#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 6.50 -0.10 3.54 -0.87 -1.26 -4.94 114.94 117.80 2cvd s ASN 3 Ca 0.00 0.59 0.01 0.00 -1.57 0.00 0.00 52.86 51.90 2cvd s ASN 3 Cb 0.00 -2.24 -0.02 0.00 -0.02 0.00 0.00 41.25 38.97 2cvd s ASN 3 CO 0.00 -0.05 -0.14 -0.31 -2.57 0.00 0.00 177.10 174.04 2cvd s TYR 4 N 1.08 2.77 -0.18 2.20 1.51 -1.26 -1.50 117.35 121.97 2cvd s TYR 4 Ca 0.21 -0.51 -0.02 0.00 -1.01 0.00 0.00 57.07 55.73 2cvd s TYR 4 Cb -0.15 -1.78 0.06 0.00 -0.11 0.00 0.00 41.96 39.98 2cvd s TYR 4 CO 0.08 -0.10 0.02 0.21 -1.11 0.00 0.00 175.55 174.65 2cvd s LYS 5 N 0.03 0.73 -0.21 -0.62 2.20 -0.64 -0.81 119.74 120.42 2cvd s LYS 5 Ca -0.05 -0.39 -0.14 0.00 -0.36 0.00 0.00 55.97 55.03 2cvd s LYS 5 Cb -0.14 -2.01 -0.04 0.00 -1.51 0.00 0.00 37.83 34.13 2cvd s LYS 5 CO 0.04 -0.59 0.33 -1.17 -0.36 0.00 0.00 175.35 173.60 2cvd s LEU 6 N 1.84 4.15 -0.15 5.43 2.96 -0.04 -0.74 118.68 132.14 2cvd s LEU 6 Ca -0.00 0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 54.31 2cvd s LEU 6 Cb -0.17 -2.39 -0.01 0.00 0.50 0.00 0.00 46.19 44.12 2cvd s LEU 6 CO -0.08 -0.02 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.90 2cvd s THR 7 N 1.17 2.86 0.25 3.68 2.01 -0.57 -0.19 115.64 124.85 2cvd s THR 7 Ca 0.16 -0.71 -0.21 0.00 0.31 0.00 0.00 61.69 61.24 2cvd s THR 7 Cb -0.14 -2.21 0.06 0.00 0.01 0.00 0.00 72.50 70.22 2cvd s THR 7 CO 0.07 0.51 0.92 -0.47 -0.69 0.00 0.00 174.62 174.96 2cvd s TYR 8 N 0.65 0.01 0.99 4.92 5.04 -0.84 -2.52 117.35 125.60 2cvd s TYR 8 Ca -0.07 -0.48 -0.13 0.00 -2.44 0.00 0.00 57.07 53.95 2cvd s TYR 8 Cb -0.16 0.73 0.18 0.00 0.35 0.00 0.00 41.96 43.06 2cvd s TYR 8 CO 0.02 -1.12 1.12 -0.06 -1.34 0.00 0.00 175.55 174.17 2cvd s PHE 9 N -2.65 2.11 -1.27 4.97 0.40 -1.26 -0.97 117.98 119.30 2cvd s PHE 9 Ca 0.17 0.86 -0.16 0.00 -0.60 0.00 0.00 56.93 57.19 2cvd s PHE 9 Cb -0.03 -3.36 0.11 0.00 0.51 0.00 0.00 43.02 40.24 2cvd s PHE 9 CO 0.07 -2.78 1.65 -1.71 0.70 0.00 0.00 175.22 173.14 2cvd n ASN 10 N -4.06 5.02 -3.62 1.36 5.15 -1.23 -4.59 115.26 113.29 2cvd n ASN 10 Ca 0.07 -2.94 -0.07 0.00 -0.60 0.00 0.00 54.58 51.04 2cvd n ASN 10 Cb 0.58 -1.68 -0.02 0.00 -0.53 0.00 0.00 39.78 38.14 2cvd n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2cvd s MET 11 N 3.20 1.09 -0.01 1.20 0.23 -1.26 -4.93 119.30 118.82 2cvd s MET 11 Ca 0.50 -0.51 -0.08 0.00 -1.03 0.00 0.00 55.69 54.57 2cvd s MET 11 Cb 0.02 0.43 -0.04 0.00 -1.53 0.00 0.00 34.83 33.71 2cvd s MET 11 CO 0.05 -0.49 0.56 0.00 -2.03 0.00 0.00 175.02 173.10 2cvd h ARG 12 N 2.00 -0.26 0.00 3.16 3.08 -1.26 -3.45 114.38 117.66 2cvd h ARG 12 Ca -0.24 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2cvd h ARG 12 Cb 1.24 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2cvd h ARG 12 CO 0.29 -0.17 0.00 0.41 -1.07 0.00 0.00 179.97 179.42 2cvd n GLY 13 N 0.48 1.42 0.00 0.04 0.00 -1.26 -1.36 105.19 104.51 2cvd n GLY 13 Ca -0.03 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.86 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 14.00 0.12 0.08 1.61 1.74 -1.26 -3.19 116.66 129.77 2cvd n ARG 14 Ca 0.00 0.06 0.08 0.00 -0.77 0.00 0.00 57.85 57.22 2cvd n ARG 14 Cb 0.00 -1.50 -0.03 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 2.97 0.55 -0.88 7.54 0.00 -1.75 -3.39 119.26 124.30 2cvd h ALA 15 Ca 0.00 -0.27 0.15 0.00 0.00 0.00 0.00 54.91 54.79 2cvd h ALA 15 Cb 0.36 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 2cvd h ALA 15 CO 0.00 0.29 0.57 1.49 0.00 0.00 0.00 179.25 181.60 2cvd h GLU 16 N 0.00 0.62 -0.68 0.00 4.57 -1.18 -0.46 114.58 117.45 2cvd h GLU 16 Ca -0.05 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 2cvd h GLU 16 Cb 1.19 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.60 2cvd h GLU 16 CO 0.01 0.41 0.35 0.97 -1.18 0.00 0.00 179.01 179.58 2cvd h ILE 17 N 0.64 1.21 -0.36 2.32 6.09 -1.81 0.31 117.51 125.91 2cvd h ILE 17 Ca 0.45 -0.56 -0.12 0.00 -1.37 0.00 0.00 64.86 63.26 2cvd h ILE 17 Cb 0.78 0.31 -0.01 0.00 0.47 0.00 0.00 36.82 38.38 2cvd h ILE 17 CO -0.20 0.24 -0.23 0.40 -3.07 0.00 0.00 178.15 175.29 2cvd h ILE 18 N 0.96 1.29 -0.56 2.19 2.04 -1.38 -2.45 117.51 119.60 2cvd h ILE 18 Ca 0.24 -1.37 -0.04 0.00 1.00 0.00 0.00 64.86 64.68 2cvd h ILE 18 Cb 0.06 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2cvd h ILE 18 CO -0.04 0.45 0.17 0.03 0.00 0.00 0.00 178.15 178.77 2cvd h ARG 19 N 0.58 0.83 -0.60 2.37 3.08 -0.71 -1.36 114.38 118.58 2cvd h ARG 19 Ca 0.07 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2cvd h ARG 19 Cb 0.79 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 2cvd h ARG 19 CO 0.06 0.72 0.09 1.88 -1.07 0.00 0.00 179.97 181.66 2cvd h TYR 20 N 0.81 1.06 -0.30 3.04 -1.99 -0.85 -1.60 116.97 117.14 2cvd h TYR 20 Ca 0.19 -0.15 -0.03 0.00 2.00 0.00 0.00 58.73 60.74 2cvd h TYR 20 Cb 0.24 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.67 2cvd h TYR 20 CO 0.01 0.92 0.08 0.82 -0.00 0.00 0.00 178.16 179.99 2cvd h ILE 21 N 0.89 1.22 -0.78 -2.88 2.04 -0.95 0.38 117.51 117.42 2cvd h ILE 21 Ca 0.18 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.33 2cvd h ILE 21 Cb 0.43 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2cvd h ILE 21 CO 0.01 0.24 0.51 -0.26 0.00 0.00 0.00 178.15 178.65 2cvd h PHE 22 N 0.33 0.97 0.06 1.37 0.05 -1.16 -1.07 116.94 117.49 2cvd h PHE 22 Ca 0.10 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.91 2cvd h PHE 22 Cb 0.29 -0.33 0.00 0.00 2.00 0.00 0.00 35.95 37.91 2cvd h PHE 22 CO 0.01 0.59 -0.03 0.00 -0.18 0.00 0.00 178.31 178.71 2cvd h ALA 23 N 1.30 -0.08 -0.96 2.45 0.00 -0.94 -0.72 119.26 120.30 2cvd h ALA 23 Ca 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2cvd h ALA 23 Cb -0.09 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2cvd h ALA 23 CO -0.08 -0.49 0.61 -0.92 0.00 0.00 0.00 179.25 178.37 2cvd h TYR 24 N -0.18 1.23 -0.00 0.00 3.20 -0.67 -1.90 116.97 118.64 2cvd h TYR 24 Ca -0.01 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2cvd h TYR 24 Cb 0.16 -0.41 0.00 0.00 1.54 0.00 0.00 36.73 38.02 2cvd h TYR 24 CO -0.04 0.80 -0.06 1.28 -1.64 0.00 0.00 178.16 178.50 2cvd n LEU 25 N -4.38 0.31 -3.49 2.82 4.77 -0.43 -4.93 117.00 111.67 2cvd n LEU 25 Ca 0.11 0.06 -0.18 0.00 -0.03 0.00 0.00 56.01 55.96 2cvd n LEU 25 Cb 0.03 -0.17 0.08 0.00 -2.33 0.00 0.00 43.42 41.03 2cvd n LEU 25 CO 0.37 0.06 0.10 -0.67 -1.33 0.00 0.00 177.39 175.92 2cvd n ASP 26 N -1.00 -2.34 -4.46 -1.43 4.64 -0.42 -5.00 116.55 106.54 2cvd n ASP 26 Ca 0.16 -0.64 -0.33 0.00 -1.38 0.00 0.00 54.79 52.59 2cvd n ASP 26 Cb 0.24 -4.95 -0.13 0.00 -1.04 0.00 0.00 41.12 35.25 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 -3.40 3.63 0.40 5.18 1.01 -0.41 -5.05 121.20 122.56 2cvd s ILE 27 Ca 0.06 -0.46 -0.23 0.00 0.00 0.00 0.00 60.65 60.03 2cvd s ILE 27 Cb -0.03 -2.56 -0.10 0.00 0.01 0.00 0.00 42.46 39.78 2cvd s ILE 27 CO 0.74 0.51 0.98 -1.10 0.00 0.00 0.00 174.94 176.07 2cvd s GLN 28 N 0.28 4.26 0.14 2.79 -1.52 -1.26 -4.66 119.66 119.69 2cvd s GLN 28 Ca -0.05 1.27 -0.24 0.00 -1.95 0.00 0.00 55.36 54.39 2cvd s GLN 28 Cb -0.15 -2.40 0.07 0.00 -0.22 0.00 0.00 33.01 30.32 2cvd s GLN 28 CO 0.04 -0.02 0.69 1.52 -0.25 0.00 0.00 175.29 177.27 2cvd s TYR 29 N -1.91 -0.45 -0.36 0.91 -0.85 -1.26 -4.65 117.35 108.77 2cvd s TYR 29 Ca 0.59 0.23 -0.20 0.00 -0.52 0.00 0.00 57.07 57.17 2cvd s TYR 29 Cb -0.15 0.57 0.00 0.00 0.38 0.00 0.00 41.96 42.77 2cvd s TYR 29 CO 0.19 -0.82 0.60 -2.00 -1.52 0.00 0.00 175.55 172.00 2cvd s GLU 30 N -3.61 3.63 -1.08 -3.49 2.12 0.01 -4.98 118.70 111.30 2cvd s GLU 30 Ca 0.03 -0.04 -0.16 0.00 0.36 0.00 0.00 54.97 55.17 2cvd s GLU 30 Cb -0.01 -3.82 0.15 0.00 0.26 0.00 0.00 34.13 30.71 2cvd s GLU 30 CO -0.10 -0.73 1.30 0.34 -0.54 0.00 0.00 175.26 175.53 2cvd s ASP 31 N 1.80 6.87 -0.50 -1.70 3.68 -1.26 -0.86 116.67 124.70 2cvd s ASP 31 Ca 0.23 -2.56 -0.28 0.00 2.13 0.00 0.00 52.55 52.07 2cvd s ASP 31 Cb -0.15 -2.40 0.03 0.00 -1.45 0.00 0.00 42.92 38.95 2cvd s ASP 31 CO 0.15 -0.90 1.07 -2.28 0.13 0.00 0.00 175.17 173.34 2cvd s HIS 32 N 2.11 2.81 -0.30 -5.34 5.65 0.74 -5.00 115.29 115.97 2cvd s HIS 32 Ca 0.38 0.52 -0.08 0.00 0.25 0.00 0.00 55.06 56.13 2cvd s HIS 32 Cb -0.04 -4.30 0.00 0.00 -1.18 0.00 0.00 32.58 27.07 2cvd s HIS 32 CO -0.04 -1.28 0.10 1.03 -0.65 0.00 0.00 174.74 173.90 2cvd s ARG 33 N 4.30 3.19 0.02 2.88 0.52 -1.26 -1.98 118.95 126.62 2cvd s ARG 33 Ca 0.43 -0.80 -0.05 0.00 -0.52 0.00 0.00 55.73 54.79 2cvd s ARG 33 Cb -0.08 -3.43 -0.05 0.00 0.52 0.00 0.00 34.95 31.91 2cvd s ARG 33 CO 0.28 -0.43 0.26 0.96 0.02 0.00 0.00 175.30 176.40 2cvd s ILE 34 N 1.54 5.32 0.54 1.52 -4.36 -0.14 -4.78 121.20 120.84 2cvd s ILE 34 Ca 0.03 0.06 -0.16 0.00 -0.26 0.00 0.00 60.65 60.32 2cvd s ILE 34 Cb -0.17 -3.57 -0.07 0.00 1.25 0.00 0.00 42.46 39.90 2cvd s ILE 34 CO 0.04 0.32 1.01 -1.61 0.24 0.00 0.00 174.94 174.93 2cvd s GLU 35 N -1.91 3.78 0.29 0.37 0.41 -1.26 -3.50 118.70 116.88 2cvd s GLU 35 Ca 0.29 1.00 0.03 0.00 -0.41 0.00 0.00 54.97 55.89 2cvd s GLU 35 Cb -0.13 -2.11 0.68 0.00 -1.78 0.00 0.00 34.13 30.79 2cvd s GLU 35 CO 0.18 -0.42 1.75 0.37 -0.49 0.00 0.00 175.26 176.65 2cvd h GLN 36 N 0.73 0.60 0.00 1.61 5.75 -1.99 -0.97 115.11 120.85 2cvd h GLN 36 Ca -0.47 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 57.98 2cvd h GLN 36 Cb 1.19 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.60 2cvd h GLN 36 CO 0.61 0.40 -0.07 0.00 -2.65 0.00 0.00 178.83 177.11 2cvd h ALA 37 N 1.64 1.25 -0.01 3.38 0.00 -2.05 -2.42 119.26 121.03 2cvd h ALA 37 Ca 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2cvd h ALA 37 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2cvd h ALA 37 CO -0.41 0.09 -0.14 -0.25 0.00 0.00 0.00 179.25 178.53 2cvd n ASP 38 N -3.53 1.57 -0.04 0.00 8.00 -0.37 -4.36 116.55 117.82 2cvd n ASP 38 Ca -0.02 -1.34 -0.13 0.00 0.71 0.00 0.00 54.79 54.00 2cvd n ASP 38 Cb 0.19 0.10 -0.09 0.00 -0.02 0.00 0.00 41.12 41.30 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 2.24 0.24 -0.71 1.24 -0.00 -1.39 -3.29 115.95 114.28 2cvd h TRP 39 Ca 0.00 -0.08 0.16 0.00 -0.00 0.00 0.00 58.89 58.97 2cvd h TRP 39 Cb 0.59 -0.05 -0.12 0.00 -0.00 0.00 0.00 29.16 29.58 2cvd h TRP 39 CO 0.00 0.67 0.05 -1.35 -0.00 0.00 0.00 178.44 177.81 2cvd h PRO 40 N -0.26 0.14 0.00 2.65 0.11 -1.76 0.27 132.00 133.15 2cvd h PRO 40 Ca 0.01 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2cvd h PRO 40 Cb 0.64 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.72 2cvd h PRO 40 CO 0.02 0.09 0.00 0.39 -0.21 0.00 0.00 178.00 178.30 2cvd n GLU 41 N -5.28 0.23 -0.03 1.05 1.02 -1.25 -2.74 120.64 113.63 2cvd n GLU 41 Ca 0.13 0.38 -0.21 0.00 -0.02 0.00 0.00 57.16 57.43 2cvd n GLU 41 Cb 0.44 -1.88 -0.13 0.00 -0.02 0.00 0.00 31.44 29.85 2cvd n GLU 41 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2cvd n ILE 42 N -2.29 1.71 -0.25 -3.67 5.41 -0.06 -4.29 119.36 115.92 2cvd n ILE 42 Ca 0.03 -0.55 0.04 0.00 1.00 0.00 0.00 62.75 63.26 2cvd n ILE 42 Cb 0.28 -1.75 0.17 0.00 -0.71 0.00 0.00 39.64 37.63 2cvd n ILE 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2cvd h LYS 43 N -0.12 0.50 0.00 0.38 3.64 -0.43 -1.02 116.57 119.52 2cvd h LYS 43 Ca -0.44 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2cvd h LYS 43 Cb 1.91 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.61 2cvd h LYS 43 CO 0.01 0.33 0.00 -1.13 -2.27 0.00 0.00 179.45 176.39 2cvd n SER 44 N -4.94 0.45 -0.30 4.20 3.41 -1.11 -1.88 113.62 113.44 2cvd n SER 44 Ca 0.13 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.52 2cvd n SER 44 Cb 0.36 -0.74 0.03 0.00 -0.26 0.00 0.00 64.21 63.60 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 -2.06 0.00 -3.58 6.66 -2.24 -0.39 -4.94 114.28 107.74 2cvd n THR 45 Ca 0.00 -0.16 -0.37 0.00 -2.27 0.00 0.00 64.05 61.25 2cvd n THR 45 Cb 0.10 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.28 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 -2.65 4.34 0.34 3.22 1.43 -0.79 -5.00 118.68 119.57 2cvd s LEU 46 Ca 0.16 0.65 0.12 0.00 -1.03 0.00 0.00 54.13 54.03 2cvd s LEU 46 Cb 0.18 -2.40 0.93 0.00 0.03 0.00 0.00 46.19 44.93 2cvd s LEU 46 CO 0.65 0.22 1.74 -0.65 0.23 0.00 0.00 176.35 178.55 2cvd h PRO 47 N 5.78 0.53 -0.08 1.29 0.11 -1.92 -2.57 132.00 135.14 2cvd h PRO 47 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2cvd h PRO 47 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2cvd h PRO 47 CO 0.68 0.35 0.00 1.19 -0.21 0.00 0.00 178.00 180.01 2cvd n PHE 48 N -4.80 0.11 -2.50 0.65 3.01 -1.26 -5.02 117.46 107.64 2cvd n PHE 48 Ca 0.26 -0.40 -0.18 0.00 1.01 0.00 0.00 57.45 58.14 2cvd n PHE 48 Cb 0.77 -0.03 -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 -0.12 -0.50 3.19 1.37 0.00 -0.97 -4.99 105.19 103.16 2cvd n GLY 49 Ca 0.03 0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 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 -5.13 0.88 0.24 1.61 -0.14 -1.26 -4.95 119.74 110.99 2cvd s LYS 50 Ca 0.04 -1.23 0.07 0.00 -1.36 0.00 0.00 55.97 53.50 2cvd s LYS 50 Cb -0.02 -0.52 -0.05 0.00 -1.68 0.00 0.00 37.83 35.56 2cvd s LYS 50 CO 0.05 0.07 -0.11 0.96 -0.76 0.00 0.00 175.35 175.56 2cvd s ILE 51 N -2.71 1.73 0.74 2.17 -4.36 -1.26 -4.61 121.20 112.90 2cvd s ILE 51 Ca 0.08 -2.18 -0.12 0.00 -0.26 0.00 0.00 60.65 58.16 2cvd s ILE 51 Cb -0.01 -2.24 0.04 0.00 1.25 0.00 0.00 42.46 41.50 2cvd s ILE 51 CO -0.00 -0.45 1.11 -2.16 0.24 0.00 0.00 174.94 173.68 2cvd s PRO 52 N -3.68 2.34 0.06 0.37 0.04 -1.26 -4.97 135.00 127.91 2cvd s PRO 52 Ca 0.26 1.31 0.03 0.00 0.04 0.00 0.00 61.00 62.64 2cvd s PRO 52 Cb 0.01 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2cvd s PRO 52 CO 0.10 -1.60 -0.09 0.96 0.04 0.00 0.00 177.00 176.41 2cvd s ILE 53 N -2.63 0.73 -0.13 0.56 -4.36 -1.05 -3.81 121.20 110.52 2cvd s ILE 53 Ca 0.64 -1.34 -0.01 0.00 -0.26 0.00 0.00 60.65 59.69 2cvd s ILE 53 Cb -0.19 -0.97 0.03 0.00 1.25 0.00 0.00 42.46 42.58 2cvd s ILE 53 CO 0.50 -0.45 -0.05 -0.22 0.24 0.00 0.00 174.94 174.96 2cvd s LEU 54 N -1.96 1.23 -0.12 0.37 2.96 -0.37 -1.51 118.68 119.28 2cvd s LEU 54 Ca -0.03 -0.43 -0.21 0.00 -0.22 0.00 0.00 54.13 53.24 2cvd s LEU 54 Cb -0.07 -0.78 -0.03 0.00 0.50 0.00 0.00 46.19 45.81 2cvd s LEU 54 CO -0.00 -0.17 0.62 -0.70 -1.32 0.00 0.00 176.35 174.78 2cvd s GLU 55 N 1.74 4.34 -0.26 1.98 2.12 0.08 -0.76 118.70 127.94 2cvd s GLU 55 Ca 0.03 0.68 0.02 0.00 0.36 0.00 0.00 54.97 56.06 2cvd s GLU 55 Cb -0.14 -3.48 0.07 0.00 0.26 0.00 0.00 34.13 30.83 2cvd s GLU 55 CO -0.08 -0.01 -0.06 0.08 -0.54 0.00 0.00 175.26 174.66 2cvd s VAL 56 N 1.10 1.90 -1.44 3.70 1.01 0.11 -1.62 120.40 125.16 2cvd s VAL 56 Ca 0.32 -1.55 -0.01 0.00 0.00 0.00 0.00 61.98 60.74 2cvd s VAL 56 Cb -0.16 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.10 2cvd s VAL 56 CO 0.13 -0.14 0.37 0.47 0.00 0.00 0.00 175.10 175.93 2cvd n ASP 57 N 4.52 -0.22 0.00 3.32 10.43 -0.56 -1.61 116.55 132.43 2cvd n ASP 57 Ca -0.11 -1.04 0.00 0.00 2.57 0.00 0.00 54.79 56.21 2cvd n ASP 57 Cb 0.43 -2.84 0.00 0.00 1.84 0.00 0.00 41.12 40.54 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 -2.05 2.16 3.64 0.44 0.00 -1.26 -5.03 105.19 103.10 2cvd n GLY 58 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 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 3.55 -0.13 0.99 1.43 -0.64 -5.09 118.68 118.79 2cvd s LEU 59 Ca 0.00 0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 53.04 2cvd s LEU 59 Cb 0.00 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.35 2cvd s LEU 59 CO 0.00 0.32 0.35 -0.89 0.23 0.00 0.00 176.35 176.36 2cvd s THR 60 N -0.53 5.25 0.08 5.49 2.01 -1.26 0.06 115.64 126.74 2cvd s THR 60 Ca 0.09 0.68 0.05 0.00 0.31 0.00 0.00 61.69 62.82 2cvd s THR 60 Cb -0.12 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 2cvd s THR 60 CO 0.02 0.39 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.53 2cvd s LEU 61 N 0.34 3.23 0.32 4.42 1.43 0.06 -4.97 118.68 123.51 2cvd s LEU 61 Ca 0.20 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.07 2cvd s LEU 61 Cb -0.14 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 2cvd s LEU 61 CO 0.06 0.20 0.13 -1.38 0.23 0.00 0.00 176.35 175.59 2cvd s HIS 62 N -1.20 1.68 -0.02 0.29 -3.43 -1.26 -1.23 115.29 110.12 2cvd s HIS 62 Ca 0.22 -1.27 -0.02 0.00 -0.80 0.00 0.00 55.06 53.20 2cvd s HIS 62 Cb -0.11 -0.99 0.01 0.00 -1.43 0.00 0.00 32.58 30.05 2cvd s HIS 62 CO 0.14 -0.37 0.03 1.04 -2.00 0.00 0.00 174.74 173.58 2cvd n GLN 63 N -0.65 -1.40 -0.26 -0.38 1.13 -1.25 -4.36 117.38 110.20 2cvd n GLN 63 Ca -0.01 1.39 0.07 0.00 -1.94 0.00 0.00 57.00 56.51 2cvd n GLN 63 Cb 0.65 -1.90 0.21 0.00 0.11 0.00 0.00 30.24 29.31 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 1.18 0.08 0.75 1.08 4.64 -1.86 -0.81 113.55 118.61 2cvd h SER 64 Ca -0.07 0.15 -0.17 0.00 -0.47 0.00 0.00 61.79 61.23 2cvd h SER 64 Cb 0.16 0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2cvd h SER 64 CO 0.00 -0.03 -0.79 -0.07 -0.87 0.00 0.00 176.83 175.07 2cvd h LEU 65 N 0.30 0.03 -0.32 5.97 3.38 -1.91 -0.39 115.31 122.38 2cvd h LEU 65 Ca 0.45 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.35 2cvd h LEU 65 Cb 0.78 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2cvd h LEU 65 CO -0.52 0.81 0.04 0.00 0.09 0.00 0.00 178.44 178.86 2cvd h ALA 66 N 1.19 0.42 -0.40 1.53 0.00 -1.61 -0.71 119.26 119.68 2cvd h ALA 66 Ca -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2cvd h ALA 66 Cb 1.39 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2cvd h ALA 66 CO 0.10 0.13 0.15 0.82 0.00 0.00 0.00 179.25 180.46 2cvd h ILE 67 N 0.35 1.20 -0.68 0.00 2.04 -1.07 -1.17 117.51 118.18 2cvd h ILE 67 Ca 0.09 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.35 2cvd h ILE 67 Cb 0.37 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2cvd h ILE 67 CO 0.01 0.23 0.43 0.00 0.00 0.00 0.00 178.15 178.81 2cvd h ALA 68 N 1.00 0.89 -0.51 1.87 0.00 -0.91 -0.81 119.26 120.79 2cvd h ALA 68 Ca 0.13 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2cvd h ALA 68 Cb 0.21 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2cvd h ALA 68 CO -0.01 0.20 0.21 -0.09 0.00 0.00 0.00 179.25 179.55 2cvd h ARG 69 N 0.84 0.77 -0.53 0.00 2.43 -0.87 -2.10 114.38 114.91 2cvd h ARG 69 Ca 0.27 -0.14 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 2cvd h ARG 69 Cb 0.02 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 2cvd h ARG 69 CO -0.11 0.67 0.29 -0.92 -1.51 0.00 0.00 179.97 178.40 2cvd h TYR 70 N 0.69 0.54 0.00 2.20 3.20 -0.61 -2.34 116.97 120.65 2cvd h TYR 70 Ca 0.17 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.00 2cvd h TYR 70 Cb 0.19 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 2cvd h TYR 70 CO 0.00 0.29 -0.27 -0.07 -1.64 0.00 0.00 178.16 176.47 2cvd h LEU 71 N 0.57 0.00 -0.60 2.82 3.38 -0.89 -2.99 115.31 117.60 2cvd h LEU 71 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2cvd h LEU 71 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2cvd h LEU 71 CO -0.13 0.27 -0.33 0.35 0.09 0.00 0.00 178.44 178.68 2cvd n THR 72 N -3.71 0.00 -1.83 0.22 -2.24 -0.81 -4.88 114.28 101.03 2cvd n THR 72 Ca -0.01 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 2cvd n THR 72 Cb 0.38 0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 2cvd n THR 72 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cvd s LYS 73 N -2.52 4.16 -1.18 -0.78 1.02 -0.92 -1.72 119.74 117.79 2cvd s LYS 73 Ca 0.22 2.51 0.00 0.00 0.02 0.00 0.00 55.97 58.73 2cvd s LYS 73 Cb 0.19 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 2cvd s LYS 73 CO 0.54 -0.61 0.00 0.09 -0.92 0.00 0.00 175.35 174.46 2cvd n ASN 74 N 2.61 -4.25 -4.51 2.83 3.02 -1.26 -5.01 115.26 108.68 2cvd n ASN 74 Ca 0.09 0.22 -0.24 0.00 -0.03 0.00 0.00 54.58 54.62 2cvd n ASN 74 Cb 0.38 -2.95 -0.11 0.00 -0.61 0.00 0.00 39.78 36.49 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 -2.47 1.60 -2.00 3.41 -4.23 -0.70 -5.02 115.64 106.23 2cvd s THR 75 Ca 0.00 -2.03 0.13 0.00 -1.18 0.00 0.00 61.69 58.61 2cvd s THR 75 Cb 0.00 -2.81 0.37 0.00 1.34 0.00 0.00 72.50 71.40 2cvd s THR 75 CO 0.00 -0.06 1.35 -0.90 -0.54 0.00 0.00 174.62 174.48 2cvd n ASP 76 N -0.78 0.00 0.02 3.99 5.75 -1.26 -3.02 116.55 121.24 2cvd n ASP 76 Ca -0.04 -1.21 0.11 0.00 -0.01 0.00 0.00 54.79 53.65 2cvd n ASP 76 Cb 0.66 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.73 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 -0.75 0.61 0.12 -2.12 4.77 -1.26 -4.50 117.00 113.87 2cvd n LEU 77 Ca 0.10 -0.11 -0.02 0.00 -0.03 0.00 0.00 56.01 55.95 2cvd n LEU 77 Cb 0.04 -0.07 0.15 0.00 -2.33 0.00 0.00 43.42 41.21 2cvd n LEU 77 CO 0.07 0.08 0.47 0.00 -1.33 0.00 0.00 177.39 176.68 2cvd h ALA 78 N 2.57 0.92 0.00 -1.18 0.00 -1.65 -2.11 119.26 117.81 2cvd h ALA 78 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2cvd h ALA 78 Cb 0.71 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2cvd h ALA 78 CO 0.00 0.78 0.00 0.41 0.00 0.00 0.00 179.25 180.44 2cvd n GLY 79 N 0.31 3.92 0.04 0.00 0.00 -1.26 -4.44 105.19 103.76 2cvd n GLY 79 Ca -0.01 -1.37 0.13 0.00 0.00 0.00 0.00 46.02 44.76 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 0.38 -4.13 1.61 3.02 -1.26 -4.71 115.26 110.18 2cvd n ASN 80 Ca 0.00 0.43 -0.10 0.00 -0.03 0.00 0.00 54.58 54.88 2cvd n ASN 80 Cb 0.00 -0.48 -0.10 0.00 -0.61 0.00 0.00 39.78 38.59 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 -3.05 0.10 0.23 3.41 -4.23 -1.26 -5.02 115.64 105.82 2cvd s THR 81 Ca 0.12 -1.86 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 2cvd s THR 81 Cb 0.16 -2.02 0.20 0.00 1.34 0.00 0.00 72.50 72.18 2cvd s THR 81 CO 0.58 -0.46 1.89 -0.33 -0.54 0.00 0.00 174.62 175.76 2cvd h GLU 82 N 2.84 1.16 -0.31 3.99 5.08 -1.99 -0.04 114.58 125.30 2cvd h GLU 82 Ca -0.35 -0.09 -0.15 0.00 -1.00 0.00 0.00 59.36 57.78 2cvd h GLU 82 Cb 1.20 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 2cvd h GLU 82 CO 0.58 0.79 -0.41 0.52 -1.00 0.00 0.00 179.01 179.49 2cvd h MET 83 N 1.18 0.75 -0.17 2.33 2.86 -1.99 -2.32 114.93 117.57 2cvd h MET 83 Ca 0.31 -0.40 -0.08 0.00 -2.06 0.00 0.00 59.70 57.48 2cvd h MET 83 Cb -0.09 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2cvd h MET 83 CO -0.06 1.02 -0.24 0.93 1.06 0.00 0.00 176.91 179.61 2cvd h GLU 84 N 0.61 0.30 -0.27 1.72 5.08 -1.82 -0.27 114.58 119.94 2cvd h GLU 84 Ca 0.05 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 2cvd h GLU 84 Cb 0.96 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2cvd h GLU 84 CO 0.09 0.53 -0.16 1.96 -1.00 0.00 0.00 179.01 180.43 2cvd h GLN 85 N 0.27 0.46 -0.40 2.33 4.20 -0.78 0.57 115.11 121.76 2cvd h GLN 85 Ca 0.04 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 2cvd h GLN 85 Cb 0.58 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 2cvd h GLN 85 CO 0.04 0.61 -0.05 0.00 -0.67 0.00 0.00 178.83 178.77 2cvd h HIS 87 N 0.56 0.81 -0.11 0.00 3.86 -0.47 0.90 115.15 120.71 2cvd h HIS 87 Ca 0.11 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2cvd h HIS 87 Cb 0.55 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 2cvd h HIS 87 CO 0.04 0.69 0.06 0.28 0.86 0.00 0.00 177.93 179.86 2cvd h VAL 88 N 0.76 1.09 -0.83 2.45 2.07 -0.67 -0.79 116.25 120.34 2cvd h VAL 88 Ca 0.17 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2cvd h VAL 88 Cb 0.30 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 2cvd h VAL 88 CO -0.00 0.08 0.54 0.44 0.02 0.00 0.00 177.57 178.65 2cvd h ASP 89 N 0.08 0.91 -0.44 0.57 3.32 -0.87 -1.73 116.42 118.26 2cvd h ASP 89 Ca 0.04 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 2cvd h ASP 89 Cb 0.07 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2cvd h ASP 89 CO -0.01 0.65 0.04 0.00 -1.72 0.00 0.00 179.24 178.20 2cvd h ALA 90 N 1.32 0.59 -0.50 3.45 0.00 -0.52 -0.97 119.26 122.63 2cvd h ALA 90 Ca 0.32 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2cvd h ALA 90 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2cvd h ALA 90 CO -0.09 0.34 0.08 0.82 0.00 0.00 0.00 179.25 180.40 2cvd h ILE 91 N 0.60 1.25 -0.59 0.00 1.08 -0.98 -0.31 117.51 118.56 2cvd h ILE 91 Ca 0.13 -0.94 -0.00 0.00 -0.39 0.00 0.00 64.86 63.66 2cvd h ILE 91 Cb 0.43 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 35.05 2cvd h ILE 91 CO 0.02 0.33 0.36 0.58 -0.69 0.00 0.00 178.15 178.75 2cvd h VAL 92 N 0.70 1.17 -0.15 1.67 2.07 -1.18 -1.08 116.25 119.46 2cvd h VAL 92 Ca 0.15 -0.38 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 2cvd h VAL 92 Cb 0.40 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2cvd h VAL 92 CO 0.01 0.18 -0.37 0.44 0.02 0.00 0.00 177.57 177.85 2cvd h ASP 93 N 0.80 0.33 -0.48 0.57 3.45 -0.96 0.77 116.42 120.90 2cvd h ASP 93 Ca 0.21 -0.13 -0.08 0.00 0.43 0.00 0.00 57.03 57.46 2cvd h ASP 93 Cb -0.03 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 38.63 2cvd h ASP 93 CO -0.04 0.68 -0.03 0.74 -1.57 0.00 0.00 179.24 179.02 2cvd h THR 94 N 0.28 1.27 -0.23 0.35 2.02 -0.62 0.16 112.91 116.13 2cvd h THR 94 Ca 0.03 -1.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.04 2cvd h THR 94 Cb 0.78 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 2cvd h THR 94 CO 0.06 0.39 -0.07 -0.07 0.37 0.00 0.00 175.52 176.20 2cvd h LEU 95 N 0.73 0.47 -1.20 2.58 3.38 -0.97 -3.03 115.31 117.27 2cvd h LEU 95 Ca 0.13 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2cvd h LEU 95 Cb 0.55 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2cvd h LEU 95 CO 0.03 0.74 0.03 -0.78 0.09 0.00 0.00 178.44 178.55 2cvd h ASP 96 N 0.19 0.55 -0.72 -0.43 3.58 -0.71 -1.80 116.42 117.09 2cvd h ASP 96 Ca 0.06 -0.10 0.04 0.00 0.42 0.00 0.00 57.03 57.45 2cvd h ASP 96 Cb 0.54 -0.14 -0.05 0.00 1.72 0.00 0.00 39.33 41.40 2cvd h ASP 96 CO 0.03 0.60 0.44 0.44 -2.88 0.00 0.00 179.24 177.86 2cvd h ASP 97 N 0.56 0.71 -0.16 2.28 3.45 -0.60 -0.12 116.42 122.53 2cvd h ASP 97 Ca 0.12 0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.54 2cvd h ASP 97 Cb 0.31 -0.14 -0.00 0.00 -0.56 0.00 0.00 39.33 38.94 2cvd h ASP 97 CO 0.01 0.48 -0.09 0.15 -1.57 0.00 0.00 179.24 178.22 2cvd h PHE 98 N 0.84 0.40 -0.79 4.55 3.57 -1.31 -3.05 116.94 121.16 2cvd h PHE 98 Ca 0.30 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 61.75 2cvd h PHE 98 Cb 0.07 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 2cvd h PHE 98 CO -0.05 0.67 0.52 0.52 -2.23 0.00 0.00 178.31 177.74 2cvd h MET 99 N 0.01 0.87 0.00 1.11 2.86 -1.06 -1.41 114.93 117.31 2cvd h MET 99 Ca 0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2cvd h MET 99 Cb 0.57 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2cvd h MET 99 CO 0.03 0.57 0.00 0.43 1.06 0.00 0.00 176.91 179.00 2cvd n SER 100 N -4.47 0.00 0.20 1.22 7.64 -0.08 -3.04 113.62 115.09 2cvd n SER 100 Ca 0.11 0.25 0.12 0.00 1.01 0.00 0.00 58.87 60.36 2cvd n SER 100 Cb 0.18 -0.38 0.20 0.00 -1.01 0.00 0.00 64.21 63.19 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 -3.20 3.07 -1.15 0.00 0.40 -1.17 -4.93 117.98 111.01 2cvd s PHE 102 Ca 0.07 0.97 -0.16 0.00 -0.60 0.00 0.00 56.93 57.22 2cvd s PHE 102 Cb 0.06 -3.60 -0.06 0.00 0.51 0.00 0.00 43.02 39.93 2cvd s PHE 102 CO 0.66 -2.11 2.16 -0.35 0.70 0.00 0.00 175.22 176.29 2cvd n PRO 103 N 4.80 2.31 0.26 0.24 -0.04 -1.26 -4.74 135.00 136.57 2cvd n PRO 103 Ca 0.12 -2.16 0.12 0.00 -0.04 0.00 0.00 63.50 61.55 2cvd n PRO 103 Cb 0.44 -3.02 0.71 0.00 -0.04 0.00 0.00 33.50 31.60 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 6.70 0.00 -0.21 0.54 4.06 -1.96 -3.00 115.95 122.07 2cvd h TRP 104 Ca 0.53 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.35 2cvd h TRP 104 Cb 0.58 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.67 2cvd h TRP 104 CO 1.46 0.12 0.17 0.00 -3.56 0.00 0.00 178.44 176.63 2cvd n ALA 105 N -2.28 3.89 -3.08 1.49 0.00 -1.26 -4.81 120.51 114.45 2cvd n ALA 105 Ca -0.02 -0.69 -0.38 0.00 0.00 0.00 0.00 53.44 52.35 2cvd n ALA 105 Cb 0.24 -1.13 -0.12 0.00 0.00 0.00 0.00 19.45 18.44 2cvd n ALA 105 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2cvd s GLU 106 N -0.77 2.87 0.27 0.00 2.56 -1.14 -4.99 118.70 117.52 2cvd s GLU 106 Ca 0.13 -1.02 -0.03 0.00 0.00 0.00 0.00 54.97 54.05 2cvd s GLU 106 Cb 0.11 -3.51 0.37 0.00 2.00 0.00 0.00 34.13 33.09 2cvd s GLU 106 CO 0.01 -0.59 1.89 0.87 -0.56 0.00 0.00 175.26 176.88 2cvd h LYS 107 N 8.29 1.04 -6.35 4.30 6.56 -1.92 -3.40 116.57 125.10 2cvd h LYS 107 Ca -0.27 -0.13 -0.54 0.00 -1.06 0.00 0.00 60.65 58.65 2cvd h LYS 107 Cb 1.11 -0.20 -0.07 0.00 -0.57 0.00 0.00 32.23 32.50 2cvd h LYS 107 CO 0.62 0.78 1.10 0.15 -2.06 0.00 0.00 179.45 180.05 2cvd s LYS 108 N -5.65 3.19 0.40 3.15 1.02 -1.26 -4.87 119.74 115.73 2cvd s LYS 108 Ca -0.11 0.14 0.14 0.00 0.02 0.00 0.00 55.97 56.16 2cvd s LYS 108 Cb 0.17 -4.17 1.00 0.00 -0.52 0.00 0.00 37.83 34.30 2cvd s LYS 108 CO 0.81 -2.11 1.89 0.37 -0.92 0.00 0.00 175.35 175.38 2cvd h GLN 109 N 10.94 0.47 0.71 1.68 5.75 -1.99 0.43 115.11 133.10 2cvd h GLN 109 Ca -0.27 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.17 2cvd h GLN 109 Cb 1.08 -0.11 0.01 0.00 1.07 0.00 0.00 27.48 29.53 2cvd h GLN 109 CO 1.23 0.31 -0.34 -0.44 -2.65 0.00 0.00 178.83 176.94 2cvd h ASP 110 N 0.49 -0.81 -0.73 -0.69 3.45 -1.95 -1.47 116.42 114.72 2cvd h ASP 110 Ca 0.42 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.87 2cvd h ASP 110 Cb 0.90 0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 39.85 2cvd h ASP 110 CO -0.16 -0.54 0.36 0.58 -1.57 0.00 0.00 179.24 177.91 2cvd h VAL 111 N -1.01 1.23 -0.44 -1.35 2.07 -1.84 -2.31 116.25 112.60 2cvd h VAL 111 Ca -0.10 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 66.85 2cvd h VAL 111 Cb 0.74 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 2cvd h VAL 111 CO 0.16 0.27 0.14 0.50 0.02 0.00 0.00 177.57 178.66 2cvd h LYS 112 N 1.01 0.29 -0.67 1.57 3.64 -0.87 0.18 116.57 121.72 2cvd h LYS 112 Ca 0.25 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.55 2cvd h LYS 112 Cb 0.10 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 2cvd h LYS 112 CO -0.03 0.19 0.19 1.49 -2.27 0.00 0.00 179.45 179.02 2cvd h GLU 113 N 0.30 1.06 -0.32 1.90 4.81 -1.05 -1.35 114.58 119.93 2cvd h GLU 113 Ca 0.21 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2cvd h GLU 113 Cb 0.21 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2cvd h GLU 113 CO -0.22 0.93 0.21 0.37 -0.73 0.00 0.00 179.01 179.57 2cvd h GLN 114 N 0.99 0.42 -0.64 1.92 5.75 -0.80 0.00 115.11 122.75 2cvd h GLN 114 Ca 0.21 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.67 2cvd h GLN 114 Cb 0.33 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.75 2cvd h GLN 114 CO -0.00 0.28 0.33 0.52 -2.65 0.00 0.00 178.83 177.31 2cvd h MET 115 N 0.43 0.91 -0.32 1.69 2.86 -0.74 0.05 114.93 119.81 2cvd h MET 115 Ca 0.12 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2cvd h MET 115 Cb -0.05 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.43 2cvd h MET 115 CO -0.03 0.70 0.18 0.74 1.06 0.00 0.00 176.91 179.57 2cvd h PHE 116 N 0.88 0.44 -0.55 -0.22 -1.00 -0.93 -1.35 116.94 114.21 2cvd h PHE 116 Ca 0.22 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.96 2cvd h PHE 116 Cb 0.08 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.47 2cvd h PHE 116 CO -0.00 0.34 0.20 -0.91 -1.61 0.00 0.00 178.31 176.33 2cvd h ASN 117 N 0.41 0.73 -0.39 2.17 2.35 -0.58 -1.37 115.58 118.89 2cvd h ASN 117 Ca 0.11 -0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 55.62 2cvd h ASN 117 Cb 0.04 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 2cvd h ASN 117 CO -0.02 0.67 -0.32 -0.33 -1.65 0.00 0.00 177.43 175.78 2cvd h GLU 118 N 0.79 0.93 -0.68 0.81 5.08 -0.67 -1.23 114.58 119.60 2cvd h GLU 118 Ca 0.19 -0.45 -0.07 0.00 -1.00 0.00 0.00 59.36 58.03 2cvd h GLU 118 Cb 0.18 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2cvd h GLU 118 CO -0.01 1.11 0.16 -0.07 -1.00 0.00 0.00 179.01 179.19 2cvd h LEU 119 N 0.77 1.03 -0.70 1.33 3.38 -0.90 0.12 115.31 120.35 2cvd h LEU 119 Ca 0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 2cvd h LEU 119 Cb 0.91 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2cvd h LEU 119 CO 0.08 1.00 -0.31 -0.07 0.09 0.00 0.00 178.44 179.24 2cvd h LEU 120 N 1.02 0.00 0.04 1.67 3.38 -1.15 -0.03 115.31 120.24 2cvd h LEU 120 Ca 0.21 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.81 2cvd h LEU 120 Cb 0.38 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 2cvd h LEU 120 CO 0.00 0.31 -2.14 0.41 0.09 0.00 0.00 178.44 177.11 2cvd n THR 121 N -3.34 1.61 -0.04 0.22 -1.04 -0.47 -4.22 114.28 106.99 2cvd n THR 121 Ca 0.01 -0.49 -0.09 0.00 -2.04 0.00 0.00 64.05 61.44 2cvd n THR 121 Cb 0.53 -1.70 -0.14 0.00 -1.82 0.00 0.00 70.33 67.20 2cvd n THR 121 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2cvd n TYR 122 N -3.68 0.79 -0.10 -1.42 0.53 0.40 -4.56 117.16 109.12 2cvd n TYR 122 Ca -0.41 0.28 -0.19 0.00 -1.02 0.00 0.00 57.90 56.57 2cvd n TYR 122 Cb 0.95 -1.14 -0.08 0.00 -1.03 0.00 0.00 39.34 38.03 2cvd n TYR 122 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2cvd n ASN 123 N -3.00 1.94 -0.27 7.72 4.13 -0.81 -4.67 115.26 120.31 2cvd n ASN 123 Ca -0.21 0.09 0.07 0.00 1.68 0.00 0.00 54.58 56.21 2cvd n ASN 123 Cb 1.07 -0.49 0.21 0.00 -1.54 0.00 0.00 39.78 39.04 2cvd n ASN 123 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2cvd h ALA 124 N -0.42 1.14 -0.98 5.41 0.00 -1.20 -2.24 119.26 120.97 2cvd h ALA 124 Ca -0.50 0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.72 2cvd h ALA 124 Cb 1.58 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 19.38 2cvd h ALA 124 CO -0.21 -0.23 0.61 -1.35 0.00 0.00 0.00 179.25 178.07 2cvd h PRO 125 N 0.44 0.67 -0.42 0.00 0.11 -1.80 -0.17 132.00 130.82 2cvd h PRO 125 Ca 0.45 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.41 2cvd h PRO 125 Cb 0.72 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 2cvd h PRO 125 CO -0.44 0.44 -0.17 0.45 -0.21 0.00 0.00 178.00 178.08 2cvd h HIS 126 N 0.69 0.90 -0.26 0.65 3.86 -1.69 -1.54 115.15 117.76 2cvd h HIS 126 Ca 0.55 -0.19 -0.14 0.00 -1.16 0.00 0.00 60.37 59.43 2cvd h HIS 126 Cb 0.95 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 29.19 2cvd h HIS 126 CO -0.00 0.91 -0.38 1.25 0.86 0.00 0.00 177.93 180.56 2cvd h LEU 127 N 0.71 0.78 -0.73 2.43 5.85 -1.18 -2.03 115.31 121.14 2cvd h LEU 127 Ca 0.11 -0.51 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 2cvd h LEU 127 Cb 0.68 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2cvd h LEU 127 CO 0.05 1.14 0.35 0.24 -0.34 0.00 0.00 178.44 179.89 2cvd h MET 128 N 0.44 1.05 -0.42 1.25 2.86 -0.97 -0.24 114.93 118.90 2cvd h MET 128 Ca 0.02 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 2cvd h MET 128 Cb 0.98 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.43 2cvd h MET 128 CO 0.09 0.83 0.14 0.37 1.06 0.00 0.00 176.91 179.39 2cvd h GLN 129 N 1.03 0.66 -0.81 1.72 5.75 -1.24 0.01 115.11 122.23 2cvd h GLN 129 Ca 0.25 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.59 2cvd h GLN 129 Cb 0.12 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.54 2cvd h GLN 129 CO -0.03 0.64 0.43 -0.44 -2.65 0.00 0.00 178.83 176.78 2cvd h ASP 130 N 0.54 1.02 -0.45 -0.69 3.32 -0.99 -0.17 116.42 119.00 2cvd h ASP 130 Ca 0.14 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 2cvd h ASP 130 Cb 0.25 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2cvd h ASP 130 CO -0.01 0.83 0.03 -0.07 -1.72 0.00 0.00 179.24 178.30 2cvd h LEU 131 N 1.12 0.76 -0.46 1.55 3.38 -0.79 0.07 115.31 120.94 2cvd h LEU 131 Ca 0.28 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2cvd h LEU 131 Cb 0.05 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2cvd h LEU 131 CO -0.04 0.86 0.21 -0.78 0.09 0.00 0.00 178.44 178.78 2cvd h ASP 132 N 0.63 0.62 -0.68 -0.43 -0.00 -0.68 -0.08 116.42 115.81 2cvd h ASP 132 Ca 0.13 -0.14 -0.07 0.00 -0.00 0.00 0.00 57.03 56.95 2cvd h ASP 132 Cb 0.46 -0.16 -0.03 0.00 -0.00 0.00 0.00 39.33 39.60 2cvd h ASP 132 CO 0.02 0.59 0.15 0.74 -0.00 0.00 0.00 179.24 180.74 2cvd h THR 133 N 0.61 1.26 -0.72 2.25 2.02 -0.90 -1.07 112.91 116.36 2cvd h THR 133 Ca 0.16 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 2cvd h THR 133 Cb 0.14 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 2cvd h THR 133 CO -0.02 0.37 0.33 0.22 0.37 0.00 0.00 175.52 176.80 2cvd h TYR 134 N 1.02 1.05 -0.39 3.16 3.20 -0.61 -2.95 116.97 121.45 2cvd h TYR 134 Ca 0.21 -0.06 -0.16 0.00 3.14 0.00 0.00 58.73 61.87 2cvd h TYR 134 Cb 0.39 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2cvd h TYR 134 CO 0.03 0.78 -0.37 1.25 -1.64 0.00 0.00 178.16 178.21 2cvd h LEU 135 N 1.01 0.99 0.00 2.82 5.85 -0.75 -3.48 115.31 121.75 2cvd h LEU 135 Ca 0.25 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.52 2cvd h LEU 135 Cb 0.14 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2cvd h LEU 135 CO -0.03 1.24 0.00 0.61 -0.34 0.00 0.00 178.44 179.92 2cvd n GLY 136 N 0.10 2.69 1.50 3.75 0.00 -0.43 -2.02 105.19 110.78 2cvd n GLY 136 Ca -0.02 -0.36 0.06 0.00 0.00 0.00 0.00 46.02 45.70 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 2.51 3.87 -0.02 0.00 -1.26 -4.97 105.19 105.32 2cvd n GLY 137 Ca 0.00 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.20 3.62 0.05 1.61 0.52 -0.85 -5.01 118.95 116.68 2cvd s ARG 138 Ca 0.41 0.78 -0.18 0.00 -0.52 0.00 0.00 55.73 56.23 2cvd s ARG 138 Cb 0.30 -2.08 -0.16 0.00 0.52 0.00 0.00 34.95 33.53 2cvd s ARG 138 CO 0.14 -0.55 1.28 1.49 0.02 0.00 0.00 175.30 177.68 2cvd h GLU 139 N -0.20 0.54 -5.40 3.54 4.81 -1.88 -3.47 114.58 112.52 2cvd h GLU 139 Ca -0.44 -0.38 -0.45 0.00 -0.13 0.00 0.00 59.36 57.96 2cvd h GLU 139 Cb 1.19 0.06 -0.14 0.00 0.63 0.00 0.00 28.75 30.49 2cvd h GLU 139 CO 0.62 1.00 -0.69 -1.58 -0.73 0.00 0.00 179.01 177.63 2cvd s TRP 140 N -3.89 1.76 0.18 0.92 0.52 -1.26 -4.90 118.94 112.28 2cvd s TRP 140 Ca -0.13 -0.72 -0.13 0.00 0.02 0.00 0.00 56.10 55.14 2cvd s TRP 140 Cb 0.06 -0.96 0.10 0.00 -1.15 0.00 0.00 33.47 31.52 2cvd s TRP 140 CO 0.82 0.22 1.84 -0.07 0.02 0.00 0.00 176.95 179.77 2cvd h LEU 141 N 2.42 0.61 -8.11 2.99 3.38 -1.90 -3.42 115.31 111.28 2cvd h LEU 141 Ca -0.39 -0.01 -0.53 0.00 0.09 0.00 0.00 57.88 57.05 2cvd h LEU 141 Cb 1.23 -0.14 -0.32 0.00 0.09 0.00 0.00 40.66 41.51 2cvd h LEU 141 CO 0.65 0.44 -0.82 -0.63 0.09 0.00 0.00 178.44 178.17 2cvd s ILE 142 N -6.14 1.24 0.00 1.22 1.09 -1.26 -4.87 121.20 112.47 2cvd s ILE 142 Ca -0.13 -0.59 0.00 0.00 -1.10 0.00 0.00 60.65 58.83 2cvd s ILE 142 Cb 0.13 -1.09 0.00 0.00 -1.06 0.00 0.00 42.46 40.44 2cvd s ILE 142 CO 0.75 0.37 0.00 0.61 -0.10 0.00 0.00 174.94 176.57 2cvd n GLY 143 N 3.38 0.02 0.49 6.18 0.00 -1.26 -4.25 105.19 109.75 2cvd n GLY 143 Ca -0.20 -0.98 0.07 0.00 0.00 0.00 0.00 46.02 44.91 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 2.56 -3.94 1.61 0.00 -1.26 -4.52 117.12 111.56 2cvd n MET 144 Ca 0.00 -2.35 -0.08 0.00 0.00 0.00 0.00 57.70 55.27 2cvd n MET 144 Cb 0.00 -1.48 -0.08 0.00 0.00 0.00 0.00 33.22 31.66 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 -1.75 0.25 0.43 3.17 1.04 -1.26 -4.95 113.70 110.62 2cvd s SER 145 Ca 0.28 -0.76 -0.26 0.00 0.48 0.00 0.00 55.95 55.69 2cvd s SER 145 Cb 0.21 0.29 -0.08 0.00 0.10 0.00 0.00 66.02 66.53 2cvd s SER 145 CO 0.08 -0.67 1.36 0.54 0.98 0.00 0.00 173.24 175.52 2cvd s VAL 146 N -3.80 2.38 0.31 5.02 0.11 -1.26 -4.78 120.40 118.38 2cvd s VAL 146 Ca 0.05 0.34 0.03 0.00 -2.93 0.00 0.00 61.98 59.47 2cvd s VAL 146 Cb 0.06 -3.20 -0.05 0.00 -1.53 0.00 0.00 36.38 31.65 2cvd s VAL 146 CO -0.10 0.05 0.08 0.42 -3.33 0.00 0.00 175.10 172.22 2cvd s THR 147 N -1.24 0.89 -1.17 5.04 -4.23 -1.26 -4.53 115.64 109.15 2cvd s THR 147 Ca 0.59 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.23 2cvd s THR 147 Cb -0.40 -2.69 0.16 0.00 1.34 0.00 0.00 72.50 70.90 2cvd s THR 147 CO 0.52 0.00 1.40 -2.67 -0.54 0.00 0.00 174.62 173.33 2cvd n TRP 148 N -0.63 0.00 -0.08 3.99 4.27 -0.79 -1.56 117.44 122.64 2cvd n TRP 148 Ca -0.02 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.46 2cvd n TRP 148 Cb 0.66 -0.42 -0.02 0.00 -1.36 0.00 0.00 31.31 30.18 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 2.52 0.54 -0.70 -1.67 0.00 -1.86 -0.29 119.26 117.80 2cvd h ALA 149 Ca 0.00 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2cvd h ALA 149 Cb 0.19 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2cvd h ALA 149 CO 0.00 0.68 0.15 -0.44 0.00 0.00 0.00 179.25 179.64 2cvd h ASP 150 N 0.66 1.07 -0.31 0.00 3.45 -1.69 -0.78 116.42 118.83 2cvd h ASP 150 Ca 0.03 -0.24 0.00 0.00 0.43 0.00 0.00 57.03 57.25 2cvd h ASP 150 Cb 1.09 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.56 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 1.06 0.39 -0.53 4.55 -1.00 -1.37 -1.92 116.94 118.11 2cvd h PHE 151 Ca 0.22 0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.95 2cvd h PHE 151 Cb 0.40 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.80 2cvd h PHE 151 CO 0.03 0.25 0.11 -0.92 -1.61 0.00 0.00 178.31 176.17 2cvd h TYR 152 N 0.41 0.86 -0.34 -0.55 3.20 -0.69 -0.82 116.97 119.04 2cvd h TYR 152 Ca 0.11 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2cvd h TYR 152 Cb -0.04 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 37.97 2cvd h TYR 152 CO -0.05 0.73 0.20 2.35 -1.64 0.00 0.00 178.16 179.75 2cvd h TRP 153 N 0.79 0.44 -0.73 -3.82 -0.00 -0.85 0.47 115.95 112.26 2cvd h TRP 153 Ca 0.17 -0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 59.01 2cvd h TRP 153 Cb 0.32 -0.15 -0.03 0.00 -0.00 0.00 0.00 29.16 29.30 2cvd h TRP 153 CO 0.02 0.32 0.25 1.49 -0.00 0.00 0.00 178.44 180.52 2cvd h GLU 154 N 0.43 1.12 -0.08 2.65 4.22 -0.83 -0.70 114.58 121.40 2cvd h GLU 154 Ca 0.12 -0.23 -0.01 0.00 0.08 0.00 0.00 59.36 59.32 2cvd h GLU 154 Cb 0.01 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 2cvd h GLU 154 CO -0.02 0.94 -0.00 0.82 -2.18 0.00 0.00 179.01 178.57 2cvd h ILE 155 N 1.07 1.26 -0.25 2.32 2.04 -0.94 -1.55 117.51 121.46 2cvd h ILE 155 Ca 0.24 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 2cvd h ILE 155 Cb 0.27 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2cvd h ILE 155 CO -0.01 0.22 0.08 0.00 0.00 0.00 0.00 178.15 178.44 2cvd h SER 157 N 0.23 0.50 -0.66 0.00 4.64 -1.16 -1.33 113.55 115.78 2cvd h SER 157 Ca 0.08 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2cvd h SER 157 Cb 0.23 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 2cvd h SER 157 CO -0.00 0.58 0.43 0.71 -0.87 0.00 0.00 176.83 177.67 2cvd h THR 158 N 0.50 1.18 -0.10 2.95 1.35 -1.13 0.54 112.91 118.21 2cvd h THR 158 Ca 0.11 -0.34 -0.20 0.00 -0.55 0.00 0.00 66.41 65.43 2cvd h THR 158 Cb 0.35 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 66.99 2cvd h THR 158 CO 0.01 0.17 -0.76 0.74 -0.25 0.00 0.00 175.52 175.43 2cvd h THR 159 N 0.89 1.35 -0.51 6.82 2.02 -1.38 -3.10 112.91 119.00 2cvd h THR 159 Ca 0.24 -2.10 -0.06 0.00 0.77 0.00 0.00 66.41 65.25 2cvd h THR 159 Cb -0.08 2.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2cvd h THR 159 CO -0.05 0.64 0.06 -0.07 0.37 0.00 0.00 175.52 176.47 2cvd h LEU 160 N 0.36 0.78 -2.33 2.58 3.38 -0.93 -2.10 115.31 117.05 2cvd h LEU 160 Ca -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 2cvd h LEU 160 Cb 1.36 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 2cvd h LEU 160 CO 0.14 0.81 -0.04 -0.07 0.09 0.00 0.00 178.44 179.37 2cvd h LEU 161 N 0.78 0.00 -0.63 1.67 3.38 -0.83 0.14 115.31 119.82 2cvd h LEU 161 Ca 0.16 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 2cvd h LEU 161 Cb 0.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2cvd h LEU 161 CO 0.01 0.04 -0.09 0.58 0.09 0.00 0.00 178.44 179.07 2cvd h VAL 162 N 0.00 1.27 0.00 1.22 2.07 -1.33 -2.55 116.25 116.93 2cvd h VAL 162 Ca -0.00 -1.23 -0.14 0.00 0.82 0.00 0.00 66.70 66.15 2cvd h VAL 162 Cb 0.13 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 2cvd h VAL 162 CO 0.01 0.43 -1.23 -0.26 0.02 0.00 0.00 177.57 176.54 2cvd h PHE 163 N 0.88 0.00 -2.41 1.57 -1.00 -1.31 -3.41 116.94 111.25 2cvd h PHE 163 Ca 0.14 0.00 -0.59 0.00 2.81 0.00 0.00 57.97 60.33 2cvd h PHE 163 Cb 0.64 0.00 -0.38 0.00 3.61 0.00 0.00 35.95 39.82 2cvd h PHE 163 CO 0.04 0.51 -0.95 1.17 -1.61 0.00 0.00 178.31 177.47 2cvd n LYS 164 N -2.92 0.33 -0.34 1.51 3.00 0.39 -5.01 118.16 115.12 2cvd n LYS 164 Ca -0.07 -3.28 0.24 0.00 -0.00 0.00 0.00 58.31 55.20 2cvd n LYS 164 Cb 0.79 -1.71 0.51 0.00 0.00 0.00 0.00 35.03 34.62 2cvd n LYS 164 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 2cvd h PRO 165 N 5.57 0.36 -0.42 1.64 0.11 -1.70 -0.85 132.00 136.72 2cvd h PRO 165 Ca 0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2cvd h PRO 165 Cb 0.90 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2cvd h PRO 165 CO 0.40 0.24 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 2cvd n ASP 166 N -4.66 2.09 -0.32 -2.05 5.68 -1.26 -4.53 116.55 111.50 2cvd n ASP 166 Ca 0.27 -2.06 0.21 0.00 -0.50 0.00 0.00 54.79 52.71 2cvd n ASP 166 Cb 0.93 -0.29 0.42 0.00 -1.14 0.00 0.00 41.12 41.04 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 2.05 0.20 -3.22 -2.12 5.85 -1.52 -1.80 115.31 114.75 2cvd h LEU 167 Ca 0.00 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2cvd h LEU 167 Cb 0.58 0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.85 2cvd h LEU 167 CO 0.03 -0.23 0.00 0.18 -0.34 0.00 0.00 178.44 178.09 2cvd n LEU 168 N -5.20 3.82 0.29 2.25 4.77 -1.26 -4.64 117.00 117.03 2cvd n LEU 168 Ca 0.29 -2.87 0.16 0.00 -0.03 0.00 0.00 56.01 53.56 2cvd n LEU 168 Cb 0.93 -0.51 0.89 0.00 -2.33 0.00 0.00 43.42 42.40 2cvd n LEU 168 CO 0.05 0.68 1.07 0.44 -1.33 0.00 0.00 177.39 178.30 2cvd h ASP 169 N 1.92 0.00 -0.12 -1.43 3.32 -1.64 -0.61 116.42 117.86 2cvd h ASP 169 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2cvd h ASP 169 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.91 2cvd h ASP 169 CO 0.20 0.05 0.00 0.59 -1.72 0.00 0.00 179.24 178.36 2cvd n ASN 170 N -3.59 2.78 -3.27 6.45 5.03 -1.26 -4.64 115.26 116.76 2cvd n ASN 170 Ca -0.02 -1.90 -0.25 0.00 0.87 0.00 0.00 54.58 53.28 2cvd n ASN 170 Cb 0.15 -0.07 -0.07 0.00 -1.02 0.00 0.00 39.78 38.77 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 1.13 0.80 -0.01 3.10 8.25 -0.24 -4.95 115.22 123.30 2cvd n HIS 171 Ca 0.16 -3.73 0.14 0.00 -0.26 0.00 0.00 57.72 54.03 2cvd n HIS 171 Cb 0.54 -0.40 0.57 0.00 1.12 0.00 0.00 29.99 31.83 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 4.10 0.23 0.00 -0.41 0.13 -1.83 -1.40 132.00 132.82 2cvd h PRO 172 Ca 0.11 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.16 2cvd h PRO 172 Cb 0.82 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 2cvd h PRO 172 CO 0.57 0.15 -0.31 0.00 -0.23 0.00 0.00 178.00 178.18 2cvd h ARG 173 N 0.24 0.00 0.00 0.86 3.08 -1.92 0.35 114.38 116.98 2cvd h ARG 173 Ca 0.23 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.12 2cvd h ARG 173 Cb 0.58 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 2cvd h ARG 173 CO -0.04 0.31 -0.73 -0.07 -1.07 0.00 0.00 179.97 178.36 2cvd h LEU 174 N 0.00 0.00 -0.24 3.04 3.38 -1.64 -2.39 115.31 117.46 2cvd h LEU 174 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 2cvd h LEU 174 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2cvd h LEU 174 CO 0.04 0.73 -0.49 0.58 0.09 0.00 0.00 178.44 179.40 2cvd h VAL 175 N 0.00 1.30 -0.77 1.22 2.07 -1.18 -2.35 116.25 116.54 2cvd h VAL 175 Ca -0.01 -1.69 -0.00 0.00 0.82 0.00 0.00 66.70 65.82 2cvd h VAL 175 Cb 1.39 1.77 -0.04 0.00 -1.52 0.00 0.00 31.29 32.90 2cvd h VAL 175 CO 0.10 0.54 0.46 0.74 0.02 0.00 0.00 177.57 179.43 2cvd h THR 176 N 0.48 1.21 -0.42 2.57 2.02 -0.87 -1.27 112.91 116.63 2cvd h THR 176 Ca 0.01 -0.46 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 2cvd h THR 176 Cb 1.09 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2cvd h THR 176 CO 0.11 0.22 0.12 0.25 0.37 0.00 0.00 175.52 176.58 2cvd h LEU 177 N 1.05 0.62 -0.49 2.58 5.85 -1.31 -1.23 115.31 122.39 2cvd h LEU 177 Ca 0.28 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.83 2cvd h LEU 177 Cb -0.05 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.76 2cvd h LEU 177 CO -0.05 0.68 0.20 0.03 -0.34 0.00 0.00 178.44 178.96 2cvd h ARG 178 N 0.54 0.39 -0.60 1.25 3.08 -0.82 -1.73 114.38 116.49 2cvd h ARG 178 Ca 0.13 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 2cvd h ARG 178 Cb 0.29 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 2cvd h ARG 178 CO -0.00 0.26 0.22 0.87 -1.07 0.00 0.00 179.97 180.24 2cvd h LYS 179 N 0.40 0.88 -0.55 0.04 1.57 -0.96 -1.13 116.57 116.83 2cvd h LYS 179 Ca 0.23 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2cvd h LYS 179 Cb 0.20 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2cvd h LYS 179 CO -0.21 0.74 0.19 0.87 -0.57 0.00 0.00 179.45 180.47 2cvd h LYS 180 N 0.86 0.84 -0.33 3.15 1.57 -0.58 -0.35 116.57 121.73 2cvd h LYS 180 Ca 0.20 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2cvd h LYS 180 Cb 0.20 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2cvd h LYS 180 CO -0.02 0.75 0.06 0.28 -0.57 0.00 0.00 179.45 179.95 2cvd h VAL 181 N 0.76 1.23 0.00 0.50 2.07 -1.00 -2.76 116.25 117.05 2cvd h VAL 181 Ca 0.18 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2cvd h VAL 181 Cb 0.24 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2cvd h VAL 181 CO -0.01 0.27 -0.00 1.56 0.02 0.00 0.00 177.57 179.40 2cvd h GLN 182 N 0.38 0.00 0.00 1.57 4.20 -0.96 -2.57 115.11 117.73 2cvd h GLN 182 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2cvd h GLN 182 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2cvd h GLN 182 CO 0.01 0.00 -0.54 0.00 -0.67 0.00 0.00 178.83 177.63 2cvd h ALA 183 N 2.00 0.64 -2.40 3.87 0.00 -0.77 -3.30 119.26 119.30 2cvd h ALA 183 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2cvd h ALA 183 Cb 0.25 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.06 2cvd h ALA 183 CO 0.00 0.00 1.17 0.42 0.00 0.00 0.00 179.25 180.85 2cvd s ILE 184 N -3.16 2.93 0.20 0.00 1.01 -0.97 -4.76 121.20 116.46 2cvd s ILE 184 Ca 0.07 0.12 -0.21 0.00 0.00 0.00 0.00 60.65 60.63 2cvd s ILE 184 Cb 0.13 -3.07 0.15 0.00 0.01 0.00 0.00 42.46 39.67 2cvd s ILE 184 CO 0.71 -0.01 1.50 -2.65 0.00 0.00 0.00 174.94 174.48 2cvd n PRO 185 N 6.88 -0.28 -0.28 2.79 -0.02 -1.26 0.60 135.00 143.44 2cvd n PRO 185 Ca 0.19 1.48 -0.04 0.00 -2.02 0.00 0.00 63.50 63.11 2cvd n PRO 185 Cb 0.40 -2.19 0.11 0.00 -0.02 0.00 0.00 33.50 31.81 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 1.09 1.16 -0.16 3.55 0.00 -1.90 -0.81 119.26 122.20 2cvd h ALA 186 Ca 0.28 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 2cvd h ALA 186 Cb 0.52 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2cvd h ALA 186 CO -0.94 0.63 -0.45 0.28 0.00 0.00 0.00 179.25 178.76 2cvd h VAL 187 N 1.13 1.34 -0.96 0.00 2.07 -1.35 -2.66 116.25 115.82 2cvd h VAL 187 Ca 0.27 -1.72 0.04 0.00 0.82 0.00 0.00 66.70 66.12 2cvd h VAL 187 Cb 0.12 2.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.83 2cvd h VAL 187 CO -0.03 0.53 0.62 0.00 0.02 0.00 0.00 177.57 178.70 2cvd h ALA 188 N 0.55 1.29 -0.69 1.67 0.00 0.40 -0.65 119.26 121.83 2cvd h ALA 188 Ca -0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2cvd h ALA 188 Cb 1.07 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2cvd h ALA 188 CO 0.10 0.47 0.21 -0.97 0.00 0.00 0.00 179.25 179.06 2cvd h ASN 189 N 1.18 1.00 -0.29 0.00 -1.24 -1.11 -2.01 115.58 113.12 2cvd h ASN 189 Ca 0.39 -0.21 -0.07 0.00 0.71 0.00 0.00 56.30 57.13 2cvd h ASN 189 Cb 0.05 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 38.83 2cvd h ASN 189 CO -0.14 0.95 -0.07 -0.25 -1.29 0.00 0.00 177.43 176.63 2cvd h TRP 190 N 1.01 0.64 -0.78 0.67 2.91 -1.02 -2.31 115.95 117.08 2cvd h TRP 190 Ca 0.22 -0.14 0.04 0.00 1.13 0.00 0.00 58.89 60.15 2cvd h TRP 190 Cb 0.30 -0.16 -0.05 0.00 -0.51 0.00 0.00 29.16 28.75 2cvd h TRP 190 CO 0.02 0.76 0.51 0.82 -1.03 0.00 0.00 178.44 179.52 2cvd h ILE 191 N 0.33 1.10 -0.01 2.65 2.04 -1.00 0.83 117.51 123.45 2cvd h ILE 191 Ca 0.07 -0.32 -0.19 0.00 1.00 0.00 0.00 64.86 65.42 2cvd h ILE 191 Cb 0.55 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2cvd h ILE 191 CO 0.03 0.17 -0.84 0.50 0.00 0.00 0.00 178.15 178.00 2cvd h LYS 192 N 0.92 0.23 0.00 2.37 3.64 -1.26 -3.35 116.57 119.12 2cvd h LYS 192 Ca 0.32 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2cvd h LYS 192 Cb 0.10 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2cvd h LYS 192 CO -0.10 0.95 -1.56 0.54 -2.27 0.00 0.00 179.45 177.01 2cvd n ARG 193 N -3.70 0.64 -1.27 1.90 1.74 -0.88 -4.99 116.66 110.09 2cvd n ARG 193 Ca -0.04 -0.01 -0.34 0.00 -0.77 0.00 0.00 57.85 56.69 2cvd n ARG 193 Cb 0.78 -1.68 0.11 0.00 -1.02 0.00 0.00 32.46 30.66 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 -3.31 1.86 0.35 5.56 1.70 0.25 -4.91 118.95 120.45 2cvd s ARG 194 Ca -0.05 1.84 -0.29 0.00 -0.47 0.00 0.00 55.73 56.76 2cvd s ARG 194 Cb 0.11 -1.79 -0.11 0.00 -0.57 0.00 0.00 34.95 32.59 2cvd s ARG 194 CO 0.84 -2.06 1.52 -2.14 -1.08 0.00 0.00 175.30 172.38 2cvd s PRO 195 N -3.95 4.11 -0.37 3.89 0.02 -1.26 -4.93 135.00 132.51 2cvd s PRO 195 Ca 0.76 2.58 -0.25 0.00 0.02 0.00 0.00 61.00 64.10 2cvd s PRO 195 Cb -0.31 -2.98 0.01 0.00 0.02 0.00 0.00 34.50 31.24 2cvd s PRO 195 CO 0.48 -0.57 0.89 -0.65 -0.33 0.00 0.00 177.00 176.83 2cvd s GLN 196 N -1.67 3.80 0.13 5.54 -0.21 -1.26 -4.96 119.66 121.03 2cvd s GLN 196 Ca 0.56 0.49 0.05 0.00 0.02 0.00 0.00 55.36 56.47 2cvd s GLN 196 Cb -0.47 -3.81 -0.04 0.00 1.00 0.00 0.00 33.01 29.69 2cvd s GLN 196 CO 0.59 -0.94 -0.11 0.95 -2.12 0.00 0.00 175.29 173.66 2cvd s THR 197 N 3.41 1.15 0.04 -0.19 -4.23 -1.26 -5.07 115.64 109.49 2cvd s THR 197 Ca 0.36 -1.87 -0.25 0.00 -1.18 0.00 0.00 61.69 58.75 2cvd s THR 197 Cb -0.12 -1.64 -0.17 0.00 1.34 0.00 0.00 72.50 71.91 2cvd s THR 197 CO 0.19 -0.62 1.48 0.50 -0.54 0.00 0.00 174.62 175.63 2cvd h LYS 198 N 3.16 -0.22 -0.01 3.99 1.63 -1.95 -3.47 116.57 119.70 2cvd h LYS 198 Ca -0.37 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 2cvd h LYS 198 Cb 1.19 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 2cvd h LYS 198 CO 0.58 0.01 0.00 1.28 -3.45 0.00 0.00 179.45 177.87