#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cvd s ASN 3 N 0.00 6.48 -0.13 3.54 0.01 -1.26 -4.95 114.94 118.62 2cvd s ASN 3 Ca 0.00 0.33 -0.05 0.00 -0.71 0.00 0.00 52.86 52.44 2cvd s ASN 3 Cb 0.00 -2.33 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 2cvd s ASN 3 CO 0.00 -0.53 0.04 -0.31 -1.51 0.00 0.00 177.10 174.79 2cvd s TYR 4 N 2.67 3.24 -0.17 2.20 1.51 -1.26 -1.26 117.35 124.28 2cvd s TYR 4 Ca 0.25 0.13 -0.02 0.00 -1.01 0.00 0.00 57.07 56.42 2cvd s TYR 4 Cb -0.15 -1.94 0.05 0.00 -0.11 0.00 0.00 41.96 39.82 2cvd s TYR 4 CO 0.13 0.33 0.02 0.21 -1.11 0.00 0.00 175.55 175.13 2cvd s LYS 5 N -0.29 0.72 -0.20 -0.62 2.20 -0.43 -1.06 119.74 120.06 2cvd s LYS 5 Ca 0.08 -0.32 -0.13 0.00 -0.36 0.00 0.00 55.97 55.23 2cvd s LYS 5 Cb -0.12 -1.87 -0.05 0.00 -1.51 0.00 0.00 37.83 34.28 2cvd s LYS 5 CO 0.02 -0.55 0.25 -1.17 -0.36 0.00 0.00 175.35 173.53 2cvd s LEU 6 N 1.86 4.19 -0.13 5.43 2.96 -0.22 -0.66 118.68 132.11 2cvd s LEU 6 Ca 0.00 0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.29 2cvd s LEU 6 Cb -0.16 -2.28 -0.00 0.00 0.50 0.00 0.00 46.19 44.25 2cvd s LEU 6 CO -0.07 0.07 -0.18 -0.89 -1.32 0.00 0.00 176.35 173.96 2cvd s THR 7 N 0.75 2.51 0.26 3.68 2.01 -0.75 -0.36 115.64 123.75 2cvd s THR 7 Ca 0.13 -0.84 -0.14 0.00 0.31 0.00 0.00 61.69 61.15 2cvd s THR 7 Cb -0.13 -2.03 0.05 0.00 0.01 0.00 0.00 72.50 70.41 2cvd s THR 7 CO 0.04 0.54 0.73 0.00 -0.69 0.00 0.00 174.62 175.23 2cvd n TYR 8 N 3.74 -1.79 -1.93 4.92 9.36 -0.74 -2.67 117.16 128.05 2cvd n TYR 8 Ca -0.19 -1.35 -0.29 0.00 3.32 0.00 0.00 57.90 59.38 2cvd n TYR 8 Cb 0.52 0.67 0.14 0.00 -0.63 0.00 0.00 39.34 40.05 2cvd n TYR 8 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2cvd s PHE 9 N -3.14 2.18 -1.34 2.98 0.40 -1.26 -0.48 117.98 117.32 2cvd s PHE 9 Ca 0.15 0.49 -0.13 0.00 -0.60 0.00 0.00 56.93 56.85 2cvd s PHE 9 Cb -0.03 -3.85 0.11 0.00 0.51 0.00 0.00 43.02 39.76 2cvd s PHE 9 CO 0.08 -2.27 1.92 -1.71 0.70 0.00 0.00 175.22 173.94 2cvd n ASN 10 N -3.57 4.67 -3.79 1.36 5.15 -1.25 -4.63 115.26 113.21 2cvd n ASN 10 Ca 0.12 -2.97 -0.10 0.00 -0.60 0.00 0.00 54.58 51.03 2cvd n ASN 10 Cb 0.60 -1.59 -0.05 0.00 -0.53 0.00 0.00 39.78 38.21 2cvd n ASN 10 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2cvd s MET 11 N 2.04 1.30 -0.04 1.20 -1.94 -1.26 -4.94 119.30 115.66 2cvd s MET 11 Ca 0.45 -0.93 -0.09 0.00 -1.71 0.00 0.00 55.69 53.40 2cvd s MET 11 Cb 0.09 0.48 -0.05 0.00 2.01 0.00 0.00 34.83 37.35 2cvd s MET 11 CO -0.02 -0.53 0.45 0.00 -0.01 0.00 0.00 175.02 174.91 2cvd h ARG 12 N 2.30 -0.32 0.00 2.03 3.08 -1.34 -3.45 114.38 116.68 2cvd h ARG 12 Ca -0.30 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2cvd h ARG 12 Cb 1.25 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.37 2cvd h ARG 12 CO 0.41 -0.21 0.00 0.41 -1.07 0.00 0.00 179.97 179.51 2cvd n GLY 13 N 0.78 1.38 0.02 0.04 0.00 -1.26 -1.34 105.19 104.81 2cvd n GLY 13 Ca -0.04 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.92 2cvd n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cvd n ARG 14 N 12.16 0.03 0.10 1.61 1.74 -1.26 -3.22 116.66 127.82 2cvd n ARG 14 Ca 0.00 0.12 0.12 0.00 -0.77 0.00 0.00 57.85 57.32 2cvd n ARG 14 Cb 0.00 -1.54 0.02 0.00 -1.02 0.00 0.00 32.46 29.91 2cvd n ARG 14 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cvd h ALA 15 N 2.76 0.50 -0.76 7.54 0.00 -1.78 -3.39 119.26 124.13 2cvd h ALA 15 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.00 2cvd h ALA 15 Cb 0.43 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2cvd h ALA 15 CO 0.00 0.00 0.50 1.49 0.00 0.00 0.00 179.25 181.24 2cvd h GLU 16 N 0.00 0.68 -0.55 0.00 4.57 -1.18 -0.88 114.58 117.22 2cvd h GLU 16 Ca 0.00 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.11 2cvd h GLU 16 Cb 0.97 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.38 2cvd h GLU 16 CO 0.00 0.45 0.24 0.97 -1.18 0.00 0.00 179.01 179.49 2cvd h ILE 17 N 0.70 1.19 -0.34 2.32 6.09 -1.81 0.24 117.51 125.92 2cvd h ILE 17 Ca 0.35 -0.59 -0.14 0.00 -1.37 0.00 0.00 64.86 63.11 2cvd h ILE 17 Cb 0.42 0.52 -0.01 0.00 0.47 0.00 0.00 36.82 38.22 2cvd h ILE 17 CO -0.13 0.24 -0.33 0.40 -3.07 0.00 0.00 178.15 175.26 2cvd h ILE 18 N 0.79 1.29 -0.59 2.19 2.04 -1.46 -2.37 117.51 119.39 2cvd h ILE 18 Ca 0.19 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.50 2cvd h ILE 18 Cb 0.13 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 2cvd h ILE 18 CO -0.02 0.49 0.19 0.03 0.00 0.00 0.00 178.15 178.85 2cvd h ARG 19 N 0.61 0.89 -0.53 2.37 3.08 -0.60 -1.53 114.38 118.66 2cvd h ARG 19 Ca 0.05 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 2cvd h ARG 19 Cb 0.92 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 2cvd h ARG 19 CO 0.08 0.76 0.12 1.88 -1.07 0.00 0.00 179.97 181.74 2cvd h TYR 20 N 0.87 0.90 -0.41 3.04 -1.99 -0.85 -1.79 116.97 116.73 2cvd h TYR 20 Ca 0.20 -0.11 -0.05 0.00 2.00 0.00 0.00 58.73 60.77 2cvd h TYR 20 Cb 0.24 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 38.70 2cvd h TYR 20 CO 0.02 0.79 0.07 0.82 -0.00 0.00 0.00 178.16 179.86 2cvd h ILE 21 N 0.75 1.24 -0.79 -2.88 2.04 -1.00 -0.01 117.51 116.87 2cvd h ILE 21 Ca 0.17 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 65.15 2cvd h ILE 21 Cb 0.35 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 2cvd h ILE 21 CO 0.00 0.30 0.45 -0.26 0.00 0.00 0.00 178.15 178.64 2cvd h PHE 22 N 0.54 1.06 -0.03 1.37 0.05 -1.22 -0.56 116.94 118.15 2cvd h PHE 22 Ca 0.13 -0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.90 2cvd h PHE 22 Cb 0.37 -0.34 -0.00 0.00 2.00 0.00 0.00 35.95 37.97 2cvd h PHE 22 CO 0.02 0.73 0.01 0.00 -0.18 0.00 0.00 178.31 178.90 2cvd h ALA 23 N 1.24 0.04 -0.69 2.45 0.00 -1.05 0.67 119.26 121.91 2cvd h ALA 23 Ca 0.28 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2cvd h ALA 23 Cb 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2cvd h ALA 23 CO -0.05 -0.35 0.45 -0.92 0.00 0.00 0.00 179.25 178.39 2cvd h TYR 24 N -0.16 0.86 -0.00 0.00 3.20 -0.81 -1.96 116.97 118.10 2cvd h TYR 24 Ca 0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2cvd h TYR 24 Cb 0.22 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.20 2cvd h TYR 24 CO -0.00 0.53 -0.01 1.28 -1.64 0.00 0.00 178.16 178.32 2cvd n LEU 25 N -4.62 0.24 -3.51 2.82 4.77 -0.23 -4.92 117.00 111.55 2cvd n LEU 25 Ca 0.06 -0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.83 2cvd n LEU 25 Cb 0.03 -0.06 0.07 0.00 -2.33 0.00 0.00 43.42 41.14 2cvd n LEU 25 CO 0.35 0.04 0.06 -0.67 -1.33 0.00 0.00 177.39 175.84 2cvd n ASP 26 N -0.88 -1.77 -4.46 -1.43 4.64 -0.48 -4.99 116.55 107.17 2cvd n ASP 26 Ca 0.21 -0.68 -0.33 0.00 -1.38 0.00 0.00 54.79 52.61 2cvd n ASP 26 Cb 0.17 -4.81 -0.13 0.00 -1.04 0.00 0.00 41.12 35.31 2cvd n ASP 26 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2cvd s ILE 27 N -3.45 3.63 0.25 5.18 1.01 0.11 -5.04 121.20 122.88 2cvd s ILE 27 Ca 0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 60.65 59.90 2cvd s ILE 27 Cb -0.00 -2.57 -0.09 0.00 0.01 0.00 0.00 42.46 39.81 2cvd s ILE 27 CO 0.75 0.50 1.01 -1.10 0.00 0.00 0.00 174.94 176.11 2cvd s GLN 28 N 0.35 4.76 0.15 2.79 -1.52 -1.26 -4.64 119.66 120.28 2cvd s GLN 28 Ca -0.06 1.63 -0.21 0.00 -1.95 0.00 0.00 55.36 54.77 2cvd s GLN 28 Cb -0.15 -3.24 0.06 0.00 -0.22 0.00 0.00 33.01 29.46 2cvd s GLN 28 CO 0.04 0.38 0.54 1.52 -0.25 0.00 0.00 175.29 177.51 2cvd s TYR 29 N -1.14 -0.43 -0.32 0.91 -0.85 -1.26 -4.51 117.35 109.75 2cvd s TYR 29 Ca 0.43 0.20 -0.19 0.00 -0.52 0.00 0.00 57.07 56.99 2cvd s TYR 29 Cb -0.29 0.46 -0.01 0.00 0.38 0.00 0.00 41.96 42.51 2cvd s TYR 29 CO 0.36 -0.80 0.55 -2.00 -1.52 0.00 0.00 175.55 172.14 2cvd s GLU 30 N -3.73 3.79 -1.22 -3.49 2.12 -0.22 -4.99 118.70 110.96 2cvd s GLU 30 Ca 0.01 0.07 -0.13 0.00 0.36 0.00 0.00 54.97 55.29 2cvd s GLU 30 Cb -0.00 -3.75 0.17 0.00 0.26 0.00 0.00 34.13 30.80 2cvd s GLU 30 CO -0.12 -0.57 1.50 -3.47 -0.54 0.00 0.00 175.26 172.05 2cvd n ASP 31 N 5.77 5.20 -4.63 -1.70 4.64 -1.26 -1.06 116.55 123.51 2cvd n ASP 31 Ca -0.03 -2.99 -0.43 0.00 -1.38 0.00 0.00 54.79 49.96 2cvd n ASP 31 Cb 0.49 -1.57 -0.02 0.00 -1.04 0.00 0.00 41.12 38.98 2cvd n ASP 31 CO 0.00 0.00 0.00 -2.28 -0.82 0.00 0.00 177.20 174.10 2cvd s HIS 32 N 1.53 2.79 -0.26 -0.67 5.65 0.51 -5.00 115.29 119.85 2cvd s HIS 32 Ca 0.43 0.93 -0.04 0.00 0.25 0.00 0.00 55.06 56.63 2cvd s HIS 32 Cb -0.01 -3.91 0.01 0.00 -1.18 0.00 0.00 32.58 27.49 2cvd s HIS 32 CO 0.01 -1.47 -0.01 1.03 -0.65 0.00 0.00 174.74 173.65 2cvd s ARG 33 N 4.10 3.05 0.47 2.88 0.52 -1.26 -1.79 118.95 126.91 2cvd s ARG 33 Ca 0.53 -0.86 -0.04 0.00 -0.52 0.00 0.00 55.73 54.85 2cvd s ARG 33 Cb -0.15 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.16 2cvd s ARG 33 CO 0.22 -0.37 0.74 0.96 0.02 0.00 0.00 175.30 176.88 2cvd s ILE 34 N 1.42 4.68 0.01 1.52 -4.36 0.37 -4.80 121.20 120.03 2cvd s ILE 34 Ca 0.02 -0.03 -0.06 0.00 -0.26 0.00 0.00 60.65 60.32 2cvd s ILE 34 Cb -0.16 -3.77 -0.05 0.00 1.25 0.00 0.00 42.46 39.73 2cvd s ILE 34 CO -0.02 -0.69 0.26 -1.61 0.24 0.00 0.00 174.94 173.12 2cvd s GLU 35 N -4.68 3.56 0.40 0.37 2.02 -1.26 -3.79 118.70 115.31 2cvd s GLU 35 Ca 0.47 -0.11 0.16 0.00 0.02 0.00 0.00 54.97 55.51 2cvd s GLU 35 Cb -0.10 -3.08 1.02 0.00 0.10 0.00 0.00 34.13 32.07 2cvd s GLU 35 CO 0.42 0.65 1.83 0.37 0.02 0.00 0.00 175.26 178.56 2cvd h GLN 36 N 3.96 0.46 0.00 1.61 5.75 -2.00 0.14 115.11 125.04 2cvd h GLN 36 Ca -0.50 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 57.97 2cvd h GLN 36 Cb 1.20 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.64 2cvd h GLN 36 CO 0.66 0.31 -0.04 0.00 -2.65 0.00 0.00 178.83 177.11 2cvd h ALA 37 N 1.61 1.05 0.00 3.38 0.00 -2.05 -2.76 119.26 120.48 2cvd h ALA 37 Ca 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2cvd h ALA 37 Cb 1.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2cvd h ALA 37 CO -0.22 0.05 -1.10 -0.25 0.00 0.00 0.00 179.25 177.72 2cvd n ASP 38 N -3.20 0.65 0.11 0.00 8.00 0.47 -4.56 116.55 118.02 2cvd n ASP 38 Ca -0.01 -0.46 -0.13 0.00 0.71 0.00 0.00 54.79 54.90 2cvd n ASP 38 Cb 0.24 0.98 -0.06 0.00 -0.02 0.00 0.00 41.12 42.26 2cvd n ASP 38 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 2cvd h TRP 39 N 0.00 -1.00 -0.93 1.24 -0.00 -1.19 -2.93 115.95 111.14 2cvd h TRP 39 Ca 0.00 0.03 0.18 0.00 -0.00 0.00 0.00 58.89 59.09 2cvd h TRP 39 Cb 0.67 0.43 -0.17 0.00 -0.00 0.00 0.00 29.16 30.08 2cvd h TRP 39 CO 0.00 -0.47 -0.27 -2.30 -0.00 0.00 0.00 178.44 175.41 2cvd n PRO 40 N -5.44 -0.12 -0.12 2.65 -0.02 -1.26 -0.17 135.00 130.52 2cvd n PRO 40 Ca -0.07 1.45 -0.12 0.00 -2.02 0.00 0.00 63.50 62.74 2cvd n PRO 40 Cb 0.35 -2.16 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 2cvd n PRO 40 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2cvd h GLU 41 N 0.00 0.79 0.22 -0.52 4.81 -1.86 -3.01 114.58 115.02 2cvd h GLU 41 Ca 0.42 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2cvd h GLU 41 Cb 0.65 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2cvd h GLU 41 CO -0.95 0.99 -0.11 0.82 -0.73 0.00 0.00 179.01 179.03 2cvd h ILE 42 N 0.59 0.81 -0.82 2.32 1.08 -0.71 -3.11 117.51 117.66 2cvd h ILE 42 Ca 0.08 -0.12 0.20 0.00 -0.39 0.00 0.00 64.86 64.63 2cvd h ILE 42 Cb 0.77 0.88 -0.12 0.00 -3.07 0.00 0.00 36.82 35.28 2cvd h ILE 42 CO 0.06 0.03 0.25 0.50 -0.69 0.00 0.00 178.15 178.30 2cvd h LYS 43 N -0.35 0.28 0.00 2.37 3.64 -0.57 0.30 116.57 122.23 2cvd h LYS 43 Ca -0.03 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2cvd h LYS 43 Cb 0.27 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2cvd h LYS 43 CO 0.05 0.18 0.00 -1.13 -2.27 0.00 0.00 179.45 176.28 2cvd n SER 44 N -5.15 0.54 -0.16 4.20 3.41 -1.14 -1.80 113.62 113.52 2cvd n SER 44 Ca 0.18 0.70 0.11 0.00 -0.26 0.00 0.00 58.87 59.60 2cvd n SER 44 Cb 0.58 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.70 2cvd n SER 44 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2cvd n THR 45 N -2.17 0.00 -3.38 6.66 -2.24 0.09 -4.93 114.28 108.30 2cvd n THR 45 Ca -0.00 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.32 2cvd n THR 45 Cb 0.10 0.99 -0.06 0.00 -2.10 0.00 0.00 70.33 69.26 2cvd n THR 45 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2cvd s LEU 46 N -2.82 4.33 0.32 3.22 1.43 -0.75 -4.99 118.68 119.43 2cvd s LEU 46 Ca 0.12 0.83 0.10 0.00 -1.03 0.00 0.00 54.13 54.15 2cvd s LEU 46 Cb 0.17 -2.64 0.95 0.00 0.03 0.00 0.00 46.19 44.70 2cvd s LEU 46 CO 0.75 0.10 1.68 -0.65 0.23 0.00 0.00 176.35 178.46 2cvd h PRO 47 N 6.15 0.35 -0.03 1.29 0.11 -1.92 -2.06 132.00 135.89 2cvd h PRO 47 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2cvd h PRO 47 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2cvd h PRO 47 CO 0.72 0.23 0.00 1.19 -0.21 0.00 0.00 178.00 179.93 2cvd n PHE 48 N -5.05 0.08 -2.69 0.65 3.01 -1.26 -5.01 117.46 107.19 2cvd n PHE 48 Ca 0.28 -0.76 -0.14 0.00 1.01 0.00 0.00 57.45 57.84 2cvd n PHE 48 Cb 0.85 -0.11 -0.00 0.00 -0.01 0.00 0.00 39.48 40.20 2cvd n PHE 48 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cvd n GLY 49 N -0.89 -0.50 3.16 1.37 0.00 -0.78 -4.97 105.19 102.58 2cvd n GLY 49 Ca 0.10 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 2cvd n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cvd s LYS 50 N -5.28 0.80 0.22 1.61 -0.14 -1.26 -4.93 119.74 110.76 2cvd s LYS 50 Ca 0.11 -1.11 0.08 0.00 -1.36 0.00 0.00 55.97 53.68 2cvd s LYS 50 Cb -0.06 -0.48 -0.05 0.00 -1.68 0.00 0.00 37.83 35.57 2cvd s LYS 50 CO 0.13 0.07 -0.14 0.96 -0.76 0.00 0.00 175.35 175.61 2cvd s ILE 51 N -2.37 1.84 0.78 2.17 -4.36 -1.26 -4.60 121.20 113.40 2cvd s ILE 51 Ca 0.04 -2.23 -0.11 0.00 -0.26 0.00 0.00 60.65 58.09 2cvd s ILE 51 Cb -0.03 -2.13 0.06 0.00 1.25 0.00 0.00 42.46 41.61 2cvd s ILE 51 CO -0.00 -0.53 1.10 -2.16 0.24 0.00 0.00 174.94 173.58 2cvd s PRO 52 N -3.63 2.19 0.05 0.37 0.04 -1.26 -4.98 135.00 127.78 2cvd s PRO 52 Ca 0.24 1.21 0.02 0.00 0.04 0.00 0.00 61.00 62.51 2cvd s PRO 52 Cb -0.01 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2cvd s PRO 52 CO 0.09 -1.70 -0.07 0.96 0.04 0.00 0.00 177.00 176.32 2cvd s ILE 53 N -2.85 0.50 -0.10 0.56 -4.36 -1.09 -3.81 121.20 110.05 2cvd s ILE 53 Ca 0.62 -1.29 -0.00 0.00 -0.26 0.00 0.00 60.65 59.72 2cvd s ILE 53 Cb -0.18 -0.86 0.02 0.00 1.25 0.00 0.00 42.46 42.70 2cvd s ILE 53 CO 0.55 -0.54 -0.07 -0.22 0.24 0.00 0.00 174.94 174.90 2cvd s LEU 54 N -1.97 1.20 -0.19 0.37 2.96 -0.01 -1.81 118.68 119.22 2cvd s LEU 54 Ca -0.05 -0.27 -0.14 0.00 -0.22 0.00 0.00 54.13 53.45 2cvd s LEU 54 Cb -0.06 -0.79 -0.04 0.00 0.50 0.00 0.00 46.19 45.80 2cvd s LEU 54 CO -0.02 -0.10 0.30 -1.61 -1.32 0.00 0.00 176.35 173.60 2cvd s GLU 55 N 1.55 4.18 -0.33 1.98 2.02 0.16 -0.72 118.70 127.55 2cvd s GLU 55 Ca 0.01 0.05 -0.00 0.00 0.02 0.00 0.00 54.97 55.05 2cvd s GLU 55 Cb -0.13 -3.49 0.07 0.00 0.10 0.00 0.00 34.13 30.68 2cvd s GLU 55 CO -0.06 0.09 0.04 0.08 0.02 0.00 0.00 175.26 175.43 2cvd s VAL 56 N 0.92 2.78 -1.53 2.63 1.01 0.66 -1.32 120.40 125.56 2cvd s VAL 56 Ca 0.15 -1.76 -0.14 0.00 0.00 0.00 0.00 61.98 60.23 2cvd s VAL 56 Cb -0.14 -2.76 0.08 0.00 0.00 0.00 0.00 36.38 33.57 2cvd s VAL 56 CO 0.05 -0.32 0.99 0.47 0.00 0.00 0.00 175.10 176.29 2cvd n ASP 57 N 4.51 -4.80 0.00 3.32 10.43 -0.39 -1.25 116.55 128.38 2cvd n ASP 57 Ca -0.08 -0.78 0.00 0.00 2.57 0.00 0.00 54.79 56.51 2cvd n ASP 57 Cb 0.42 -3.91 0.00 0.00 1.84 0.00 0.00 41.12 39.48 2cvd n ASP 57 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2cvd n GLY 58 N -1.70 2.68 3.72 0.44 0.00 -1.26 -5.03 105.19 104.04 2cvd n GLY 58 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2cvd n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cvd s LEU 59 N 0.00 4.33 -0.10 0.99 1.43 -0.38 -5.01 118.68 119.94 2cvd s LEU 59 Ca 0.00 1.17 -0.20 0.00 -1.03 0.00 0.00 54.13 54.07 2cvd s LEU 59 Cb 0.00 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 2cvd s LEU 59 CO 0.00 -0.08 0.54 -0.89 0.23 0.00 0.00 176.35 176.15 2cvd s THR 60 N 0.64 5.14 0.08 5.49 2.01 -1.26 -0.24 115.64 127.50 2cvd s THR 60 Ca 0.36 1.10 0.09 0.00 0.31 0.00 0.00 61.69 63.55 2cvd s THR 60 Cb -0.18 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 2cvd s THR 60 CO 0.18 0.31 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.45 2cvd s LEU 61 N 0.63 2.51 0.34 4.42 1.43 0.10 -4.97 118.68 123.14 2cvd s LEU 61 Ca 0.29 -0.55 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2cvd s LEU 61 Cb -0.16 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 2cvd s LEU 61 CO 0.13 0.22 0.15 -1.38 0.23 0.00 0.00 176.35 175.70 2cvd s HIS 62 N -1.00 1.70 -0.02 0.29 -3.43 -1.26 -0.83 115.29 110.74 2cvd s HIS 62 Ca 0.15 -1.33 -0.01 0.00 -0.80 0.00 0.00 55.06 53.07 2cvd s HIS 62 Cb -0.10 -0.98 0.01 0.00 -1.43 0.00 0.00 32.58 30.07 2cvd s HIS 62 CO 0.06 -0.43 0.03 1.04 -2.00 0.00 0.00 174.74 173.44 2cvd n GLN 63 N -0.70 -1.54 -0.26 -0.38 1.13 -1.25 -4.30 117.38 110.07 2cvd n GLN 63 Ca -0.01 1.48 0.07 0.00 -1.94 0.00 0.00 57.00 56.60 2cvd n GLN 63 Cb 0.65 -1.97 0.20 0.00 0.11 0.00 0.00 30.24 29.23 2cvd n GLN 63 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2cvd h SER 64 N 1.30 -0.07 0.91 1.08 4.64 -1.86 -0.90 113.55 118.64 2cvd h SER 64 Ca -0.06 0.17 -0.15 0.00 -0.47 0.00 0.00 61.79 61.28 2cvd h SER 64 Cb 0.14 0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 2cvd h SER 64 CO 0.00 -0.10 -0.70 -0.07 -0.87 0.00 0.00 176.83 175.09 2cvd h LEU 65 N 0.22 0.00 -0.41 5.97 3.38 -1.91 -0.67 115.31 121.89 2cvd h LEU 65 Ca 0.44 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.31 2cvd h LEU 65 Cb 0.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2cvd h LEU 65 CO -0.58 0.70 -0.15 0.00 0.09 0.00 0.00 178.44 178.50 2cvd h ALA 66 N 1.30 0.57 -0.37 1.53 0.00 -1.58 -1.24 119.26 119.47 2cvd h ALA 66 Ca -0.01 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 2cvd h ALA 66 Cb 1.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2cvd h ALA 66 CO 0.09 0.49 0.04 0.82 0.00 0.00 0.00 179.25 180.69 2cvd h ILE 67 N 0.64 1.25 -0.78 0.00 2.04 -1.09 -1.42 117.51 118.15 2cvd h ILE 67 Ca 0.10 -0.90 0.02 0.00 1.00 0.00 0.00 64.86 65.07 2cvd h ILE 67 Cb 0.69 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 2cvd h ILE 67 CO 0.05 0.30 0.51 0.00 0.00 0.00 0.00 178.15 179.01 2cvd h ALA 68 N 0.89 1.00 -0.62 1.87 0.00 -0.99 -0.65 119.26 120.75 2cvd h ALA 68 Ca 0.11 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2cvd h ALA 68 Cb 0.40 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2cvd h ALA 68 CO 0.01 0.36 0.10 -0.09 0.00 0.00 0.00 179.25 179.63 2cvd h ARG 69 N 1.02 1.03 -0.56 0.00 2.43 -1.08 -2.01 114.38 115.21 2cvd h ARG 69 Ca 0.29 -0.28 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2cvd h ARG 69 Cb -0.08 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.32 2cvd h ARG 69 CO -0.08 0.97 0.36 -0.92 -1.51 0.00 0.00 179.97 178.79 2cvd h TYR 70 N 0.94 0.68 0.00 2.20 3.20 -0.56 -2.06 116.97 121.37 2cvd h TYR 70 Ca 0.19 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.00 2cvd h TYR 70 Cb 0.44 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 2cvd h TYR 70 CO 0.03 0.41 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.53 2cvd h LEU 71 N 0.72 0.00 -0.39 2.82 3.38 -0.93 -3.21 115.31 117.70 2cvd h LEU 71 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2cvd h LEU 71 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2cvd h LEU 71 CO -0.06 0.37 -0.57 0.35 0.09 0.00 0.00 178.44 178.61 2cvd n THR 72 N -3.61 0.00 -1.88 0.22 -2.24 -0.78 -4.86 114.28 101.13 2cvd n THR 72 Ca -0.01 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.26 2cvd n THR 72 Cb 0.48 0.76 -0.01 0.00 -2.10 0.00 0.00 70.33 69.46 2cvd n THR 72 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2cvd s LYS 73 N -2.74 4.18 0.00 -0.78 2.20 -0.80 -1.66 119.74 120.13 2cvd s LYS 73 Ca 0.15 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.24 2cvd s LYS 73 Cb 0.18 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.47 2cvd s LYS 73 CO 0.67 -0.49 0.00 0.09 -0.36 0.00 0.00 175.35 175.26 2cvd n ASN 74 N 1.31 -3.37 -4.78 1.43 3.02 -1.26 -5.01 115.26 106.61 2cvd n ASN 74 Ca 0.04 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.33 2cvd n ASN 74 Cb 0.39 -1.38 -0.06 0.00 -0.61 0.00 0.00 39.78 38.12 2cvd n ASN 74 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2cvd s THR 75 N -1.88 2.01 -2.00 3.41 -4.23 -0.67 -5.02 115.64 107.26 2cvd s THR 75 Ca 0.00 -1.69 0.17 0.00 -1.18 0.00 0.00 61.69 58.99 2cvd s THR 75 Cb 0.00 -2.70 0.47 0.00 1.34 0.00 0.00 72.50 71.62 2cvd s THR 75 CO 0.00 0.00 1.56 -0.90 -0.54 0.00 0.00 174.62 174.74 2cvd n ASP 76 N -1.36 0.00 -0.07 3.99 5.75 -1.26 -3.13 116.55 120.47 2cvd n ASP 76 Ca -0.04 -1.25 0.11 0.00 -0.01 0.00 0.00 54.79 53.61 2cvd n ASP 76 Cb 0.65 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.81 2cvd n ASP 76 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2cvd n LEU 77 N -0.79 0.93 0.08 -2.12 4.77 -1.26 -4.57 117.00 114.02 2cvd n LEU 77 Ca 0.13 -0.32 -0.15 0.00 -0.03 0.00 0.00 56.01 55.63 2cvd n LEU 77 Cb 0.06 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 40.97 2cvd n LEU 77 CO 0.09 0.21 0.11 0.00 -1.33 0.00 0.00 177.39 176.48 2cvd h ALA 78 N 3.15 0.27 0.00 -1.18 0.00 -1.66 -2.04 119.26 117.80 2cvd h ALA 78 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2cvd h ALA 78 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2cvd h ALA 78 CO 0.00 0.83 0.00 0.41 0.00 0.00 0.00 179.25 180.49 2cvd n GLY 79 N 1.10 4.08 0.05 0.00 0.00 -1.26 -4.37 105.19 104.78 2cvd n GLY 79 Ca -0.08 -1.29 0.13 0.00 0.00 0.00 0.00 46.02 44.78 2cvd n GLY 79 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cvd n ASN 80 N 0.00 0.33 -4.08 1.61 3.02 -1.26 -4.67 115.26 110.21 2cvd n ASN 80 Ca 0.00 0.54 -0.10 0.00 -0.03 0.00 0.00 54.58 54.99 2cvd n ASN 80 Cb 0.00 -0.63 -0.09 0.00 -0.61 0.00 0.00 39.78 38.46 2cvd n ASN 80 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2cvd s THR 81 N -3.06 0.09 0.27 3.41 -4.23 -1.26 -5.01 115.64 105.85 2cvd s THR 81 Ca 0.11 -1.72 -0.05 0.00 -1.18 0.00 0.00 61.69 58.86 2cvd s THR 81 Cb 0.15 -1.96 0.26 0.00 1.34 0.00 0.00 72.50 72.29 2cvd s THR 81 CO 0.51 -0.42 1.94 -0.33 -0.54 0.00 0.00 174.62 175.78 2cvd h GLU 82 N 2.76 1.25 -0.46 3.99 5.08 -1.99 0.74 114.58 125.94 2cvd h GLU 82 Ca -0.34 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 57.90 2cvd h GLU 82 Cb 1.21 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2cvd h GLU 82 CO 0.55 0.82 0.12 0.52 -1.00 0.00 0.00 179.01 180.03 2cvd h MET 83 N 1.28 0.73 -0.29 2.33 2.86 -1.98 -1.29 114.93 118.57 2cvd h MET 83 Ca 0.36 -0.17 -0.07 0.00 -2.06 0.00 0.00 59.70 57.75 2cvd h MET 83 Cb -0.12 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.42 2cvd h MET 83 CO -0.08 0.71 -0.13 0.93 1.06 0.00 0.00 176.91 179.40 2cvd h GLU 84 N 0.61 0.50 -0.14 1.72 5.08 -1.79 -1.29 114.58 119.27 2cvd h GLU 84 Ca 0.14 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2cvd h GLU 84 Cb 0.31 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2cvd h GLU 84 CO -0.00 0.63 -0.18 1.96 -1.00 0.00 0.00 179.01 180.42 2cvd h GLN 85 N 0.46 0.23 -0.43 2.33 4.20 -0.45 -0.22 115.11 121.23 2cvd h GLN 85 Ca 0.09 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.61 2cvd h GLN 85 Cb 0.50 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2cvd h GLN 85 CO 0.03 0.41 -0.23 0.00 -0.67 0.00 0.00 178.83 178.37 2cvd h HIS 87 N 0.75 1.14 0.05 0.00 3.86 -0.39 0.72 115.15 121.28 2cvd h HIS 87 Ca 0.09 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2cvd h HIS 87 Cb 0.81 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.93 2cvd h HIS 87 CO 0.06 0.84 -0.02 0.28 0.86 0.00 0.00 177.93 179.94 2cvd h VAL 88 N 1.11 0.96 -0.86 2.45 2.07 -0.84 -1.09 116.25 120.05 2cvd h VAL 88 Ca 0.27 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.78 2cvd h VAL 88 Cb 0.14 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 2cvd h VAL 88 CO -0.03 0.01 0.56 0.44 0.02 0.00 0.00 177.57 178.57 2cvd h ASP 89 N -0.08 0.95 -0.43 0.57 3.32 -0.93 -1.62 116.42 118.19 2cvd h ASP 89 Ca -0.01 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2cvd h ASP 89 Cb 0.06 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2cvd h ASP 89 CO 0.01 0.66 0.13 0.00 -1.72 0.00 0.00 179.24 178.32 2cvd h ALA 90 N 1.35 0.56 -0.62 3.45 0.00 -0.56 -0.51 119.26 122.94 2cvd h ALA 90 Ca 0.34 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2cvd h ALA 90 Cb -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2cvd h ALA 90 CO -0.10 0.22 0.14 0.82 0.00 0.00 0.00 179.25 180.33 2cvd h ILE 91 N 0.56 1.25 -0.62 0.00 1.08 -0.98 -0.41 117.51 118.38 2cvd h ILE 91 Ca 0.14 -0.94 -0.01 0.00 -0.39 0.00 0.00 64.86 63.66 2cvd h ILE 91 Cb 0.27 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 2cvd h ILE 91 CO -0.00 0.35 0.33 0.58 -0.69 0.00 0.00 178.15 178.72 2cvd h VAL 92 N 0.91 1.20 -0.09 1.67 2.07 -1.08 -1.22 116.25 119.71 2cvd h VAL 92 Ca 0.19 -0.52 -0.12 0.00 0.82 0.00 0.00 66.70 67.07 2cvd h VAL 92 Cb 0.37 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2cvd h VAL 92 CO 0.00 0.22 -0.46 0.44 0.02 0.00 0.00 177.57 177.80 2cvd h ASP 93 N 0.84 0.24 -0.48 0.57 3.45 -0.83 0.10 116.42 120.31 2cvd h ASP 93 Ca 0.22 -0.11 -0.07 0.00 0.43 0.00 0.00 57.03 57.50 2cvd h ASP 93 Cb 0.06 -0.07 -0.02 0.00 -0.56 0.00 0.00 39.33 38.74 2cvd h ASP 93 CO -0.03 0.67 0.04 0.74 -1.57 0.00 0.00 179.24 179.09 2cvd h THR 94 N 0.18 1.26 -0.23 0.35 2.02 -0.69 0.35 112.91 116.15 2cvd h THR 94 Ca 0.01 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.14 2cvd h THR 94 Cb 0.89 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 2cvd h THR 94 CO 0.07 0.35 -0.10 -0.07 0.37 0.00 0.00 175.52 176.14 2cvd h LEU 95 N 0.69 0.49 -1.05 2.58 3.38 -1.01 -2.95 115.31 117.43 2cvd h LEU 95 Ca 0.14 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2cvd h LEU 95 Cb 0.45 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2cvd h LEU 95 CO 0.02 0.78 -0.08 -0.78 0.09 0.00 0.00 178.44 178.47 2cvd h ASP 96 N 0.20 0.57 -0.50 -0.43 3.58 -0.59 -1.78 116.42 117.47 2cvd h ASP 96 Ca 0.05 -0.14 0.04 0.00 0.42 0.00 0.00 57.03 57.41 2cvd h ASP 96 Cb 0.59 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.44 2cvd h ASP 96 CO 0.03 0.69 0.25 0.44 -2.88 0.00 0.00 179.24 177.77 2cvd h ASP 97 N 0.55 0.35 -0.02 2.28 3.45 -0.25 0.84 116.42 123.63 2cvd h ASP 97 Ca 0.10 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.59 2cvd h ASP 97 Cb 0.47 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 2cvd h ASP 97 CO 0.02 0.25 0.00 0.15 -1.57 0.00 0.00 179.24 178.09 2cvd h PHE 98 N 0.49 0.04 -0.95 4.55 3.57 -1.30 -2.69 116.94 120.66 2cvd h PHE 98 Ca 0.22 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.75 2cvd h PHE 98 Cb 0.13 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.81 2cvd h PHE 98 CO -0.10 0.32 0.62 0.52 -2.23 0.00 0.00 178.31 177.44 2cvd h MET 99 N -0.25 1.16 0.00 1.11 2.86 -1.11 -1.45 114.93 117.24 2cvd h MET 99 Ca 0.01 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2cvd h MET 99 Cb 0.31 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.70 2cvd h MET 99 CO 0.00 0.77 0.00 0.43 1.06 0.00 0.00 176.91 179.17 2cvd n SER 100 N -4.44 0.48 0.22 1.22 7.64 0.27 -2.80 113.62 116.22 2cvd n SER 100 Ca 0.13 0.62 0.10 0.00 1.01 0.00 0.00 58.87 60.73 2cvd n SER 100 Cb 0.10 -0.72 0.44 0.00 -1.01 0.00 0.00 64.21 63.01 2cvd n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cvd s PHE 102 N -3.59 2.09 -0.99 0.00 0.40 -1.12 -4.90 117.98 109.86 2cvd s PHE 102 Ca 0.01 0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 56.59 2cvd s PHE 102 Cb 0.10 -3.90 -0.09 0.00 0.51 0.00 0.00 43.02 39.64 2cvd s PHE 102 CO 0.64 -3.33 2.10 -0.35 0.70 0.00 0.00 175.22 174.98 2cvd n PRO 103 N 7.30 2.05 0.30 0.24 -0.04 -1.26 -4.72 135.00 138.86 2cvd n PRO 103 Ca 0.18 -1.90 0.18 0.00 -0.04 0.00 0.00 63.50 61.92 2cvd n PRO 103 Cb 0.44 -2.85 0.91 0.00 -0.04 0.00 0.00 33.50 31.96 2cvd n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2cvd h TRP 104 N 6.93 0.00 -0.40 0.54 4.06 -1.94 -2.27 115.95 122.87 2cvd h TRP 104 Ca 0.50 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.45 2cvd h TRP 104 Cb 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.66 2cvd h TRP 104 CO 1.52 0.04 0.00 0.00 -3.56 0.00 0.00 178.44 176.44 2cvd n ALA 105 N -2.17 2.42 -1.67 1.49 0.00 -1.26 -4.98 120.51 114.34 2cvd n ALA 105 Ca -0.02 -0.99 -0.47 0.00 0.00 0.00 0.00 53.44 51.97 2cvd n ALA 105 Cb 0.19 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.70 2cvd n ALA 105 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2cvd n GLU 106 N 1.46 2.18 -0.26 0.00 4.07 -0.86 -4.88 120.64 122.37 2cvd n GLU 106 Ca 0.20 0.79 -0.07 0.00 -0.06 0.00 0.00 57.16 58.02 2cvd n GLU 106 Cb 0.60 -2.59 0.05 0.00 -0.06 0.00 0.00 31.44 29.43 2cvd n GLU 106 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 2cvd h LYS 107 N 7.21 1.11 -5.39 5.31 1.63 -1.93 -3.40 116.57 121.10 2cvd h LYS 107 Ca -0.46 -0.25 -0.65 0.00 -0.85 0.00 0.00 60.65 58.44 2cvd h LYS 107 Cb 1.26 -0.16 -0.15 0.00 -0.60 0.00 0.00 32.23 32.58 2cvd h LYS 107 CO 0.91 0.96 0.11 0.15 -3.45 0.00 0.00 179.45 178.13 2cvd s LYS 108 N -5.39 3.36 0.66 1.90 1.02 -1.26 -4.90 119.74 115.13 2cvd s LYS 108 Ca -0.12 -0.30 0.43 0.00 0.02 0.00 0.00 55.97 56.00 2cvd s LYS 108 Cb 0.15 -3.92 2.38 0.00 -0.52 0.00 0.00 37.83 35.91 2cvd s LYS 108 CO 0.84 -0.94 2.36 0.37 -0.92 0.00 0.00 175.35 177.06 2cvd h GLN 109 N 8.78 0.00 0.64 1.68 5.75 -1.99 -0.68 115.11 129.29 2cvd h GLN 109 Ca -0.26 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.21 2cvd h GLN 109 Cb 1.10 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.66 2cvd h GLN 109 CO 0.87 0.00 -0.31 0.22 -2.65 0.00 0.00 178.83 176.97 2cvd h ASP 110 N 0.00 -0.72 -0.35 -0.69 1.82 -1.95 -2.67 116.42 111.85 2cvd h ASP 110 Ca 0.00 -0.01 -0.12 0.00 -0.39 0.00 0.00 57.03 56.51 2cvd h ASP 110 Cb 0.02 0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.20 2cvd h ASP 110 CO -0.00 -0.35 -0.22 0.58 -1.61 0.00 0.00 179.24 177.64 2cvd h VAL 111 N -1.15 1.27 -0.38 2.25 2.07 -1.85 -3.11 116.25 115.35 2cvd h VAL 111 Ca -0.09 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.15 2cvd h VAL 111 Cb 0.69 1.18 -0.07 0.00 -1.52 0.00 0.00 31.29 31.57 2cvd h VAL 111 CO 0.14 0.46 -0.04 0.50 0.02 0.00 0.00 177.57 178.65 2cvd h LYS 112 N 0.74 0.05 -0.48 1.57 3.64 -1.19 0.08 116.57 120.97 2cvd h LYS 112 Ca 0.10 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2cvd h LYS 112 Cb 0.75 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2cvd h LYS 112 CO 0.06 0.03 0.21 1.49 -2.27 0.00 0.00 179.45 178.97 2cvd h GLU 113 N 0.05 0.71 -0.87 1.90 4.22 -1.48 -2.15 114.58 116.96 2cvd h GLU 113 Ca 0.18 -0.12 -0.00 0.00 0.08 0.00 0.00 59.36 59.50 2cvd h GLU 113 Cb 0.27 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2cvd h GLU 113 CO -0.34 0.62 0.53 0.37 -2.18 0.00 0.00 179.01 178.01 2cvd h GLN 114 N 0.63 1.18 -0.48 1.92 5.75 -1.35 -2.46 115.11 120.30 2cvd h GLN 114 Ca 0.16 -0.10 -0.12 0.00 -0.15 0.00 0.00 58.65 58.44 2cvd h GLN 114 Cb 0.16 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 2cvd h GLN 114 CO -0.02 0.82 -0.16 0.52 -2.65 0.00 0.00 178.83 177.34 2cvd h MET 115 N 1.20 0.96 -0.11 1.69 2.86 -0.79 -1.91 114.93 118.84 2cvd h MET 115 Ca 0.31 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2cvd h MET 115 Cb -0.06 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 2cvd h MET 115 CO -0.06 1.06 0.07 0.74 1.06 0.00 0.00 176.91 179.78 2cvd h PHE 116 N 0.82 0.13 -0.88 -0.22 -1.00 -1.18 -0.76 116.94 113.84 2cvd h PHE 116 Ca 0.12 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 2cvd h PHE 116 Cb 0.73 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 40.21 2cvd h PHE 116 CO 0.05 0.08 0.52 -0.91 -1.61 0.00 0.00 178.31 176.44 2cvd h ASN 117 N 0.14 1.06 -0.37 2.17 4.21 -1.40 -1.28 115.58 120.11 2cvd h ASN 117 Ca 0.04 -0.07 -0.04 0.00 1.21 0.00 0.00 56.30 57.44 2cvd h ASN 117 Cb -0.01 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 36.90 2cvd h ASN 117 CO -0.01 0.82 0.07 -0.08 -1.29 0.00 0.00 177.43 176.95 2cvd h GLU 118 N 1.22 0.61 -0.53 0.81 4.57 -1.02 0.14 114.58 120.37 2cvd h GLU 118 Ca 0.31 -0.16 -0.08 0.00 -1.18 0.00 0.00 59.36 58.26 2cvd h GLU 118 Cb -0.04 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 2cvd h GLU 118 CO -0.06 0.66 0.02 -0.07 -1.18 0.00 0.00 179.01 178.39 2cvd h LEU 119 N 0.46 0.85 0.04 1.64 3.38 -0.84 0.16 115.31 121.00 2cvd h LEU 119 Ca 0.12 -0.21 -0.28 0.00 0.09 0.00 0.00 57.88 57.60 2cvd h LEU 119 Cb 0.34 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 40.88 2cvd h LEU 119 CO 0.00 0.90 -1.13 -0.07 0.09 0.00 0.00 178.44 178.24 2cvd h LEU 120 N 0.83 0.86 0.13 1.67 3.38 -1.12 0.31 115.31 121.37 2cvd h LEU 120 Ca 0.16 -0.74 -0.30 0.00 0.09 0.00 0.00 57.88 57.10 2cvd h LEU 120 Cb 0.46 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2cvd h LEU 120 CO 0.02 1.54 -1.43 0.74 0.09 0.00 0.00 178.44 179.40 2cvd h THR 121 N 0.33 1.28 0.00 0.22 2.02 -0.96 -3.37 112.91 112.43 2cvd h THR 121 Ca -0.15 -2.88 0.00 0.00 0.77 0.00 0.00 66.41 64.15 2cvd h THR 121 Cb 1.79 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 71.04 2cvd h THR 121 CO 0.22 0.84 -0.59 0.00 0.37 0.00 0.00 175.52 176.36 2cvd n TYR 122 N -3.50 0.00 -0.10 3.16 9.36 0.04 -4.63 117.16 121.48 2cvd n TYR 122 Ca -0.14 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 60.98 2cvd n TYR 122 Cb 1.04 -0.29 -0.03 0.00 -0.63 0.00 0.00 39.34 39.43 2cvd n TYR 122 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 2cvd h ASN 123 N -0.59 0.48 -0.35 2.98 4.21 -1.49 -3.27 115.58 117.54 2cvd h ASN 123 Ca 0.00 -0.24 0.08 0.00 1.21 0.00 0.00 56.30 57.35 2cvd h ASN 123 Cb 0.59 -0.13 -0.08 0.00 -1.12 0.00 0.00 38.32 37.58 2cvd h ASN 123 CO 0.00 0.59 -0.20 0.00 -1.29 0.00 0.00 177.43 176.53 2cvd h ALA 124 N 0.91 0.05 -0.75 -0.83 0.00 -0.54 -1.70 119.26 116.40 2cvd h ALA 124 Ca 0.10 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.17 2cvd h ALA 124 Cb 0.30 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2cvd h ALA 124 CO 0.00 -0.58 0.49 -1.35 0.00 0.00 0.00 179.25 177.82 2cvd h PRO 125 N -0.14 0.87 -0.44 0.00 0.11 -1.75 -0.78 132.00 129.86 2cvd h PRO 125 Ca 0.18 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.20 2cvd h PRO 125 Cb 0.42 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 2cvd h PRO 125 CO -0.44 0.57 0.15 0.45 -0.21 0.00 0.00 178.00 178.52 2cvd h HIS 126 N 0.89 0.70 -0.57 0.65 3.86 -1.39 -1.79 115.15 117.50 2cvd h HIS 126 Ca 0.30 -0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.40 2cvd h HIS 126 Cb 0.09 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 2cvd h HIS 126 CO -0.00 0.62 0.15 1.25 0.86 0.00 0.00 177.93 180.82 2cvd h LEU 127 N 0.58 0.86 -0.90 2.43 5.85 -0.71 -1.66 115.31 121.76 2cvd h LEU 127 Ca 0.14 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.65 2cvd h LEU 127 Cb 0.24 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2cvd h LEU 127 CO -0.01 0.86 0.60 0.24 -0.34 0.00 0.00 178.44 179.79 2cvd h MET 128 N 0.82 1.19 -0.55 1.25 2.86 -0.96 -0.13 114.93 119.40 2cvd h MET 128 Ca 0.18 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.67 2cvd h MET 128 Cb 0.33 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2cvd h MET 128 CO -0.00 0.79 0.05 0.37 1.06 0.00 0.00 176.91 179.18 2cvd h GLN 129 N 1.22 0.94 -0.64 1.72 5.75 -1.03 -0.62 115.11 122.44 2cvd h GLN 129 Ca 0.33 -0.27 -0.05 0.00 -0.15 0.00 0.00 58.65 58.50 2cvd h GLN 129 Cb -0.14 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.29 2cvd h GLN 129 CO -0.07 0.92 0.19 -0.44 -2.65 0.00 0.00 178.83 176.78 2cvd h ASP 130 N 0.82 0.95 -0.56 -0.69 3.32 -0.77 -1.63 116.42 117.87 2cvd h ASP 130 Ca 0.16 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 56.89 2cvd h ASP 130 Cb 0.47 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2cvd h ASP 130 CO 0.02 0.91 -0.08 -0.07 -1.72 0.00 0.00 179.24 178.31 2cvd h LEU 131 N 0.94 1.04 -0.47 1.55 3.38 -0.85 -0.48 115.31 120.41 2cvd h LEU 131 Ca 0.21 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2cvd h LEU 131 Cb 0.31 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2cvd h LEU 131 CO -0.00 1.13 0.22 -0.78 0.09 0.00 0.00 178.44 179.10 2cvd h ASP 132 N 0.93 0.62 -0.55 -0.43 -0.00 -0.93 -0.29 116.42 115.77 2cvd h ASP 132 Ca 0.15 -0.13 -0.10 0.00 -0.00 0.00 0.00 57.03 56.95 2cvd h ASP 132 Cb 0.64 -0.16 -0.02 0.00 -0.00 0.00 0.00 39.33 39.80 2cvd h ASP 132 CO 0.04 0.57 -0.04 0.74 -0.00 0.00 0.00 179.24 180.56 2cvd h THR 133 N 0.62 1.26 -0.56 2.25 2.02 -1.16 0.07 112.91 117.41 2cvd h THR 133 Ca 0.16 -1.18 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 2cvd h THR 133 Cb 0.12 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 2cvd h THR 133 CO -0.02 0.42 0.28 0.22 0.37 0.00 0.00 175.52 176.80 2cvd h TYR 134 N 0.93 0.79 -0.38 3.16 3.20 -0.76 -2.84 116.97 121.06 2cvd h TYR 134 Ca 0.16 -0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.88 2cvd h TYR 134 Cb 0.59 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2cvd h TYR 134 CO 0.04 0.59 -0.22 1.25 -1.64 0.00 0.00 178.16 178.19 2cvd h LEU 135 N 0.75 0.84 0.00 2.82 5.85 -0.87 -3.48 115.31 121.22 2cvd h LEU 135 Ca 0.19 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.50 2cvd h LEU 135 Cb 0.09 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2cvd h LEU 135 CO -0.03 1.08 0.00 0.61 -0.34 0.00 0.00 178.44 179.76 2cvd n GLY 136 N -0.02 2.55 1.23 3.75 0.00 -0.00 -1.95 105.19 110.75 2cvd n GLY 136 Ca -0.02 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.64 2cvd n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cvd n GLY 137 N 0.00 2.06 3.84 -0.02 0.00 -1.26 -4.94 105.19 104.87 2cvd n GLY 137 Ca 0.00 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 2cvd n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cvd s ARG 138 N -1.89 3.38 -0.02 1.61 0.52 -0.82 -5.00 118.95 116.73 2cvd s ARG 138 Ca 0.34 0.89 -0.22 0.00 -0.52 0.00 0.00 55.73 56.22 2cvd s ARG 138 Cb 0.23 -2.05 -0.21 0.00 0.52 0.00 0.00 34.95 33.44 2cvd s ARG 138 CO 0.14 -0.74 1.12 1.49 0.02 0.00 0.00 175.30 177.32 2cvd h GLU 139 N -0.24 0.28 -5.70 3.54 4.81 -1.90 -3.47 114.58 111.91 2cvd h GLU 139 Ca -0.45 -0.25 -0.52 0.00 -0.13 0.00 0.00 59.36 58.01 2cvd h GLU 139 Cb 1.20 0.06 -0.14 0.00 0.63 0.00 0.00 28.75 30.50 2cvd h GLU 139 CO 0.60 0.93 -0.71 -1.58 -0.73 0.00 0.00 179.01 177.52 2cvd s TRP 140 N -3.41 2.00 0.24 0.92 0.52 -1.26 -4.87 118.94 113.08 2cvd s TRP 140 Ca -0.15 -0.57 -0.06 0.00 0.02 0.00 0.00 56.10 55.34 2cvd s TRP 140 Cb 0.03 -1.04 0.24 0.00 -1.15 0.00 0.00 33.47 31.55 2cvd s TRP 140 CO 0.77 0.42 1.87 -0.07 0.02 0.00 0.00 176.95 179.95 2cvd h LEU 141 N 2.32 1.11 -8.08 2.99 3.38 -1.90 -3.43 115.31 111.70 2cvd h LEU 141 Ca -0.40 -0.09 -0.46 0.00 0.09 0.00 0.00 57.88 57.02 2cvd h LEU 141 Cb 1.24 -0.28 -0.30 0.00 0.09 0.00 0.00 40.66 41.40 2cvd h LEU 141 CO 0.65 0.88 -0.80 -0.63 0.09 0.00 0.00 178.44 178.63 2cvd s ILE 142 N -5.84 0.97 0.00 1.22 1.09 -1.26 -4.91 121.20 112.47 2cvd s ILE 142 Ca -0.13 -0.49 0.00 0.00 -1.10 0.00 0.00 60.65 58.94 2cvd s ILE 142 Cb 0.17 -0.84 0.00 0.00 -1.06 0.00 0.00 42.46 40.73 2cvd s ILE 142 CO 0.83 0.29 0.00 0.61 -0.10 0.00 0.00 174.94 176.57 2cvd n GLY 143 N 3.10 0.53 0.83 6.18 0.00 -1.26 -4.11 105.19 110.46 2cvd n GLY 143 Ca -0.17 -0.87 0.07 0.00 0.00 0.00 0.00 46.02 45.06 2cvd n GLY 143 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2cvd n MET 144 N 0.00 2.97 -3.86 1.61 0.00 -1.26 -4.59 117.12 111.99 2cvd n MET 144 Ca 0.00 -2.51 -0.09 0.00 0.00 0.00 0.00 57.70 55.10 2cvd n MET 144 Cb 0.00 -1.61 -0.07 0.00 0.00 0.00 0.00 33.22 31.54 2cvd n MET 144 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2cvd s SER 145 N -1.47 0.10 0.44 3.17 1.04 -1.26 -4.96 113.70 110.76 2cvd s SER 145 Ca 0.35 -0.67 -0.26 0.00 0.48 0.00 0.00 55.95 55.85 2cvd s SER 145 Cb 0.25 0.35 -0.09 0.00 0.10 0.00 0.00 66.02 66.63 2cvd s SER 145 CO 0.13 -0.75 1.40 0.54 0.98 0.00 0.00 173.24 175.54 2cvd s VAL 146 N -3.87 2.19 0.28 5.02 0.11 -1.26 -4.75 120.40 118.12 2cvd s VAL 146 Ca 0.06 0.17 0.02 0.00 -2.93 0.00 0.00 61.98 59.30 2cvd s VAL 146 Cb 0.05 -3.10 -0.06 0.00 -1.53 0.00 0.00 36.38 31.74 2cvd s VAL 146 CO -0.10 0.03 0.08 0.42 -3.33 0.00 0.00 175.10 172.20 2cvd s THR 147 N -1.21 0.78 -1.20 5.04 -4.23 -1.26 -4.52 115.64 109.04 2cvd s THR 147 Ca 0.60 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.23 2cvd s THR 147 Cb -0.43 -2.69 0.16 0.00 1.34 0.00 0.00 72.50 70.88 2cvd s THR 147 CO 0.55 0.00 1.35 -2.67 -0.54 0.00 0.00 174.62 173.31 2cvd n TRP 148 N -0.55 0.00 0.01 3.99 4.27 -0.77 -1.29 117.44 123.11 2cvd n TRP 148 Ca -0.01 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.50 2cvd n TRP 148 Cb 0.66 -0.40 0.04 0.00 -1.36 0.00 0.00 31.31 30.26 2cvd n TRP 148 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2cvd h ALA 149 N 2.50 0.66 -0.53 -1.67 0.00 -1.87 -1.09 119.26 117.26 2cvd h ALA 149 Ca 0.00 -0.53 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 2cvd h ALA 149 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2cvd h ALA 149 CO 0.00 0.70 -0.06 -0.44 0.00 0.00 0.00 179.25 179.44 2cvd h ASP 150 N 0.42 0.94 -0.37 0.00 3.45 -1.59 -1.25 116.42 118.02 2cvd h ASP 150 Ca 0.00 -0.28 -0.01 0.00 0.43 0.00 0.00 57.03 57.17 2cvd h ASP 150 Cb 1.13 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.63 2cvd h ASP 150 CO 0.11 1.04 0.20 -0.26 -1.57 0.00 0.00 179.24 178.76 2cvd h PHE 151 N 0.87 0.50 -0.32 4.55 -1.00 -1.41 -2.00 116.94 118.13 2cvd h PHE 151 Ca 0.15 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.85 2cvd h PHE 151 Cb 0.60 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.98 2cvd h PHE 151 CO 0.04 0.39 -0.10 -0.92 -1.61 0.00 0.00 178.31 176.11 2cvd h TYR 152 N 0.47 0.57 -0.20 -0.55 3.20 -0.97 -0.85 116.97 118.63 2cvd h TYR 152 Ca 0.13 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2cvd h TYR 152 Cb 0.05 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2cvd h TYR 152 CO -0.03 0.62 0.10 2.35 -1.64 0.00 0.00 178.16 179.56 2cvd h TRP 153 N 0.50 0.28 -0.73 -3.82 2.91 -0.92 0.52 115.95 114.69 2cvd h TRP 153 Ca 0.09 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.06 2cvd h TRP 153 Cb 0.47 -0.09 -0.03 0.00 -0.51 0.00 0.00 29.16 29.00 2cvd h TRP 153 CO 0.02 0.28 0.31 1.49 -1.03 0.00 0.00 178.44 179.51 2cvd h GLU 154 N 0.20 1.09 -0.09 2.65 4.22 -0.97 -0.53 114.58 121.14 2cvd h GLU 154 Ca 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 59.36 59.31 2cvd h GLU 154 Cb 0.10 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2cvd h GLU 154 CO -0.01 0.88 0.02 0.82 -2.18 0.00 0.00 179.01 178.55 2cvd h ILE 155 N 1.05 1.19 -0.31 2.32 2.04 -0.93 -1.11 117.51 121.75 2cvd h ILE 155 Ca 0.25 -0.57 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2cvd h ILE 155 Cb 0.19 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2cvd h ILE 155 CO -0.02 0.16 -0.00 0.00 0.00 0.00 0.00 178.15 178.29 2cvd h SER 157 N 0.35 0.59 -0.48 0.00 4.64 -1.10 -1.43 113.55 116.12 2cvd h SER 157 Ca 0.09 -0.12 0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2cvd h SER 157 Cb 0.44 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 2cvd h SER 157 CO 0.02 0.66 0.30 0.74 -0.87 0.00 0.00 176.83 177.68 2cvd h THR 158 N 0.59 1.09 -0.26 2.95 2.02 -1.09 0.53 112.91 118.73 2cvd h THR 158 Ca 0.12 -0.21 -0.17 0.00 0.77 0.00 0.00 66.41 66.92 2cvd h THR 158 Cb 0.38 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2cvd h THR 158 CO 0.01 0.11 -0.51 0.74 0.37 0.00 0.00 175.52 176.24 2cvd h THR 159 N 0.61 1.29 -0.41 3.16 2.02 -1.32 -3.04 112.91 115.22 2cvd h THR 159 Ca 0.18 -1.72 -0.06 0.00 0.77 0.00 0.00 66.41 65.59 2cvd h THR 159 Cb -0.03 1.64 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2cvd h THR 159 CO -0.06 0.55 0.01 -0.07 0.37 0.00 0.00 175.52 176.32 2cvd h LEU 160 N 0.58 0.62 -2.41 2.58 3.38 -0.93 -2.01 115.31 117.12 2cvd h LEU 160 Ca 0.02 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2cvd h LEU 160 Cb 1.09 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 2cvd h LEU 160 CO 0.11 0.68 -0.03 -0.07 0.09 0.00 0.00 178.44 179.22 2cvd h LEU 161 N 0.62 0.00 -0.60 1.67 3.38 -0.78 0.12 115.31 119.72 2cvd h LEU 161 Ca 0.13 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2cvd h LEU 161 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2cvd h LEU 161 CO 0.01 0.03 -0.34 0.58 0.09 0.00 0.00 178.44 178.81 2cvd h VAL 162 N 0.00 1.28 0.00 1.22 2.07 -1.34 -2.39 116.25 117.10 2cvd h VAL 162 Ca -0.00 -1.49 -0.25 0.00 0.82 0.00 0.00 66.70 65.78 2cvd h VAL 162 Cb 0.16 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 2cvd h VAL 162 CO 0.00 0.49 -1.40 -0.26 0.02 0.00 0.00 177.57 176.42 2cvd h PHE 163 N 0.62 0.00 -2.31 1.57 -1.00 -1.25 -3.42 116.94 111.16 2cvd h PHE 163 Ca 0.06 0.00 -0.53 0.00 2.81 0.00 0.00 57.97 60.31 2cvd h PHE 163 Cb 0.87 0.00 -0.36 0.00 3.61 0.00 0.00 35.95 40.07 2cvd h PHE 163 CO 0.04 0.94 -0.87 0.21 -1.61 0.00 0.00 178.31 177.03 2cvd s LYS 164 N -2.68 0.75 0.52 1.51 2.20 0.28 -5.02 119.74 117.31 2cvd s LYS 164 Ca -0.02 -1.62 0.25 0.00 -0.36 0.00 0.00 55.97 54.22 2cvd s LYS 164 Cb 0.09 -1.20 1.37 0.00 -1.51 0.00 0.00 37.83 36.57 2cvd s LYS 164 CO 0.82 -1.30 1.96 -1.35 -0.36 0.00 0.00 175.35 175.12 2cvd h PRO 165 N 6.26 0.06 -0.46 4.03 0.11 -1.67 -1.92 132.00 138.39 2cvd h PRO 165 Ca 0.16 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2cvd h PRO 165 Cb 0.96 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2cvd h PRO 165 CO 0.29 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.72 2cvd n ASP 166 N -4.37 2.37 -0.32 -2.05 5.68 -1.26 -4.49 116.55 112.10 2cvd n ASP 166 Ca 0.12 -2.08 0.16 0.00 -0.50 0.00 0.00 54.79 52.49 2cvd n ASP 166 Cb 0.67 -0.32 0.35 0.00 -1.14 0.00 0.00 41.12 40.68 2cvd n ASP 166 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 2cvd h LEU 167 N 2.31 0.41 -3.31 -2.12 5.85 -1.72 -2.46 115.31 114.26 2cvd h LEU 167 Ca 0.00 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2cvd h LEU 167 Cb 0.66 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 2cvd h LEU 167 CO 0.04 -0.01 0.01 0.18 -0.34 0.00 0.00 178.44 178.32 2cvd n LEU 168 N -5.02 4.17 0.20 2.25 4.77 -1.26 -4.65 117.00 117.46 2cvd n LEU 168 Ca 0.25 -3.05 0.07 0.00 -0.03 0.00 0.00 56.01 53.25 2cvd n LEU 168 Cb 0.73 -0.57 0.60 0.00 -2.33 0.00 0.00 43.42 41.85 2cvd n LEU 168 CO 0.13 0.70 1.09 0.44 -1.33 0.00 0.00 177.39 178.42 2cvd h ASP 169 N 2.02 0.09 -0.64 -1.43 5.19 -1.75 -1.84 116.42 118.06 2cvd h ASP 169 Ca 0.02 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2cvd h ASP 169 Cb 1.54 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 41.03 2cvd h ASP 169 CO 0.28 0.06 0.00 0.59 -3.12 0.00 0.00 179.24 177.05 2cvd n ASN 170 N -4.52 3.84 -3.26 6.45 5.03 -1.26 -4.66 115.26 116.88 2cvd n ASN 170 Ca -0.02 -2.00 -0.25 0.00 0.87 0.00 0.00 54.58 53.19 2cvd n ASN 170 Cb 0.10 -0.43 -0.07 0.00 -1.02 0.00 0.00 39.78 38.36 2cvd n ASN 170 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2cvd n HIS 171 N 1.62 0.70 0.12 3.10 8.25 -0.69 -4.96 115.22 123.36 2cvd n HIS 171 Ca 0.23 -3.72 0.12 0.00 -0.26 0.00 0.00 57.72 54.10 2cvd n HIS 171 Cb 0.62 -0.40 0.63 0.00 1.12 0.00 0.00 29.99 31.96 2cvd n HIS 171 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2cvd h PRO 172 N 4.08 0.08 -0.06 -0.41 0.13 -1.83 -1.57 132.00 132.42 2cvd h PRO 172 Ca 0.11 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.16 2cvd h PRO 172 Cb 0.82 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 2cvd h PRO 172 CO 0.56 0.05 -0.31 0.00 -0.23 0.00 0.00 178.00 178.07 2cvd h ARG 173 N 0.08 0.11 0.00 0.86 3.08 -1.93 0.47 114.38 117.05 2cvd h ARG 173 Ca 0.12 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.97 2cvd h ARG 173 Cb 0.39 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2cvd h ARG 173 CO -0.01 0.41 -0.78 -0.07 -1.07 0.00 0.00 179.97 178.46 2cvd h LEU 174 N 0.10 0.00 -0.21 3.04 3.38 -1.68 -2.29 115.31 117.64 2cvd h LEU 174 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2cvd h LEU 174 Cb 0.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2cvd h LEU 174 CO 0.04 0.78 -0.33 0.58 0.09 0.00 0.00 178.44 179.60 2cvd h VAL 175 N 0.00 1.33 -0.74 1.22 2.07 -1.17 -2.47 116.25 116.49 2cvd h VAL 175 Ca -0.01 -1.54 0.03 0.00 0.82 0.00 0.00 66.70 66.00 2cvd h VAL 175 Cb 1.38 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.91 2cvd h VAL 175 CO 0.10 0.48 0.46 0.74 0.02 0.00 0.00 177.57 179.37 2cvd h THR 176 N 0.28 1.10 -0.73 2.57 2.02 -0.86 -0.73 112.91 116.57 2cvd h THR 176 Ca 0.02 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2cvd h THR 176 Cb 0.92 0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.41 2cvd h THR 176 CO 0.08 0.17 0.46 0.25 0.37 0.00 0.00 175.52 176.84 2cvd h LEU 177 N 0.91 0.87 -0.24 2.58 5.85 -1.33 -0.34 115.31 123.60 2cvd h LEU 177 Ca 0.30 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2cvd h LEU 177 Cb 0.02 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2cvd h LEU 177 CO -0.11 0.66 0.12 0.03 -0.34 0.00 0.00 178.44 178.79 2cvd h ARG 178 N 1.00 0.24 -0.39 1.25 3.08 -0.85 -2.02 114.38 116.69 2cvd h ARG 178 Ca 0.26 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.26 2cvd h ARG 178 Cb -0.06 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2cvd h ARG 178 CO -0.05 0.16 0.09 0.87 -1.07 0.00 0.00 179.97 179.96 2cvd h LYS 179 N 0.25 0.57 -0.66 0.04 1.57 -0.67 -0.62 116.57 117.04 2cvd h LYS 179 Ca 0.10 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2cvd h LYS 179 Cb 0.03 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 2cvd h LYS 179 CO -0.07 0.53 0.12 0.87 -0.57 0.00 0.00 179.45 180.33 2cvd h LYS 180 N 0.56 1.07 -0.24 3.15 1.57 -0.60 -0.13 116.57 121.96 2cvd h LYS 180 Ca 0.13 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.54 2cvd h LYS 180 Cb 0.23 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2cvd h LYS 180 CO -0.00 0.97 -0.23 0.28 -0.57 0.00 0.00 179.45 179.90 2cvd h VAL 181 N 1.01 1.32 0.00 0.50 2.07 -0.84 -2.96 116.25 117.35 2cvd h VAL 181 Ca 0.20 -1.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 2cvd h VAL 181 Cb 0.41 1.69 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2cvd h VAL 181 CO 0.01 0.43 -0.07 1.56 0.02 0.00 0.00 177.57 179.53 2cvd h GLN 182 N 0.27 0.00 0.00 1.57 4.20 -0.90 -2.52 115.11 117.74 2cvd h GLN 182 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2cvd h GLN 182 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2cvd h GLN 182 CO 0.06 0.07 -0.29 0.00 -0.67 0.00 0.00 178.83 178.00 2cvd n ALA 183 N -2.19 2.93 -1.93 3.87 0.00 -0.08 -3.55 120.51 119.57 2cvd n ALA 183 Ca -0.01 -0.22 -0.42 0.00 0.00 0.00 0.00 53.44 52.78 2cvd n ALA 183 Cb 0.22 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 2cvd n ALA 183 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2cvd s ILE 184 N -3.02 3.45 0.10 0.00 1.01 -0.95 -4.78 121.20 117.00 2cvd s ILE 184 Ca 0.12 0.53 -0.19 0.00 0.00 0.00 0.00 60.65 61.11 2cvd s ILE 184 Cb 0.17 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 2cvd s ILE 184 CO 0.63 -0.07 1.01 -2.65 0.00 0.00 0.00 174.94 173.86 2cvd n PRO 185 N 7.33 -0.27 -0.16 2.79 -0.02 -1.26 0.52 135.00 143.92 2cvd n PRO 185 Ca 0.18 0.99 -0.00 0.00 -2.02 0.00 0.00 63.50 62.65 2cvd n PRO 185 Cb 0.43 -1.46 0.25 0.00 -0.02 0.00 0.00 33.50 32.70 2cvd n PRO 185 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cvd h ALA 186 N 0.24 1.40 -0.07 3.55 0.00 -1.90 -0.79 119.26 121.69 2cvd h ALA 186 Ca 0.10 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2cvd h ALA 186 Cb 0.25 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2cvd h ALA 186 CO -0.58 0.49 -0.48 0.28 0.00 0.00 0.00 179.25 178.96 2cvd h VAL 187 N 0.89 1.40 -1.01 0.00 2.07 -1.11 -2.78 116.25 115.71 2cvd h VAL 187 Ca 0.23 -1.87 0.03 0.00 0.82 0.00 0.00 66.70 65.91 2cvd h VAL 187 Cb 0.04 2.33 -0.06 0.00 -1.52 0.00 0.00 31.29 32.08 2cvd h VAL 187 CO -0.04 0.55 0.66 0.00 0.02 0.00 0.00 177.57 178.77 2cvd h ALA 188 N 0.42 1.32 -0.48 1.67 0.00 0.30 -0.31 119.26 122.18 2cvd h ALA 188 Ca -0.04 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2cvd h ALA 188 Cb 1.14 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2cvd h ALA 188 CO 0.10 0.58 -0.04 -0.97 0.00 0.00 0.00 179.25 178.92 2cvd h ASN 189 N 1.30 0.81 -0.25 0.00 -1.24 -1.16 -2.22 115.58 112.82 2cvd h ASN 189 Ca 0.39 -0.22 -0.13 0.00 0.71 0.00 0.00 56.30 57.05 2cvd h ASN 189 Cb -0.04 -0.22 -0.00 0.00 0.73 0.00 0.00 38.32 38.79 2cvd h ASN 189 CO -0.12 0.90 -0.36 -0.25 -1.29 0.00 0.00 177.43 176.31 2cvd h TRP 190 N 0.77 0.85 -0.66 0.67 2.91 -1.08 -2.69 115.95 116.71 2cvd h TRP 190 Ca 0.14 -0.28 0.01 0.00 1.13 0.00 0.00 58.89 59.89 2cvd h TRP 190 Cb 0.52 -0.17 -0.03 0.00 -0.51 0.00 0.00 29.16 28.97 2cvd h TRP 190 CO 0.03 1.04 0.44 0.82 -1.03 0.00 0.00 178.44 179.74 2cvd h ILE 191 N 0.41 1.15 0.00 2.65 2.04 -0.92 0.71 117.51 123.55 2cvd h ILE 191 Ca 0.03 -0.30 -0.16 0.00 1.00 0.00 0.00 64.86 65.43 2cvd h ILE 191 Cb 0.95 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2cvd h ILE 191 CO 0.08 0.16 -0.75 0.50 0.00 0.00 0.00 178.15 178.14 2cvd h LYS 192 N 0.86 0.00 0.00 2.37 3.64 -1.34 -3.34 116.57 118.76 2cvd h LYS 192 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 2cvd h LYS 192 Cb -0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2cvd h LYS 192 CO -0.06 0.75 -1.43 0.54 -2.27 0.00 0.00 179.45 176.98 2cvd n ARG 193 N -3.56 0.50 -1.44 1.90 1.74 -0.96 -5.00 116.66 109.85 2cvd n ARG 193 Ca -0.00 -0.09 -0.33 0.00 -0.77 0.00 0.00 57.85 56.65 2cvd n ARG 193 Cb 0.75 -1.47 0.09 0.00 -1.02 0.00 0.00 32.46 30.81 2cvd n ARG 193 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2cvd s ARG 194 N -3.15 2.23 0.33 5.56 1.70 0.20 -4.93 118.95 120.89 2cvd s ARG 194 Ca 0.00 1.56 -0.29 0.00 -0.47 0.00 0.00 55.73 56.53 2cvd s ARG 194 Cb 0.14 -1.87 -0.11 0.00 -0.57 0.00 0.00 34.95 32.54 2cvd s ARG 194 CO 0.84 -1.72 1.56 -2.14 -1.08 0.00 0.00 175.30 172.76 2cvd s PRO 195 N -4.15 4.11 -0.40 3.89 0.02 -1.26 -4.93 135.00 132.28 2cvd s PRO 195 Ca 0.70 2.59 -0.25 0.00 0.02 0.00 0.00 61.00 64.06 2cvd s PRO 195 Cb -0.24 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.30 2cvd s PRO 195 CO 0.46 -0.60 0.88 -0.65 -0.33 0.00 0.00 177.00 176.76 2cvd s GLN 196 N -1.18 3.70 0.15 5.54 -1.52 -1.26 -4.96 119.66 120.13 2cvd s GLN 196 Ca 0.59 0.34 0.03 0.00 -1.95 0.00 0.00 55.36 54.38 2cvd s GLN 196 Cb -0.48 -3.85 -0.04 0.00 -0.22 0.00 0.00 33.01 28.42 2cvd s GLN 196 CO 0.55 -1.01 -0.07 0.95 -0.25 0.00 0.00 175.29 175.45 2cvd s THR 197 N 3.45 0.97 -0.01 -0.19 -4.23 -1.26 -5.07 115.64 109.30 2cvd s THR 197 Ca 0.36 -2.02 -0.25 0.00 -1.18 0.00 0.00 61.69 58.60 2cvd s THR 197 Cb -0.12 -1.90 -0.19 0.00 1.34 0.00 0.00 72.50 71.64 2cvd s THR 197 CO 0.21 -0.69 1.28 0.50 -0.54 0.00 0.00 174.62 175.37 2cvd h LYS 198 N 2.78 -0.10 -0.02 3.99 3.64 -1.95 -3.48 116.57 121.44 2cvd h LYS 198 Ca -0.36 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2cvd h LYS 198 Cb 1.19 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2cvd h LYS 198 CO 0.64 0.30 0.00 1.28 -2.27 0.00 0.00 179.45 179.40