#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1boc n LYS 1 N 0.00 0.10 -3.41 0.03 2.85 -1.26 -4.85 118.16 111.63 1boc n LYS 1 Ca 0.00 0.39 0.02 0.00 -1.05 0.00 0.00 58.31 57.67 1boc n LYS 1 Cb 0.00 -1.72 0.01 0.00 -0.65 0.00 0.00 35.03 32.67 1boc n LYS 1 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1boc n SER 2 N -1.92 -0.85 -4.27 -5.58 3.41 -1.26 -0.10 113.62 103.05 1boc n SER 2 Ca 0.02 -1.16 -0.10 0.00 -0.26 0.00 0.00 58.87 57.37 1boc n SER 2 Cb 0.17 1.31 -0.07 0.00 -0.26 0.00 0.00 64.21 65.36 1boc n SER 2 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1boc n PRO 3 N -0.67 0.05 -2.77 4.33 -0.02 -1.26 -2.70 135.00 131.95 1boc n PRO 3 Ca 0.03 -0.97 -0.10 0.00 -2.02 0.00 0.00 63.50 60.45 1boc n PRO 3 Cb 0.42 -2.66 0.05 0.00 -0.02 0.00 0.00 33.50 31.28 1boc n PRO 3 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1boc n GLU 4 N 6.61 -3.38 0.00 -0.52 1.02 -1.26 -4.95 120.64 118.16 1boc n GLU 4 Ca 0.25 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 57.88 1boc n GLU 4 Cb 0.47 -4.36 0.00 0.00 -0.02 0.00 0.00 31.44 27.53 1boc n GLU 4 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1boc n GLU 5 N -2.75 1.73 -0.13 3.49 1.02 -1.10 -4.61 120.64 118.30 1boc n GLU 5 Ca -0.14 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.89 1boc n GLU 5 Cb 0.59 -0.97 -0.02 0.00 -0.02 0.00 0.00 31.44 31.02 1boc n GLU 5 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1boc h LEU 6 N 0.00 0.67 0.00 -4.62 6.46 -1.90 -2.38 115.31 113.53 1boc h LEU 6 Ca 0.00 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.45 1boc h LEU 6 Cb 0.38 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1boc h LEU 6 CO 0.00 0.81 0.00 1.17 -0.62 0.00 0.00 178.44 179.80 1boc n LYS 7 N -4.46 0.98 -0.05 1.25 4.81 -1.26 -3.09 118.16 116.34 1boc n LYS 7 Ca -0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.37 1boc n LYS 7 Cb 0.28 -1.24 -0.14 0.00 0.02 0.00 0.00 35.03 33.96 1boc n LYS 7 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1boc n GLY 8 N 0.70 -1.03 0.06 3.14 0.00 -0.90 -4.05 105.19 103.11 1boc n GLY 8 Ca 0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 1boc n GLY 8 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1boc h ILE 9 N 0.00 0.06 0.00 -0.61 2.10 -1.50 -3.28 117.51 114.27 1boc h ILE 9 Ca -0.36 -1.05 0.00 0.00 1.08 0.00 0.00 64.86 64.53 1boc h ILE 9 Cb 1.96 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.81 1boc h ILE 9 CO 0.04 0.02 0.00 0.33 -1.08 0.00 0.00 178.15 177.46 1boc n PHE 10 N -4.70 0.00 0.24 2.19 7.35 -1.19 0.90 117.46 122.25 1boc n PHE 10 Ca -0.04 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.75 1boc n PHE 10 Cb 0.14 -0.33 0.51 0.00 0.35 0.00 0.00 39.48 40.15 1boc n PHE 10 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1boc h GLU 11 N 0.00 0.00 0.00 -4.13 5.08 -1.47 0.83 114.58 114.89 1boc h GLU 11 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1boc h GLU 11 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1boc h GLU 11 CO 0.00 0.00 0.00 1.17 -1.00 0.00 0.00 179.01 179.18 1boc n LYS 12 N -2.40 0.00 0.09 2.33 3.00 0.26 -3.78 118.16 117.66 1boc n LYS 12 Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.24 1boc n LYS 12 Cb 0.39 -0.34 -0.00 0.00 0.00 0.00 0.00 35.03 35.07 1boc n LYS 12 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 1boc h TYR 13 N 0.00 0.09 0.00 5.64 0.05 -0.60 -2.85 116.97 119.30 1boc h TYR 13 Ca 0.00 -0.05 -0.04 0.00 0.05 0.00 0.00 58.73 58.68 1boc h TYR 13 Cb 0.00 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1boc h TYR 13 CO 0.00 0.89 -0.20 0.00 -1.05 0.00 0.00 178.16 177.79 1boc h ALA 14 N 1.10 1.38 0.00 3.88 0.00 0.65 -0.65 119.26 125.61 1boc h ALA 14 Ca -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1boc h ALA 14 Cb 1.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1boc h ALA 14 CO 0.12 0.26 0.00 -0.25 0.00 0.00 0.00 179.25 179.37 1boc n ASP 15 N -3.89 0.65 0.30 0.00 8.00 -0.91 -2.83 116.55 117.86 1boc n ASP 15 Ca -0.02 0.61 0.16 0.00 0.71 0.00 0.00 54.79 56.25 1boc n ASP 15 Cb 0.29 -0.77 0.86 0.00 -0.02 0.00 0.00 41.12 41.49 1boc n ASP 15 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1boc h LYS 16 N 0.00 0.00 0.00 -1.24 1.63 -1.12 -3.40 116.57 112.44 1boc h LYS 16 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1boc h LYS 16 Cb 0.51 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 1boc h LYS 16 CO 0.00 0.00 0.00 0.39 -3.45 0.00 0.00 179.45 176.39 1boc n GLU 17 N -2.78 2.41 0.06 1.90 -0.58 -1.13 -4.99 120.64 115.54 1boc n GLU 17 Ca -0.02 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.51 1boc n GLU 17 Cb 0.25 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 31.00 1boc n GLU 17 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1boc h GLY 18 N 0.00 0.73 -1.15 0.62 0.00 -1.82 -3.47 103.07 97.99 1boc h GLY 18 Ca 0.00 -1.40 -0.58 0.00 0.00 0.00 0.00 47.33 45.35 1boc h GLY 18 CO 0.00 1.24 -0.53 -0.35 0.00 0.00 0.00 176.54 176.90 1boc s ASP 19 N -7.33 3.07 -0.20 0.19 -1.08 -1.26 -5.02 116.67 105.03 1boc s ASP 19 Ca -0.10 -1.63 0.15 0.00 -0.52 0.00 0.00 52.55 50.46 1boc s ASP 19 Cb 0.06 0.42 0.58 0.00 -1.46 0.00 0.00 42.92 42.52 1boc s ASP 19 CO 0.92 -0.87 1.49 0.61 0.52 0.00 0.00 175.17 177.85 1boc n GLY 20 N -0.97 3.96 0.49 2.66 0.00 -1.25 -2.50 105.19 107.59 1boc n GLY 20 Ca -0.08 -1.04 0.06 0.00 0.00 0.00 0.00 46.02 44.95 1boc n GLY 20 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1boc n ASN 21 N -0.40 2.06 -3.95 1.61 3.02 -1.26 -1.72 115.26 114.62 1boc n ASN 21 Ca 0.24 -1.53 -0.10 0.00 -0.03 0.00 0.00 54.58 53.16 1boc n ASN 21 Cb 0.97 -0.02 -0.11 0.00 -0.61 0.00 0.00 39.78 40.02 1boc n ASN 21 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1boc s GLN 22 N -1.00 0.29 0.08 3.52 1.11 -1.26 -3.14 119.66 119.27 1boc s GLN 22 Ca 0.15 -0.50 0.00 0.00 0.01 0.00 0.00 55.36 55.02 1boc s GLN 22 Cb 0.10 0.11 0.00 0.00 -1.01 0.00 0.00 33.01 32.21 1boc s GLN 22 CO 0.15 -0.05 0.04 1.28 0.01 0.00 0.00 175.29 176.72 1boc n LEU 23 N 1.78 0.00 -3.83 2.90 4.77 -1.17 -4.42 117.00 117.03 1boc n LEU 23 Ca -0.22 -0.45 -0.09 0.00 -0.03 0.00 0.00 56.01 55.22 1boc n LEU 23 Cb 0.56 0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1boc n LEU 23 CO 0.21 -0.22 0.33 -0.44 -1.33 0.00 0.00 177.39 175.94 1boc s SER 24 N -1.46 -0.24 0.48 -1.43 0.01 -1.26 -1.07 113.70 108.73 1boc s SER 24 Ca 0.03 -0.61 0.25 0.00 1.31 0.00 0.00 55.95 56.93 1boc s SER 24 Cb -0.00 0.64 1.22 0.00 0.21 0.00 0.00 66.02 68.09 1boc s SER 24 CO 0.02 -1.18 1.97 0.50 0.41 0.00 0.00 173.24 174.96 1boc h LYS 25 N 2.12 0.00 0.00 12.44 3.64 -1.96 -1.24 116.57 131.57 1boc h LYS 25 Ca -0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1boc h LYS 25 Cb 1.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 1boc h LYS 25 CO 0.31 0.18 0.00 -1.91 -2.27 0.00 0.00 179.45 175.76 1boc n GLU 26 N -3.59 0.34 0.00 1.90 4.07 -1.26 -2.94 120.64 119.15 1boc n GLU 26 Ca -0.01 0.02 0.03 0.00 -0.06 0.00 0.00 57.16 57.14 1boc n GLU 26 Cb 0.32 -1.50 0.01 0.00 -0.06 0.00 0.00 31.44 30.21 1boc n GLU 26 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1boc n GLU 27 N -1.32 1.43 0.00 5.31 -0.58 -0.51 -4.27 120.64 120.71 1boc n GLU 27 Ca 0.12 -0.64 -0.09 0.00 -0.42 0.00 0.00 57.16 56.12 1boc n GLU 27 Cb 0.24 -1.03 -0.14 0.00 -0.57 0.00 0.00 31.44 29.94 1boc n GLU 27 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1boc h LEU 28 N 0.95 0.05 0.45 -4.62 5.85 -1.33 -3.28 115.31 113.39 1boc h LEU 28 Ca 0.00 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1boc h LEU 28 Cb 0.24 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1boc h LEU 28 CO 0.00 1.08 -0.22 0.50 -0.34 0.00 0.00 178.44 179.46 1boc h LYS 29 N 0.01 -0.58 -0.48 1.25 3.64 -1.76 -2.46 116.57 116.18 1boc h LYS 29 Ca -0.23 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.33 1boc h LYS 29 Cb 1.96 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 33.89 1boc h LYS 29 CO 0.10 -0.29 0.49 -0.07 -2.27 0.00 0.00 179.45 177.40 1boc h LEU 30 N -0.83 0.00 0.06 5.20 3.38 -1.74 0.25 115.31 121.63 1boc h LEU 30 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1boc h LEU 30 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1boc h LEU 30 CO 0.10 0.00 -0.03 0.25 0.09 0.00 0.00 178.44 178.85 1boc h LEU 31 N 0.00 -0.07 0.43 1.67 7.12 -1.50 -1.24 115.31 121.72 1boc h LEU 31 Ca 0.23 -0.25 -0.01 0.00 0.13 0.00 0.00 57.88 57.97 1boc h LEU 31 Cb 1.20 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 41.33 1boc h LEU 31 CO -0.00 0.22 -0.40 -0.07 -0.13 0.00 0.00 178.44 178.05 1boc h LEU 32 N -0.36 -1.09 -1.06 2.25 3.38 -0.26 0.12 115.31 118.28 1boc h LEU 32 Ca -0.01 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1boc h LEU 32 Cb 0.32 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1boc h LEU 32 CO 0.01 -0.56 0.06 0.00 0.09 0.00 0.00 178.44 178.04 1boc n GLN 33 N -5.50 0.10 -0.05 1.13 6.02 -0.61 0.30 117.38 118.77 1boc n GLN 33 Ca -0.11 0.59 -0.04 0.00 -0.01 0.00 0.00 57.00 57.43 1boc n GLN 33 Cb 0.40 -1.90 -0.15 0.00 1.02 0.00 0.00 30.24 29.61 1boc n GLN 33 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1boc n THR 34 N -2.07 1.10 0.01 5.09 -1.04 -0.14 -4.62 114.28 112.62 1boc n THR 34 Ca -0.01 -0.75 0.00 0.00 -2.04 0.00 0.00 64.05 61.25 1boc n THR 34 Cb 0.08 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 1boc n THR 34 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1boc n GLU 35 N -2.70 0.00 -3.18 -2.82 1.02 0.23 -4.98 120.64 108.20 1boc n GLU 35 Ca -0.22 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.74 1boc n GLU 35 Cb 0.98 -0.42 -0.06 0.00 -0.02 0.00 0.00 31.44 31.92 1boc n GLU 35 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1boc s PHE 36 N -2.00 -0.01 -0.23 -0.32 0.08 0.88 -4.97 117.98 111.40 1boc s PHE 36 Ca 0.00 -1.53 0.13 0.00 0.12 0.00 0.00 56.93 55.65 1boc s PHE 36 Cb 0.00 -0.43 0.71 0.00 -0.57 0.00 0.00 43.02 42.73 1boc s PHE 36 CO 0.00 -1.00 1.33 -2.30 -0.10 0.00 0.00 175.22 173.15 1boc n PRO 37 N 3.08 0.09 -0.00 0.24 -0.01 0.80 -1.33 135.00 137.87 1boc n PRO 37 Ca 0.23 0.55 0.01 0.00 -0.01 0.00 0.00 63.50 64.29 1boc n PRO 37 Cb 0.50 -1.94 0.07 0.00 -0.01 0.00 0.00 33.50 32.12 1boc n PRO 37 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 175.50 174.36 1boc n SER 38 N -1.97 0.01 -0.06 2.55 3.41 -1.26 -3.40 113.62 112.89 1boc n SER 38 Ca -0.01 -1.92 0.03 0.00 -0.26 0.00 0.00 58.87 56.71 1boc n SER 38 Cb 0.18 -0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1boc n SER 38 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1boc n LEU 39 N -0.53 0.18 0.00 1.04 4.32 -0.44 -4.43 117.00 117.13 1boc n LEU 39 Ca 0.02 -0.08 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 1boc n LEU 39 Cb 0.01 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.79 1boc n LEU 39 CO 0.01 0.04 0.00 0.18 -1.22 0.00 0.00 177.39 176.41 1boc n LEU 40 N -0.48 0.00 0.00 2.23 4.77 -1.22 -3.94 117.00 118.36 1boc n LEU 40 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1boc n LEU 40 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1boc n LEU 40 CO 0.04 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.39 1boc n LYS 41 N -0.30 -0.96 -3.65 3.23 4.76 -1.26 -2.78 118.16 117.19 1boc n LYS 41 Ca 0.00 0.24 -0.24 0.00 -2.87 0.00 0.00 58.31 55.44 1boc n LYS 41 Cb 0.00 -4.13 0.07 0.00 -1.84 0.00 0.00 35.03 29.13 1boc n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1boc n GLY 42 N -0.85 -0.51 0.00 0.72 0.00 -1.26 -4.94 105.19 98.36 1boc n GLY 42 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1boc n GLY 42 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1boc n MET 43 N -4.84 0.00 0.00 1.61 2.00 -1.12 -5.06 117.12 109.72 1boc n MET 43 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.67 1boc n MET 43 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.79 1boc n MET 43 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1boc n SER 44 N 0.00 0.00 -2.33 7.83 3.41 -1.26 -4.60 113.62 116.67 1boc n SER 44 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.56 1boc n SER 44 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1boc n SER 44 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1boc n THR 45 N 0.00 0.00 -0.95 6.66 -1.04 -1.26 -3.95 114.28 113.74 1boc n THR 45 Ca 0.00 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1boc n THR 45 Cb 0.00 -1.83 0.00 0.00 -1.82 0.00 0.00 70.33 66.68 1boc n THR 45 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1boc n LEU 46 N 0.00 0.11 0.07 -4.42 7.94 -1.25 -4.61 117.00 114.84 1boc n LEU 46 Ca 0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.93 1boc n LEU 46 Cb 0.10 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 43.87 1boc n LEU 46 CO 0.07 -0.06 0.00 0.47 -1.11 0.00 0.00 177.39 176.76 1boc n ASP 47 N -0.00 -0.13 0.24 1.96 8.00 -1.26 -4.68 116.55 120.68 1boc n ASP 47 Ca 0.00 0.26 0.12 0.00 0.71 0.00 0.00 54.79 55.87 1boc n ASP 47 Cb 0.00 0.24 0.51 0.00 -0.02 0.00 0.00 41.12 41.85 1boc n ASP 47 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1boc h GLU 48 N 0.00 0.00 0.00 -1.24 4.11 -1.82 -0.89 114.58 114.75 1boc h GLU 48 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.39 1boc h GLU 48 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1boc h GLU 48 CO 0.00 0.17 -0.20 1.25 0.07 0.00 0.00 179.01 180.30 1boc h LEU 49 N 0.00 0.00 0.12 3.06 5.85 -1.88 -1.69 115.31 120.77 1boc h LEU 49 Ca -0.00 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.54 1boc h LEU 49 Cb 0.69 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.74 1boc h LEU 49 CO 0.02 0.20 -0.83 0.15 -0.34 0.00 0.00 178.44 177.64 1boc h PHE 50 N 0.00 0.47 -0.22 1.25 3.57 -1.48 -3.34 116.94 117.20 1boc h PHE 50 Ca -0.00 -0.34 -0.14 0.00 3.53 0.00 0.00 57.97 61.02 1boc h PHE 50 Cb 1.13 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1boc h PHE 50 CO 0.00 1.32 -0.39 1.49 -2.23 0.00 0.00 178.31 178.50 1boc h GLU 51 N -0.43 0.65 -0.84 1.11 4.81 -1.33 -2.85 114.58 115.69 1boc h GLU 51 Ca -0.16 -0.41 0.24 0.00 -0.13 0.00 0.00 59.36 58.91 1boc h GLU 51 Cb 1.60 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.99 1boc h GLU 51 CO 0.12 1.02 0.89 1.49 -0.73 0.00 0.00 179.01 181.80 1boc h GLU 52 N 0.35 0.00 0.00 1.92 4.57 -1.44 -3.37 114.58 116.60 1boc h GLU 52 Ca 0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1boc h GLU 52 Cb 0.99 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.58 1boc h GLU 52 CO 0.09 0.00 0.00 1.28 -1.18 0.00 0.00 179.01 179.20 1boc n LEU 53 N -3.54 0.00 -4.89 1.64 4.77 -1.08 -5.02 117.00 108.89 1boc n LEU 53 Ca 0.18 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.87 1boc n LEU 53 Cb 1.16 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.23 1boc n LEU 53 CO 0.27 0.00 0.39 -0.62 -1.33 0.00 0.00 177.39 176.11 1boc s ASP 54 N -1.00 6.41 -0.19 -1.43 2.15 -1.26 -4.99 116.67 116.36 1boc s ASP 54 Ca 0.00 0.97 0.15 0.00 0.43 0.00 0.00 52.55 54.09 1boc s ASP 54 Cb 0.00 -2.26 0.42 0.00 -0.30 0.00 0.00 42.92 40.78 1boc s ASP 54 CO 0.00 -0.42 1.29 2.29 -0.17 0.00 0.00 175.17 178.16 1boc n LYS 55 N -1.57 1.84 -0.33 4.34 0.00 -1.26 -4.60 118.16 116.59 1boc n LYS 55 Ca 0.01 -2.92 0.00 0.00 -0.00 0.00 0.00 58.31 55.40 1boc n LYS 55 Cb 0.54 -1.67 0.00 0.00 -0.00 0.00 0.00 35.03 33.90 1boc n LYS 55 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1boc n ASN 56 N -1.10 0.00 0.11 -5.58 4.05 -1.26 -4.90 115.26 106.59 1boc n ASN 56 Ca 0.21 -0.98 0.10 0.00 0.45 0.00 0.00 54.58 54.37 1boc n ASN 56 Cb 0.79 0.00 0.45 0.00 1.23 0.00 0.00 39.78 42.25 1boc n ASN 56 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1boc n GLY 57 N 0.00 -1.05 1.14 8.20 0.00 -1.26 -4.78 105.19 107.44 1boc n GLY 57 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1boc n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1boc n ASP 58 N -2.07 -1.71 0.00 1.61 5.68 -1.26 -3.47 116.55 115.32 1boc n ASP 58 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.30 1boc n ASP 58 Cb 0.15 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.84 1boc n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1boc n GLY 59 N -2.57 0.42 3.64 6.12 0.00 -1.26 -5.07 105.19 106.47 1boc n GLY 59 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1boc n GLY 59 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1boc s GLU 60 N -0.74 2.32 0.00 1.61 2.12 -1.23 -3.17 118.70 119.61 1boc s GLU 60 Ca 0.00 -1.14 0.00 0.00 0.36 0.00 0.00 54.97 54.19 1boc s GLU 60 Cb 0.00 -2.31 0.00 0.00 0.26 0.00 0.00 34.13 32.08 1boc s GLU 60 CO 0.00 0.45 0.00 1.33 -0.54 0.00 0.00 175.26 176.50 1boc n VAL 61 N -0.06 0.00 -4.19 3.70 0.24 -0.24 -4.13 118.33 113.66 1boc n VAL 61 Ca -0.10 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.08 1boc n VAL 61 Cb 0.55 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.82 1boc n VAL 61 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1boc s SER 62 N -0.03 0.15 0.02 -1.34 1.04 -1.26 -3.05 113.70 109.23 1boc s SER 62 Ca 0.00 -1.35 0.08 0.00 0.48 0.00 0.00 55.95 55.16 1boc s SER 62 Cb 0.00 0.38 0.36 0.00 0.10 0.00 0.00 66.02 66.87 1boc s SER 62 CO 0.00 -0.84 1.26 0.33 0.98 0.00 0.00 173.24 174.97 1boc n PHE 63 N -0.26 0.06 0.08 5.02 7.35 -1.19 -1.18 117.46 127.34 1boc n PHE 63 Ca 0.01 0.03 -0.04 0.00 -0.76 0.00 0.00 57.45 56.69 1boc n PHE 63 Cb 0.66 -0.54 -0.07 0.00 0.35 0.00 0.00 39.48 39.87 1boc n PHE 63 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1boc h GLU 64 N 0.00 0.00 0.00 -4.13 5.08 -1.94 -3.28 114.58 110.31 1boc h GLU 64 Ca 0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1boc h GLU 64 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1boc h GLU 64 CO 0.00 0.79 -1.80 0.39 -1.00 0.00 0.00 179.01 177.38 1boc n GLU 65 N -3.28 0.65 0.00 2.33 -0.58 -0.50 -3.97 120.64 115.29 1boc n GLU 65 Ca -0.01 -0.06 0.03 0.00 -0.42 0.00 0.00 57.16 56.70 1boc n GLU 65 Cb 0.88 -1.61 0.16 0.00 -0.57 0.00 0.00 31.44 30.30 1boc n GLU 65 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1boc n PHE 66 N -2.48 0.00 0.09 -0.32 7.35 -0.33 -2.98 117.46 118.79 1boc n PHE 66 Ca -0.08 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.43 1boc n PHE 66 Cb 0.69 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.37 1boc n PHE 66 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 1boc h GLN 67 N 0.00 0.30 -0.48 -4.13 1.08 -1.69 -3.18 115.11 107.02 1boc h GLN 67 Ca 0.00 -0.52 0.14 0.00 -1.45 0.00 0.00 58.65 56.82 1boc h GLN 67 Cb 0.00 0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.60 1boc h GLN 67 CO 0.00 1.20 0.49 0.28 -0.95 0.00 0.00 178.83 179.85 1boc h VAL 68 N 0.08 0.38 0.02 -0.54 2.07 -1.82 0.75 116.25 117.19 1boc h VAL 68 Ca -0.22 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 67.06 1boc h VAL 68 Cb 2.03 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 1boc h VAL 68 CO 0.19 0.00 -1.30 0.25 0.02 0.00 0.00 177.57 176.73 1boc h LEU 69 N 0.00 0.06 -1.85 2.57 6.46 -1.78 -3.28 115.31 117.50 1boc h LEU 69 Ca 0.23 -0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1boc h LEU 69 Cb 1.21 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.11 1boc h LEU 69 CO -0.00 1.07 0.04 1.62 -0.62 0.00 0.00 178.44 180.54 1boc h VAL 70 N 0.01 1.04 -0.25 1.05 3.04 0.53 0.28 116.25 121.95 1boc h VAL 70 Ca -0.13 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 1boc h VAL 70 Cb 1.88 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 32.09 1boc h VAL 70 CO 0.12 0.05 0.00 0.29 -1.01 0.00 0.00 177.57 177.02 1boc n LYS 71 N -4.49 2.16 -0.00 4.17 5.02 -1.02 -3.29 118.16 120.70 1boc n LYS 71 Ca -0.01 -1.15 0.01 0.00 -2.02 0.00 0.00 58.31 55.14 1boc n LYS 71 Cb 0.10 -1.55 0.01 0.00 -0.02 0.00 0.00 35.03 33.57 1boc n LYS 71 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1boc n LYS 72 N 0.29 -0.40 0.02 1.97 4.01 0.98 -4.82 118.16 120.21 1boc n LYS 72 Ca 0.10 -0.70 0.00 0.00 -0.51 0.00 0.00 58.31 57.20 1boc n LYS 72 Cb 0.46 -1.04 0.00 0.00 -0.51 0.00 0.00 35.03 33.94 1boc n LYS 72 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 1boc n ILE 73 N 0.06 0.52 -0.15 -0.18 2.08 -1.17 -4.86 119.36 115.67 1boc n ILE 73 Ca 0.01 0.17 -0.10 0.00 0.56 0.00 0.00 62.75 63.40 1boc n ILE 73 Cb 0.07 -1.49 -0.07 0.00 -0.75 0.00 0.00 39.64 37.39 1boc n ILE 73 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1boc h SER 74 N 0.00 -1.40 -0.01 4.38 0.02 -0.57 -3.48 113.55 112.50 1boc h SER 74 Ca 0.00 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1boc h SER 74 Cb 0.53 0.58 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1boc h SER 74 CO 0.00 -0.26 0.00 1.67 -1.14 0.00 0.00 176.83 177.10