#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pac s ASP 2 N 0.00 1.58 0.15 4.31 1.01 -1.26 -4.95 116.67 117.51 2pac s ASP 2 Ca 0.00 -2.70 0.22 0.00 0.71 0.00 0.00 52.55 50.77 2pac s ASP 2 Cb 0.00 -0.23 0.87 0.00 1.01 0.00 0.00 42.92 44.57 2pac s ASP 2 CO 0.00 -0.20 1.66 -0.81 0.21 0.00 0.00 175.17 176.03 2pac n PRO 3 N 3.21 0.13 0.09 8.23 -0.04 -1.26 -1.71 135.00 143.64 2pac n PRO 3 Ca 0.24 0.31 -0.02 0.00 -0.04 0.00 0.00 63.50 63.99 2pac n PRO 3 Cb 0.46 -1.72 -0.05 0.00 -0.04 0.00 0.00 33.50 32.14 2pac n PRO 3 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2pac h GLU 4 N 0.00 0.00 0.00 0.54 5.08 -1.96 -0.59 114.58 117.65 2pac h GLU 4 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2pac h GLU 4 Cb 0.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2pac h GLU 4 CO 0.00 0.68 -0.87 0.28 -1.00 0.00 0.00 179.01 178.10 2pac h VAL 5 N 0.00 0.41 0.24 3.13 2.07 -1.82 -3.06 116.25 117.22 2pac h VAL 5 Ca -0.04 -1.68 -0.32 0.00 0.82 0.00 0.00 66.70 65.48 2pac h VAL 5 Cb 1.60 2.00 0.04 0.00 -1.52 0.00 0.00 31.29 33.41 2pac h VAL 5 CO 0.09 0.23 -1.43 -0.07 0.02 0.00 0.00 177.57 176.42 2pac h LEU 6 N 0.00 0.79 -1.08 2.57 3.38 -1.27 -2.39 115.31 117.31 2pac h LEU 6 Ca -0.06 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 56.96 2pac h LEU 6 Cb 1.31 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2pac h LEU 6 CO 0.03 1.68 -0.11 0.15 0.09 0.00 0.00 178.44 180.28 2pac h PHE 7 N 0.08 0.00 -0.01 1.13 3.57 -1.21 -2.66 116.94 117.85 2pac h PHE 7 Ca -0.25 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.25 2pac h PHE 7 Cb 2.11 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.85 2pac h PHE 7 CO 0.14 0.11 -0.61 1.17 -2.23 0.00 0.00 178.31 176.89 2pac n LYS 8 N -3.22 0.46 0.00 1.11 3.00 -1.15 -2.45 118.16 115.90 2pac n LYS 8 Ca 0.01 -0.34 0.00 0.00 -0.00 0.00 0.00 58.31 57.98 2pac n LYS 8 Cb 0.40 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 33.94 2pac n LYS 8 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2pac n ASN 9 N -0.97 0.00 0.00 3.14 2.85 -0.90 -4.81 115.26 114.57 2pac n ASN 9 Ca 0.07 0.77 0.00 0.00 -0.11 0.00 0.00 54.58 55.31 2pac n ASN 9 Cb 0.37 -0.27 0.00 0.00 1.24 0.00 0.00 39.78 41.12 2pac n ASN 9 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2pac n LYS 10 N -1.84 0.00 0.00 1.20 5.02 -1.26 -5.07 118.16 116.21 2pac n LYS 10 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2pac n LYS 10 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2pac n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pac n GLY 11 N 0.00 -1.51 0.52 0.72 0.00 -1.26 -5.01 105.19 98.64 2pac n GLY 11 Ca 0.00 0.55 -0.20 0.00 0.00 0.00 0.00 46.02 46.37 2pac n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pac n VAL 13 N -5.52 0.70 0.15 0.00 3.14 -1.03 -2.48 118.33 113.29 2pac n VAL 13 Ca -0.16 0.18 0.19 0.00 -2.96 0.00 0.00 64.34 61.59 2pac n VAL 13 Cb 0.51 -1.08 0.77 0.00 -1.06 0.00 0.00 33.84 32.99 2pac n VAL 13 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2pac h ALA 14 N 2.31 1.94 0.00 1.55 0.00 -1.78 -3.29 119.26 119.99 2pac h ALA 14 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2pac h ALA 14 Cb 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2pac h ALA 14 CO 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 179.25 178.67 2pac n HIS 16 N 0.00 0.00 -0.61 0.00 8.25 -1.04 -2.20 115.22 119.63 2pac n HIS 16 Ca -0.03 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.49 2pac n HIS 16 Cb 0.40 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.44 2pac n HIS 16 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2pac n ALA 17 N -1.97 -1.48 -0.11 -1.41 0.00 -1.26 -4.42 120.51 109.86 2pac n ALA 17 Ca 0.00 0.36 -0.21 0.00 0.00 0.00 0.00 53.44 53.59 2pac n ALA 17 Cb 0.00 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 2pac n ALA 17 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2pac n ILE 18 N -2.78 1.41 0.27 0.00 -6.64 -1.26 -3.48 119.36 106.89 2pac n ILE 18 Ca -0.03 -0.18 0.08 0.00 -1.77 0.00 0.00 62.75 60.84 2pac n ILE 18 Cb 0.27 -1.98 0.23 0.00 -1.44 0.00 0.00 39.64 36.72 2pac n ILE 18 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 2pac n ASP 19 N -4.21 2.98 -4.18 7.28 5.68 -1.26 -1.95 116.55 120.88 2pac n ASP 19 Ca -0.38 -2.11 -0.11 0.00 -0.50 0.00 0.00 54.79 51.69 2pac n ASP 19 Cb 0.73 -0.39 -0.10 0.00 -1.14 0.00 0.00 41.12 40.22 2pac n ASP 19 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2pac s THR 20 N -1.48 0.59 -0.07 2.12 -4.23 -1.26 -5.06 115.64 106.25 2pac s THR 20 Ca 0.34 -1.94 0.02 0.00 -1.18 0.00 0.00 61.69 58.94 2pac s THR 20 Cb 0.19 -1.84 0.02 0.00 1.34 0.00 0.00 72.50 72.21 2pac s THR 20 CO 0.21 -0.72 -0.10 -0.75 -0.54 0.00 0.00 174.62 172.72 2pac s LYS 21 N -3.89 1.48 0.00 3.99 2.20 -1.26 -4.02 119.74 118.25 2pac s LYS 21 Ca 0.16 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 2pac s LYS 21 Cb 0.06 -1.30 0.00 0.00 -1.51 0.00 0.00 37.83 35.08 2pac s LYS 21 CO -0.02 -0.03 0.00 0.00 -0.36 0.00 0.00 175.35 174.94 2pac n MET 22 N 4.00 0.00 -0.08 4.03 0.00 -1.26 -4.99 117.12 118.83 2pac n MET 22 Ca -0.22 0.00 -0.19 0.00 0.00 0.00 0.00 57.70 57.29 2pac n MET 22 Cb 0.51 0.00 -0.13 0.00 0.00 0.00 0.00 33.22 33.60 2pac n MET 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2pac n VAL 23 N -0.11 1.59 -3.55 3.17 0.31 -1.21 -4.98 118.33 113.55 2pac n VAL 23 Ca 0.00 -0.62 -0.20 0.00 -0.01 0.00 0.00 64.34 63.51 2pac n VAL 23 Cb 0.00 -1.47 -0.02 0.00 -0.91 0.00 0.00 33.84 31.43 2pac n VAL 23 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2pac s GLY 24 N -6.13 1.96 0.71 2.92 0.00 -0.93 -4.94 107.32 100.91 2pac s GLY 24 Ca -0.29 -1.75 -0.14 0.00 0.00 0.00 0.00 44.72 42.54 2pac s GLY 24 CO 0.67 -1.61 1.13 2.56 0.00 0.00 0.00 173.10 175.85 2pac s PRO 25 N -4.13 2.47 -0.07 2.90 0.04 -1.26 -4.68 135.00 130.27 2pac s PRO 25 Ca 0.47 1.43 -0.28 0.00 0.04 0.00 0.00 61.00 62.66 2pac s PRO 25 Cb -0.05 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2pac s PRO 25 CO 0.28 -1.52 0.90 0.00 0.04 0.00 0.00 177.00 176.71 2pac s ALA 26 N -2.40 3.31 0.47 8.56 0.00 -1.26 -4.72 121.76 125.74 2pac s ALA 26 Ca 0.67 0.33 0.17 0.00 0.00 0.00 0.00 51.96 53.13 2pac s ALA 26 Cb -0.22 -3.26 1.16 0.00 0.00 0.00 0.00 23.12 20.81 2pac s ALA 26 CO 0.46 -0.36 2.01 1.88 0.00 0.00 0.00 175.76 179.74 2pac h TYR 27 N 6.95 0.26 -0.40 0.00 -1.99 -1.42 0.51 116.97 120.87 2pac h TYR 27 Ca -0.37 0.01 -0.15 0.00 2.00 0.00 0.00 58.73 60.22 2pac h TYR 27 Cb 1.18 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 39.82 2pac h TYR 27 CO 0.69 0.12 -0.34 0.87 -0.00 0.00 0.00 178.16 179.50 2pac h LYS 28 N 0.24 0.93 -0.33 4.88 1.57 -1.77 -0.44 116.57 121.66 2pac h LYS 28 Ca 0.23 -0.47 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 2pac h LYS 28 Cb 0.60 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 2pac h LYS 28 CO -0.05 1.12 -0.02 -0.44 -0.57 0.00 0.00 179.45 179.49 2pac h ASP 29 N 0.77 0.48 0.05 0.86 5.19 -1.20 0.43 116.42 123.01 2pac h ASP 29 Ca 0.07 -0.10 -0.14 0.00 -0.62 0.00 0.00 57.03 56.25 2pac h ASP 29 Cb 0.93 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.30 2pac h ASP 29 CO 0.09 0.57 -0.45 0.58 -3.12 0.00 0.00 179.24 176.90 2pac h VAL 30 N 0.49 1.31 -0.43 -1.35 2.07 -0.81 -1.44 116.25 116.10 2pac h VAL 30 Ca 0.10 -1.65 -0.03 0.00 0.82 0.00 0.00 66.70 65.94 2pac h VAL 30 Cb 0.36 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 2pac h VAL 30 CO 0.01 0.51 0.04 0.00 0.02 0.00 0.00 177.57 178.16 2pac n ALA 31 N -2.50 3.60 -0.02 1.67 0.00 -0.20 -2.26 120.51 120.79 2pac n ALA 31 Ca -0.02 -1.42 0.00 0.00 0.00 0.00 0.00 53.44 52.00 2pac n ALA 31 Cb 0.54 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2pac n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pac n ALA 32 N 0.34 2.39 0.05 0.00 0.00 0.14 -4.30 120.51 119.13 2pac n ALA 32 Ca 0.22 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2pac n ALA 32 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.41 2pac n ALA 32 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2pac n LYS 33 N -0.11 0.00 -1.08 0.00 3.00 -0.99 -4.85 118.16 114.13 2pac n LYS 33 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.14 2pac n LYS 33 Cb 0.00 -0.38 0.18 0.00 0.00 0.00 0.00 35.03 34.84 2pac n LYS 33 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2pac n PHE 34 N -3.37 2.29 0.65 5.64 3.72 -0.96 -4.33 117.46 121.10 2pac n PHE 34 Ca 0.00 -1.80 0.09 0.00 -0.05 0.00 0.00 57.45 55.69 2pac n PHE 34 Cb 0.00 -0.78 0.41 0.00 -0.94 0.00 0.00 39.48 38.17 2pac n PHE 34 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2pac n ALA 35 N -1.13 1.87 -0.05 4.37 0.00 -1.25 -0.54 120.51 123.78 2pac n ALA 35 Ca 0.49 -0.06 -0.20 0.00 0.00 0.00 0.00 53.44 53.67 2pac n ALA 35 Cb 1.39 -1.31 -0.13 0.00 0.00 0.00 0.00 19.45 19.40 2pac n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pac n GLY 36 N 0.46 -0.49 6.58 0.00 0.00 -1.26 -5.05 105.19 105.43 2pac n GLY 36 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2pac n GLY 36 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2pac n GLN 37 N -3.39 0.00 -1.38 1.61 6.02 0.30 -5.09 117.38 115.45 2pac n GLN 37 Ca -0.37 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.62 2pac n GLN 37 Cb 1.03 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 32.28 2pac n GLN 37 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2pac n ALA 38 N 1.00 -3.00 0.00 -1.58 0.00 -1.26 -4.95 120.51 110.72 2pac n ALA 38 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2pac n ALA 38 Cb 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.20 2pac n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pac n GLY 39 N 0.13 0.32 0.00 0.00 0.00 -1.26 -5.07 105.19 99.31 2pac n GLY 39 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2pac n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pac n ALA 40 N 0.00 0.00 -1.90 4.61 0.00 -1.26 -4.97 120.51 116.98 2pac n ALA 40 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2pac n ALA 40 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2pac n ALA 40 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2pac n GLU 41 N 0.00 -1.78 0.06 0.00 2.13 -1.26 -4.42 120.64 115.37 2pac n GLU 41 Ca 0.00 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.44 2pac n GLU 41 Cb 0.00 -5.02 0.00 0.00 0.27 0.00 0.00 31.44 26.69 2pac n GLU 41 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2pac n ALA 42 N -0.99 2.73 1.59 4.31 0.00 -1.26 -4.71 120.51 122.17 2pac n ALA 42 Ca -0.13 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.42 2pac n ALA 42 Cb 0.49 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.42 2pac n ALA 42 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2pac n GLU 43 N -2.88 1.40 0.03 0.00 0.28 -1.26 -2.57 120.64 115.62 2pac n GLU 43 Ca 0.00 -0.59 -0.20 0.00 -0.16 0.00 0.00 57.16 56.21 2pac n GLU 43 Cb 0.00 -1.36 -0.14 0.00 1.43 0.00 0.00 31.44 31.37 2pac n GLU 43 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2pac h LEU 44 N 1.22 0.41 -1.03 -1.84 5.85 -1.87 -2.86 115.31 115.19 2pac h LEU 44 Ca 0.00 -0.79 -0.07 0.00 0.84 0.00 0.00 57.88 57.86 2pac h LEU 44 Cb 0.27 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2pac h LEU 44 CO 0.00 1.69 -0.35 0.00 -0.34 0.00 0.00 178.44 179.44 2pac h ALA 45 N 0.24 1.04 0.00 1.25 0.00 -1.81 -2.13 119.26 117.86 2pac h ALA 45 Ca -0.37 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2pac h ALA 45 Cb 2.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.78 2pac h ALA 45 CO 0.12 0.44 0.00 1.96 0.00 0.00 0.00 179.25 181.77 2pac h GLN 46 N 0.00 0.00 0.00 0.00 4.20 -1.55 -2.91 115.11 114.86 2pac h GLN 46 Ca -0.00 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 2pac h GLN 46 Cb 0.84 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 2pac h GLN 46 CO 0.05 0.00 -0.88 0.00 -0.67 0.00 0.00 178.83 177.33 2pac h ARG 47 N 0.00 0.21 0.00 1.46 2.47 -1.14 0.56 114.38 117.94 2pac h ARG 47 Ca 0.00 -0.23 -0.03 0.00 -1.26 0.00 0.00 59.98 58.46 2pac h ARG 47 Cb 0.91 0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2pac h ARG 47 CO 0.00 0.96 -0.15 0.82 0.56 0.00 0.00 179.97 182.16 2pac h ILE 48 N 0.12 1.01 -0.13 2.04 2.04 -1.30 0.54 117.51 121.84 2pac h ILE 48 Ca -0.05 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.30 2pac h ILE 48 Cb 1.51 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2pac h ILE 48 CO 0.14 0.14 0.00 1.17 0.00 0.00 0.00 178.15 179.60 2pac n LYS 49 N -4.23 1.83 -0.17 2.37 4.81 -1.07 -4.25 118.16 117.45 2pac n LYS 49 Ca -0.02 -1.47 0.00 0.00 -0.87 0.00 0.00 58.31 55.95 2pac n LYS 49 Cb 0.22 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 34.13 2pac n LYS 49 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2pac n ASN 50 N 0.16 0.00 -0.81 3.14 2.85 0.20 -2.70 115.26 118.10 2pac n ASN 50 Ca 0.05 -1.20 0.00 0.00 -0.11 0.00 0.00 54.58 53.32 2pac n ASN 50 Cb 0.28 -0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.26 2pac n ASN 50 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2pac n GLY 51 N 0.00 -3.59 0.25 8.20 0.00 0.19 -4.66 105.19 105.57 2pac n GLY 51 Ca 0.00 -1.02 0.16 0.00 0.00 0.00 0.00 46.02 45.16 2pac n GLY 51 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2pac h SER 52 N 0.37 0.00 0.00 1.61 0.87 -1.79 -3.41 113.55 111.20 2pac h SER 52 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2pac h SER 52 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2pac h SER 52 CO 0.00 0.00 0.00 1.67 -0.53 0.00 0.00 176.83 177.97 2pac n GLN 53 N -3.00 0.00 0.00 2.24 -0.06 -1.26 -4.53 117.38 110.76 2pac n GLN 53 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 2pac n GLN 53 Cb 0.35 -1.75 0.00 0.00 -4.06 0.00 0.00 30.24 24.78 2pac n GLN 53 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2pac n GLY 54 N -2.00 2.02 1.13 1.69 0.00 -1.26 -4.91 105.19 101.86 2pac n GLY 54 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2pac n GLY 54 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2pac n VAL 55 N 0.08 0.05 -0.10 1.61 0.31 -1.26 -4.92 118.33 114.09 2pac n VAL 55 Ca 0.00 0.02 -0.18 0.00 -0.01 0.00 0.00 64.34 64.16 2pac n VAL 55 Cb 0.00 -1.37 -0.06 0.00 -0.91 0.00 0.00 33.84 31.50 2pac n VAL 55 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2pac n TRP 56 N -2.96 0.00 -4.53 3.52 7.02 -1.26 -5.05 117.44 114.18 2pac n TRP 56 Ca 0.00 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.23 2pac n TRP 56 Cb 0.41 -0.69 -0.11 0.00 -2.42 0.00 0.00 31.31 28.51 2pac n TRP 56 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2pac s GLY 57 N -5.16 2.20 -0.09 6.99 0.00 -1.26 -5.03 107.32 104.97 2pac s GLY 57 Ca -0.31 -2.12 0.03 0.00 0.00 0.00 0.00 44.72 42.32 2pac s GLY 57 CO 0.42 -1.98 1.00 -1.55 0.00 0.00 0.00 173.10 170.98 2pac n PRO 58 N -0.79 1.76 -3.65 2.90 -0.04 -1.26 -4.41 135.00 129.51 2pac n PRO 58 Ca -0.05 -0.82 -0.38 0.00 -0.04 0.00 0.00 63.50 62.22 2pac n PRO 58 Cb 0.65 -1.55 -0.08 0.00 -0.04 0.00 0.00 33.50 32.49 2pac n PRO 58 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2pac s ILE 59 N -1.23 4.11 0.22 0.52 2.07 -1.26 -5.01 121.20 120.62 2pac s ILE 59 Ca 0.15 -3.17 -0.31 0.00 -1.41 0.00 0.00 60.65 55.91 2pac s ILE 59 Cb 0.12 -3.62 -0.15 0.00 0.13 0.00 0.00 42.46 38.94 2pac s ILE 59 CO 0.04 -0.95 1.11 -0.81 -1.91 0.00 0.00 174.94 172.41 2pac n PRO 60 N 3.21 1.27 -2.41 3.50 -0.04 -1.26 -4.88 135.00 134.39 2pac n PRO 60 Ca 0.12 0.45 -0.42 0.00 -0.04 0.00 0.00 63.50 63.61 2pac n PRO 60 Cb 0.39 -1.90 -0.03 0.00 -0.04 0.00 0.00 33.50 31.92 2pac n PRO 60 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2pac s MET 61 N -0.83 4.35 -0.25 0.54 -2.45 -1.26 -4.92 119.30 114.47 2pac s MET 61 Ca 0.67 1.74 -0.40 0.00 -1.25 0.00 0.00 55.69 56.45 2pac s MET 61 Cb -0.78 -3.54 -0.16 0.00 1.25 0.00 0.00 34.83 31.60 2pac s MET 61 CO 0.55 -0.45 1.69 -2.30 1.05 0.00 0.00 175.02 175.56 2pac n PRO 62 N 5.10 1.11 -1.40 4.11 -0.02 -1.26 -3.14 135.00 139.49 2pac n PRO 62 Ca 0.11 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.68 2pac n PRO 62 Cb 0.46 -2.08 0.08 0.00 -0.02 0.00 0.00 33.50 31.94 2pac n PRO 62 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2pac s PRO 63 N 3.18 2.45 0.02 0.52 0.04 -1.26 -4.68 135.00 135.28 2pac s PRO 63 Ca 0.97 1.18 0.00 0.00 0.04 0.00 0.00 61.00 63.19 2pac s PRO 63 Cb -1.07 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 31.55 2pac s PRO 63 CO 0.64 -1.49 0.00 -1.71 0.04 0.00 0.00 177.00 174.48 2pac n ASN 64 N -3.26 -5.60 0.00 6.66 4.05 -1.10 -4.93 115.26 111.09 2pac n ASN 64 Ca 0.09 0.87 0.00 0.00 0.45 0.00 0.00 54.58 55.99 2pac n ASN 64 Cb 0.53 -3.01 0.00 0.00 1.23 0.00 0.00 39.78 38.53 2pac n ASN 64 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2pac n ALA 65 N 0.88 1.84 -3.02 5.20 0.00 -1.26 -4.99 120.51 119.16 2pac n ALA 65 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2pac n ALA 65 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2pac n ALA 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2pac s VAL 66 N -1.77 0.08 1.09 0.00 -7.23 -1.26 -5.08 120.40 106.23 2pac s VAL 66 Ca 0.00 -0.68 -0.16 0.00 -1.81 0.00 0.00 61.98 59.33 2pac s VAL 66 Cb 0.00 -0.87 0.23 0.00 0.56 0.00 0.00 36.38 36.30 2pac s VAL 66 CO 0.00 -0.38 1.12 -0.44 -0.31 0.00 0.00 175.10 175.10 2pac s SER 67 N -1.94 1.92 0.34 4.85 0.01 -1.26 -4.52 113.70 113.11 2pac s SER 67 Ca -0.07 0.82 -0.29 0.00 1.31 0.00 0.00 55.95 57.72 2pac s SER 67 Cb -0.02 -1.23 -0.11 0.00 0.21 0.00 0.00 66.02 64.88 2pac s SER 67 CO -0.02 -3.52 1.51 -0.62 0.41 0.00 0.00 173.24 170.99 2pac s ASP 68 N -3.84 6.39 0.00 2.44 2.15 -1.26 -1.44 116.67 121.11 2pac s ASP 68 Ca 0.68 2.98 0.00 0.00 0.43 0.00 0.00 52.55 56.65 2pac s ASP 68 Cb -0.13 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.84 2pac s ASP 68 CO 0.56 -0.86 0.00 -0.67 -0.17 0.00 0.00 175.17 174.03 2pac n ASP 69 N 1.09 0.00 0.17 -0.34 2.03 -1.26 -4.63 116.55 113.61 2pac n ASP 69 Ca 0.03 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.39 2pac n ASP 69 Cb 0.39 0.00 0.24 0.00 -0.72 0.00 0.00 41.12 41.03 2pac n ASP 69 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2pac h GLU 70 N 0.00 0.00 0.08 -0.67 4.39 -1.64 -2.22 114.58 114.52 2pac h GLU 70 Ca 0.00 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.39 2pac h GLU 70 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2pac h GLU 70 CO 0.00 0.41 -1.66 0.00 -1.16 0.00 0.00 179.01 176.60 2pac h ALA 71 N 1.59 0.34 -0.89 3.43 0.00 -1.48 -3.28 119.26 118.98 2pac h ALA 71 Ca -0.00 -1.30 0.21 0.00 0.00 0.00 0.00 54.91 53.83 2pac h ALA 71 Cb 1.05 0.70 -0.06 0.00 0.00 0.00 0.00 17.79 19.49 2pac h ALA 71 CO 0.05 1.03 0.60 0.37 0.00 0.00 0.00 179.25 181.30 2pac h GLN 72 N -0.39 0.29 0.05 0.00 4.15 -1.81 0.51 115.11 117.92 2pac h GLN 72 Ca -0.38 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.01 2pac h GLN 72 Cb 1.72 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 29.35 2pac h GLN 72 CO -0.03 0.19 -0.03 1.15 -1.93 0.00 0.00 178.83 178.18 2pac h THR 73 N 0.30 1.22 0.00 2.39 2.02 -1.53 -1.37 112.91 115.94 2pac h THR 73 Ca 0.45 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2pac h THR 73 Cb 1.29 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 69.56 2pac h THR 73 CO -0.14 0.25 0.00 0.18 0.37 0.00 0.00 175.52 176.18 2pac n LEU 74 N -4.92 0.00 -0.01 2.58 7.99 -0.09 -1.83 117.00 120.72 2pac n LEU 74 Ca -0.08 0.47 -0.10 0.00 -0.01 0.00 0.00 56.01 56.28 2pac n LEU 74 Cb 0.24 -0.47 -0.14 0.00 -0.11 0.00 0.00 43.42 42.94 2pac n LEU 74 CO 0.32 -0.21 -0.52 0.00 -1.51 0.00 0.00 177.39 175.47 2pac h ALA 75 N 2.58 0.71 -0.04 -1.18 0.00 0.17 -2.76 119.26 118.73 2pac h ALA 75 Ca 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 54.91 53.45 2pac h ALA 75 Cb 0.25 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2pac h ALA 75 CO 0.00 1.53 -0.11 -0.22 0.00 0.00 0.00 179.25 180.46 2pac h LYS 76 N 0.01 0.15 -0.12 0.00 3.64 -0.48 -0.78 116.57 118.99 2pac h LYS 76 Ca -0.29 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 58.92 2pac h LYS 76 Cb 2.01 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.83 2pac h LYS 76 CO 0.08 0.71 -0.25 2.35 -2.27 0.00 0.00 179.45 180.08 2pac h TRP 77 N -0.39 0.24 -0.17 1.91 7.01 -1.56 0.56 115.95 123.54 2pac h TRP 77 Ca -0.00 -0.04 0.01 0.00 2.11 0.00 0.00 58.89 60.97 2pac h TRP 77 Cb 0.71 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 2pac h TRP 77 CO 0.13 0.45 0.07 -0.24 -2.79 0.00 0.00 178.44 176.06 2pac h VAL 78 N 0.20 0.97 -0.98 2.65 3.04 -1.40 -2.21 116.25 118.53 2pac h VAL 78 Ca 0.03 -0.05 -0.58 0.00 -1.01 0.00 0.00 66.70 65.09 2pac h VAL 78 Cb 0.55 0.80 -0.30 0.00 -2.01 0.00 0.00 31.29 30.33 2pac h VAL 78 CO 0.04 0.03 0.75 -0.11 -1.01 0.00 0.00 177.57 177.26 2pac n LEU 79 N -5.04 7.13 -0.53 3.16 0.00 -0.20 -4.08 117.00 117.44 2pac n LEU 79 Ca -0.03 -3.88 -0.00 0.00 0.00 0.00 0.00 56.01 52.09 2pac n LEU 79 Cb 0.06 -0.90 -0.00 0.00 0.00 0.00 0.00 43.42 42.58 2pac n LEU 79 CO 0.31 1.23 0.25 -0.24 0.00 0.00 0.00 177.39 178.94 2pac n SER 80 N -1.01 -0.02 0.00 1.96 2.88 0.18 -4.78 113.62 112.83 2pac n SER 80 Ca 0.60 -1.29 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 2pac n SER 80 Cb 1.20 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.62 2pac n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pac n GLN 81 N 0.01 0.00 0.00 -1.46 10.64 -0.87 -4.89 117.38 120.80 2pac n GLN 81 Ca -0.01 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.24 2pac n GLN 81 Cb 0.56 0.00 0.46 0.00 -0.86 0.00 0.00 30.24 30.40 2pac n GLN 81 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40