0.00 0.00 179.01 179.73 1cue h LYS 206 N 0.69 0.37 -0.14 1.92 1.79 -0.76 -0.60 116.57 119.84 1cue h LYS 206 Ca 0.07 -0.22 -0.06 0.00 -2.18 0.00 0.00 60.65 58.25 1cue h LYS 206 Cb 0.91 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1cue h LYS 206 CO 0.08 0.80 -0.17 0.28 -1.08 0.00 0.00 179.45 179.37 1cue h VAL 207 N 0.29 1.36 -0.24 0.50 2.07 -1.22 -3.03 116.25 115.98 1cue h VAL 207 Ca 0.01 -1.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.10 1cue h VAL 207 Cb 1.01 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 1cue h VAL 207 CO 0.09 0.40 -0.18 0.03 0.02 0.00 0.00 177.57 177.93 1cue h ARG 208 N -0.03 0.43 -0.92 1.57 3.08 -0.94 0.35 114.38 117.92 1cue h ARG 208 Ca 0.02 -0.13 0.13 0.00 0.07 0.00 0.00 59.98 60.06 1cue h ARG 208 Cb 0.71 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.65 1cue h ARG 208 CO 0.04 0.59 0.59 0.00 -1.07 0.00 0.00 179.97 180.12 1cue h ALA 209 N 1.43 1.70 0.00 0.04 0.00 -1.05 -2.83 119.26 118.55 1cue h ALA 209 Ca 0.07 0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 1cue h ALA 209 Cb 0.54 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1cue h ALA 209 CO 0.03 0.07 -2.16 1.33 0.00 0.00 0.00 179.25 178.52 1cue n VAL 210 N -4.57 1.04 0.00 0.00 0.24 -0.95 -5.11 118.33 108.98 1cue n VAL 210 Ca 0.17 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1cue n VAL 210 Cb 0.40 -0.40 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1cue n VAL 210 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1cue n ARG 211 N -2.66 0.00 0.00 7.34 3.00 0.12 -5.08 116.66 119.39 1cue n ARG 211 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.61 1cue n ARG 211 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.44 1cue n ARG 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1cue n GLY 212 N -0.48 0.73 0.00 -0.13 0.00 -1.26 -4.80 105.19 99.25 1cue n GLY 212 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1cue n GLY 212 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06