#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1boc h LYS 1 N 0.00 0.05 0.00 0.03 -0.00 -1.95 -3.46 116.57 111.24 1boc h LYS 1 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1boc h LYS 1 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 32.23 32.22 1boc h LYS 1 CO 0.00 0.03 0.00 -1.13 -0.00 0.00 0.00 179.45 178.35 1boc n SER 2 N -5.43 0.00 -3.20 7.07 3.41 -1.26 -0.88 113.62 113.32 1boc n SER 2 Ca 0.20 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.59 1boc n SER 2 Cb 0.65 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.58 1boc n SER 2 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1boc n PRO 3 N 0.00 1.74 -2.26 4.33 -0.05 -1.26 -4.26 135.00 133.24 1boc n PRO 3 Ca 0.00 -1.36 -0.03 0.00 -0.05 0.00 0.00 63.50 62.05 1boc n PRO 3 Cb 0.00 -2.43 0.02 0.00 -0.05 0.00 0.00 33.50 31.03 1boc n PRO 3 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 1boc n GLU 4 N 4.61 -1.27 -0.10 0.54 1.02 -1.26 -4.99 120.64 119.18 1boc n GLU 4 Ca 0.39 0.17 -0.18 0.00 -0.02 0.00 0.00 57.16 57.52 1boc n GLU 4 Cb 0.14 -3.13 -0.08 0.00 -0.02 0.00 0.00 31.44 28.35 1boc n GLU 4 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1boc n GLU 5 N -1.63 0.45 0.03 3.49 4.07 -1.26 -4.56 120.64 121.23 1boc n GLU 5 Ca -0.06 0.15 -0.22 0.00 -0.06 0.00 0.00 57.16 56.97 1boc n GLU 5 Cb 0.53 -1.30 -0.14 0.00 -0.06 0.00 0.00 31.44 30.47 1boc n GLU 5 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1boc h LEU 6 N -0.37 0.49 -0.87 4.31 5.85 -1.93 -3.30 115.31 119.49 1boc h LEU 6 Ca -0.47 -0.91 0.00 0.00 0.84 0.00 0.00 57.88 57.34 1boc h LEU 6 Cb 1.55 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.43 1boc h LEU 6 CO -0.19 1.75 0.15 1.17 -0.34 0.00 0.00 178.44 180.97 1boc n LYS 7 N -3.69 0.09 -0.03 1.25 4.81 -1.26 -1.54 118.16 117.78 1boc n LYS 7 Ca -0.27 0.55 -0.17 0.00 -0.87 0.00 0.00 58.31 57.56 1boc n LYS 7 Cb 1.01 -1.93 -0.07 0.00 0.02 0.00 0.00 35.03 34.05 1boc n LYS 7 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1boc h GLY 8 N 0.00 0.77 1.00 3.14 0.00 -1.80 -3.31 103.07 102.86 1boc h GLY 8 Ca 0.00 -1.06 -0.03 0.00 0.00 0.00 0.00 47.33 46.24 1boc h GLY 8 CO 0.00 0.95 -0.26 1.19 0.00 0.00 0.00 176.54 178.42 1boc h ILE 9 N 0.39 0.47 0.00 2.60 -0.00 -1.48 -2.64 117.51 116.84 1boc h ILE 9 Ca -0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 64.86 64.80 1boc h ILE 9 Cb 1.28 0.48 0.00 0.00 -0.00 0.00 0.00 36.82 38.58 1boc h ILE 9 CO 0.14 0.00 0.00 0.49 -0.00 0.00 0.00 178.15 178.78 1boc n PHE 10 N -5.40 0.00 -0.10 2.19 3.01 -1.25 0.63 117.46 116.54 1boc n PHE 10 Ca -0.12 0.00 0.23 0.00 1.01 0.00 0.00 57.45 58.56 1boc n PHE 10 Cb 0.30 0.00 0.37 0.00 -0.01 0.00 0.00 39.48 40.14 1boc n PHE 10 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1boc h GLU 11 N 0.00 0.00 0.00 -1.08 5.08 -1.55 1.06 114.58 118.09 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 -3.12 0.00 0.07 2.33 3.00 0.18 -3.66 118.16 116.95 1boc n LYS 12 Ca 0.18 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.37 1boc n LYS 12 Cb 1.39 -0.34 -0.04 0.00 0.00 0.00 0.00 35.03 36.04 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 0.53 0.00 5.64 0.05 0.48 -1.73 116.97 121.93 1boc h TYR 13 Ca 0.00 -0.29 -0.00 0.00 0.05 0.00 0.00 58.73 58.49 1boc h TYR 13 Cb 0.00 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 37.68 1boc h TYR 13 CO 0.00 1.11 -0.00 0.00 -1.05 0.00 0.00 178.16 178.22 1boc h ALA 14 N 0.79 1.46 0.00 3.88 0.00 0.12 0.16 119.26 125.67 1boc h ALA 14 Ca -0.07 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1boc h ALA 14 Cb 1.57 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1boc h ALA 14 CO 0.16 0.01 -0.80 0.22 0.00 0.00 0.00 179.25 178.83 1boc h ASP 15 N 0.00 0.00 -0.22 0.00 3.58 -0.84 0.52 116.42 119.46 1boc h ASP 15 Ca -0.00 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.48 1boc h ASP 15 Cb 0.01 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1boc h ASP 15 CO 0.00 0.17 0.15 0.50 -2.88 0.00 0.00 179.24 177.18 1boc h LYS 16 N 0.00 0.18 0.00 0.28 1.63 0.20 0.70 116.57 119.56 1boc h LYS 16 Ca -0.03 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 1boc h LYS 16 Cb 1.15 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.74 1boc h LYS 16 CO 0.02 0.12 -0.04 1.05 -3.45 0.00 0.00 179.45 177.15 1boc h GLU 17 N 0.18 0.00 0.00 1.90 4.11 -1.65 -3.46 114.58 115.65 1boc h GLU 17 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.52 1boc h GLU 17 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1boc h GLU 17 CO -0.02 0.04 0.00 0.41 0.07 0.00 0.00 179.01 179.51 1boc n GLY 18 N 1.05 0.43 0.00 1.06 0.00 0.23 -5.06 105.19 102.90 1boc n GLY 18 Ca 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1boc n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1boc n ASP 19 N 0.00 0.00 0.00 1.61 -0.08 -1.13 -4.99 116.55 111.96 1boc n ASP 19 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1boc n ASP 19 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1boc n ASP 19 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1boc n GLY 20 N 0.00 1.62 0.92 0.27 0.00 0.18 -4.33 105.19 103.86 1boc n GLY 20 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 2.85 -3.78 1.61 5.03 -1.26 -2.34 115.26 117.37 1boc n ASN 21 Ca 0.00 -1.92 -0.10 0.00 0.87 0.00 0.00 54.58 53.43 1boc n ASN 21 Cb 0.00 -0.06 -0.07 0.00 -1.02 0.00 0.00 39.78 38.63 1boc n ASN 21 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1boc s GLN 22 N -1.87 0.87 0.04 3.52 1.11 -1.26 -3.57 119.66 118.49 1boc s GLN 22 Ca 0.32 -0.76 0.00 0.00 0.01 0.00 0.00 55.36 54.93 1boc s GLN 22 Cb 0.21 0.37 0.00 0.00 -1.01 0.00 0.00 33.01 32.57 1boc s GLN 22 CO 0.31 -0.29 0.00 1.28 0.01 0.00 0.00 175.29 176.60 1boc n LEU 23 N 0.13 0.00 -3.80 2.90 4.77 -1.24 -4.16 117.00 115.59 1boc n LEU 23 Ca -0.16 -0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 55.50 1boc n LEU 23 Cb 0.62 0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.71 1boc n LEU 23 CO 0.21 -0.05 0.49 -0.44 -1.33 0.00 0.00 177.39 176.27 1boc s SER 24 N -1.21 -0.28 0.50 -1.43 0.01 -1.26 -0.98 113.70 109.04 1boc s SER 24 Ca 0.00 -0.52 0.26 0.00 1.31 0.00 0.00 55.95 57.00 1boc s SER 24 Cb -0.00 0.69 1.30 0.00 0.21 0.00 0.00 66.02 68.21 1boc s SER 24 CO 0.00 -1.26 2.00 0.50 0.41 0.00 0.00 173.24 174.90 1boc h LYS 25 N 2.00 0.00 -0.01 12.44 3.64 -1.94 -1.47 116.57 131.24 1boc h LYS 25 Ca -0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1boc h LYS 25 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1boc h LYS 25 CO 0.25 0.16 0.00 0.39 -2.27 0.00 0.00 179.45 177.97 1boc n GLU 26 N -3.59 1.02 0.00 1.90 1.02 -1.26 -3.29 120.64 116.44 1boc n GLU 26 Ca -0.01 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1boc n GLU 26 Cb 0.29 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1boc n GLU 26 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1boc n GLU 27 N -0.75 0.94 -0.09 3.49 1.02 -0.57 -4.57 120.64 120.11 1boc n GLU 27 Ca 0.14 -0.78 -0.23 0.00 -0.02 0.00 0.00 57.16 56.26 1boc n GLU 27 Cb 0.07 -0.73 -0.12 0.00 -0.02 0.00 0.00 31.44 30.64 1boc n GLU 27 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1boc n LEU 28 N -0.17 2.35 -0.00 -4.62 7.94 -1.12 -3.75 117.00 117.62 1boc n LEU 28 Ca 0.00 0.22 -0.09 0.00 -1.11 0.00 0.00 56.01 55.03 1boc n LEU 28 Cb 0.32 -0.96 -0.03 0.00 0.53 0.00 0.00 43.42 43.28 1boc n LEU 28 CO 0.00 0.66 0.72 0.50 -1.11 0.00 0.00 177.39 178.16 1boc h LYS 29 N -0.48 -0.25 -0.85 1.96 3.64 -1.85 0.35 116.57 119.09 1boc h LYS 29 Ca -0.51 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 59.14 1boc h LYS 29 Cb 1.71 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.56 1boc h LYS 29 CO -0.15 -0.16 0.63 -0.07 -2.27 0.00 0.00 179.45 177.42 1boc h LEU 30 N -0.26 0.00 0.88 5.20 4.07 -1.81 0.47 115.31 123.87 1boc h LEU 30 Ca 0.10 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 1boc h LEU 30 Cb 0.41 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.16 1boc h LEU 30 CO -0.29 0.00 -0.42 0.25 -1.08 0.00 0.00 178.44 176.90 1boc h LEU 31 N 0.00 -1.00 -0.47 1.67 6.46 -0.40 -0.44 115.31 121.13 1boc h LEU 31 Ca 0.40 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 58.27 1boc h LEU 31 Cb 1.66 0.26 -0.09 0.00 -0.73 0.00 0.00 40.66 41.76 1boc h LEU 31 CO -0.00 -0.69 -0.45 -0.07 -0.62 0.00 0.00 178.44 176.61 1boc h LEU 32 N -1.24 -1.50 -1.62 2.25 3.38 -0.50 0.27 115.31 116.35 1boc h LEU 32 Ca -0.12 0.23 0.18 0.00 0.09 0.00 0.00 57.88 58.26 1boc h LEU 32 Cb 0.91 0.66 -0.05 0.00 0.09 0.00 0.00 40.66 42.26 1boc h LEU 32 CO 0.20 -0.36 0.54 1.56 0.09 0.00 0.00 178.44 180.47 1boc h GLN 33 N -0.30 0.34 0.00 1.13 4.20 -1.17 3.40 115.11 122.71 1boc h GLN 33 Ca 0.14 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1boc h GLN 33 Cb 0.58 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1boc h GLN 33 CO -0.62 0.22 -0.47 0.00 -0.67 0.00 0.00 178.83 177.30 1boc h THR 34 N 0.35 0.00 0.00 -0.54 1.03 0.12 -3.41 112.91 110.45 1boc h THR 34 Ca 0.40 -0.97 0.00 0.00 -0.01 0.00 0.00 66.41 65.84 1boc h THR 34 Cb 1.05 1.73 0.00 0.00 -1.07 0.00 0.00 68.15 69.86 1boc h THR 34 CO -0.12 0.00 -0.39 -0.62 -0.01 0.00 0.00 175.52 174.38 1boc n GLU 35 N -2.85 0.00 -3.15 0.00 1.02 0.09 -5.00 120.64 110.74 1boc n GLU 35 Ca 0.02 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.98 1boc n GLU 35 Cb 0.53 -0.34 -0.06 0.00 -0.02 0.00 0.00 31.44 31.56 1boc n GLU 35 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1boc n PHE 36 N -3.11 -2.03 0.25 -0.32 3.72 0.96 -4.97 117.46 111.95 1boc n PHE 36 Ca 0.00 -2.58 0.13 0.00 -0.05 0.00 0.00 57.45 54.95 1boc n PHE 36 Cb 0.19 0.72 0.77 0.00 -0.94 0.00 0.00 39.48 40.23 1boc n PHE 36 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1boc h PRO 37 N 5.38 0.00 -0.00 -1.08 0.10 0.34 -1.58 132.00 135.16 1boc h PRO 37 Ca 0.19 0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.29 1boc h PRO 37 Cb 0.98 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.08 1boc h PRO 37 CO 0.24 0.00 -0.00 -1.13 0.10 0.00 0.00 178.00 177.20 1boc n SER 38 N -4.16 0.09 0.00 -2.05 3.41 -1.26 -3.02 113.62 106.62 1boc n SER 38 Ca -0.01 -0.85 0.13 0.00 -0.26 0.00 0.00 58.87 57.87 1boc n SER 38 Cb 0.16 -0.06 0.73 0.00 -0.26 0.00 0.00 64.21 64.78 1boc n SER 38 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1boc n LEU 39 N -0.99 0.00 0.34 1.04 -0.00 -0.59 -3.43 117.00 113.37 1boc n LEU 39 Ca 0.22 0.06 -0.15 0.00 -0.00 0.00 0.00 56.01 56.14 1boc n LEU 39 Cb 0.15 -0.06 -0.08 0.00 -0.00 0.00 0.00 43.42 43.44 1boc n LEU 39 CO 0.19 -0.01 0.44 -0.07 -0.00 0.00 0.00 177.39 177.94 1boc h LEU 40 N 0.00 -0.75 -8.06 1.47 3.38 -1.75 -3.39 115.31 106.21 1boc h LEU 40 Ca 0.00 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1boc h LEU 40 Cb 0.05 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1boc h LEU 40 CO 0.00 -0.39 0.91 0.29 0.09 0.00 0.00 178.44 179.35 1boc n LYS 41 N -5.38 0.09 0.13 1.13 5.02 -1.22 -4.13 118.16 113.79 1boc n LYS 41 Ca -0.12 -0.47 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1boc n LYS 41 Cb 0.37 -1.97 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1boc n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1boc n GLY 42 N 5.38 -0.27 0.00 0.72 0.00 -1.26 -5.15 105.19 104.61 1boc n GLY 42 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.41 0.00 0.00 1.61 2.81 -1.26 -5.13 117.12 111.74 1boc n MET 43 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1boc n MET 43 Cb 0.01 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.52 1boc n MET 43 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1boc n SER 44 N 0.00 0.00 0.00 7.83 3.41 -1.26 -4.48 113.62 119.12 1boc n SER 44 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1boc n SER 44 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1boc n SER 44 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1boc n THR 45 N 0.00 0.00 0.00 6.66 5.66 -1.26 -4.91 114.28 120.43 1boc n THR 45 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1boc n THR 45 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1boc n THR 45 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1boc n LEU 46 N 0.00 1.16 -0.15 1.09 7.99 -1.26 -4.65 117.00 121.17 1boc n LEU 46 Ca 0.00 0.20 0.05 0.00 -0.01 0.00 0.00 56.01 56.25 1boc n LEU 46 Cb 0.00 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.28 1boc n LEU 46 CO 0.00 0.00 0.12 0.47 -1.51 0.00 0.00 177.39 176.47 1boc n ASP 47 N -0.39 0.99 -0.42 -1.43 9.92 -1.26 -4.31 116.55 119.64 1boc n ASP 47 Ca 0.00 -0.99 -0.06 0.00 -0.53 0.00 0.00 54.79 53.21 1boc n ASP 47 Cb 0.00 0.69 -0.02 0.00 -0.64 0.00 0.00 41.12 41.14 1boc n ASP 47 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1boc n GLU 48 N -0.64 -0.51 0.11 -1.24 2.13 -1.26 -4.85 120.64 114.38 1boc n GLU 48 Ca 0.04 0.63 0.13 0.00 0.66 0.00 0.00 57.16 58.61 1boc n GLU 48 Cb 0.21 -4.36 0.32 0.00 0.27 0.00 0.00 31.44 27.88 1boc n GLU 48 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1boc h LEU 49 N 0.00 0.00 0.09 4.31 5.85 -1.97 -2.46 115.31 121.13 1boc h LEU 49 Ca -0.11 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.45 1boc h LEU 49 Cb 0.42 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.47 1boc h LEU 49 CO 0.17 0.02 -0.50 0.15 -0.34 0.00 0.00 178.44 177.94 1boc h PHE 50 N 0.00 0.33 0.00 1.25 3.57 -1.88 -2.61 116.94 117.60 1boc h PHE 50 Ca 0.00 -0.24 -0.11 0.00 3.53 0.00 0.00 57.97 61.15 1boc h PHE 50 Cb 0.78 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 1boc h PHE 50 CO 0.00 1.19 -0.52 1.49 -2.23 0.00 0.00 178.31 178.24 1boc h GLU 51 N -0.62 0.00 0.00 1.11 4.81 -1.66 -1.65 114.58 116.57 1boc h GLU 51 Ca -0.09 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.01 1boc h GLU 51 Cb 1.39 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.75 1boc h GLU 51 CO 0.09 0.52 -0.61 1.49 -0.73 0.00 0.00 179.01 179.77 1boc h GLU 52 N 0.00 0.00 0.00 1.92 4.81 -1.55 -3.40 114.58 116.36 1boc h GLU 52 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1boc h GLU 52 Cb 1.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.75 1boc h GLU 52 CO 0.07 0.61 -0.38 1.28 -0.73 0.00 0.00 179.01 179.85 1boc n LEU 53 N -3.25 0.75 -4.80 1.64 4.77 -0.98 -5.04 117.00 110.08 1boc n LEU 53 Ca 0.02 0.13 -0.22 0.00 -0.03 0.00 0.00 56.01 55.90 1boc n LEU 53 Cb 0.78 -0.58 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 1boc n LEU 53 CO 0.42 -0.42 -0.11 -0.62 -1.33 0.00 0.00 177.39 175.33 1boc s ASP 54 N -4.77 4.91 0.00 -1.43 2.15 -0.62 -5.04 116.67 111.87 1boc s ASP 54 Ca -0.11 -0.73 0.00 0.00 0.43 0.00 0.00 52.55 52.14 1boc s ASP 54 Cb 0.02 -0.72 0.00 0.00 -0.30 0.00 0.00 42.92 41.91 1boc s ASP 54 CO 0.16 -0.44 0.15 0.29 -0.17 0.00 0.00 175.17 175.16 1boc n LYS 55 N -1.33 0.00 -0.32 4.34 5.02 -1.26 -3.83 118.16 120.78 1boc n LYS 55 Ca -0.01 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.13 1boc n LYS 55 Cb 0.61 -0.31 0.00 0.00 -0.02 0.00 0.00 35.03 35.32 1boc n LYS 55 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1boc n ASN 56 N 0.00 0.00 0.06 4.39 4.05 -1.26 -4.90 115.26 117.60 1boc n ASN 56 Ca 0.00 -0.93 0.07 0.00 0.45 0.00 0.00 54.58 54.16 1boc n ASN 56 Cb 0.37 0.00 0.30 0.00 1.23 0.00 0.00 39.78 41.69 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 -0.88 0.91 8.20 0.00 -1.26 -4.76 105.19 107.40 1boc n GLY 57 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.79 -1.36 0.00 1.61 5.75 -1.26 -3.72 116.55 115.78 1boc n ASP 58 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.79 1boc n ASP 58 Cb 0.11 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.97 1boc n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1boc n GLY 59 N -2.45 0.60 3.62 6.12 0.00 -1.26 -5.08 105.19 106.74 1boc n GLY 59 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.93 2.25 0.00 1.61 -6.30 -1.24 -2.93 118.70 111.16 1boc s GLU 60 Ca 0.00 -1.12 0.00 0.00 -2.50 0.00 0.00 54.97 51.35 1boc s GLU 60 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 34.13 31.83 1boc s GLU 60 CO 0.00 0.47 0.00 1.55 0.02 0.00 0.00 175.26 177.30 1boc n VAL 61 N 0.16 0.00 -3.75 3.70 3.14 -0.15 -4.43 118.33 117.00 1boc n VAL 61 Ca -0.11 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.18 1boc n VAL 61 Cb 0.54 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.30 1boc n VAL 61 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1boc s SER 62 N 1.00 -0.32 0.34 6.55 1.04 -1.26 -3.69 113.70 117.36 1boc s SER 62 Ca 0.00 -0.47 0.25 0.00 0.48 0.00 0.00 55.95 56.21 1boc s SER 62 Cb 0.00 0.66 1.20 0.00 0.10 0.00 0.00 66.02 67.98 1boc s SER 62 CO 0.00 -1.19 1.76 0.15 0.98 0.00 0.00 173.24 174.94 1boc h PHE 63 N 2.06 0.00 0.00 5.02 3.57 -1.95 -0.44 116.94 125.20 1boc h PHE 63 Ca -0.25 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.15 1boc h PHE 63 Cb 1.27 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.99 1boc h PHE 63 CO 0.37 0.00 -0.47 1.49 -2.23 0.00 0.00 178.31 177.46 1boc h GLU 64 N 0.00 0.00 0.00 1.11 4.57 -1.94 -2.83 114.58 115.49 1boc h GLU 64 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1boc h GLU 64 Cb 0.19 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1boc h GLU 64 CO 0.00 0.47 -1.24 0.39 -1.18 0.00 0.00 179.01 177.45 1boc n GLU 65 N -3.95 0.78 -0.02 1.92 -0.58 -0.51 -4.10 120.64 114.19 1boc n GLU 65 Ca -0.02 -0.06 0.02 0.00 -0.42 0.00 0.00 57.16 56.68 1boc n GLU 65 Cb 0.50 -1.40 0.08 0.00 -0.57 0.00 0.00 31.44 30.04 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 -1.70 0.04 0.05 -0.32 7.35 -0.29 -3.35 117.46 119.24 1boc n PHE 66 Ca 0.01 -0.02 -0.10 0.00 -0.76 0.00 0.00 57.45 56.58 1boc n PHE 66 Cb 0.36 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 40.06 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 0.20 0.07 -1.05 -4.13 1.08 -1.69 -3.17 115.11 106.42 1boc h GLN 67 Ca 0.00 -0.12 0.28 0.00 -1.45 0.00 0.00 58.65 57.36 1boc h GLN 67 Cb 0.05 0.04 -0.08 0.00 -0.05 0.00 0.00 27.48 27.44 1boc h GLN 67 CO 0.00 0.94 0.71 0.28 -0.95 0.00 0.00 178.83 179.80 1boc h VAL 68 N 0.02 0.50 -0.03 -0.54 2.07 -1.86 1.15 116.25 117.57 1boc h VAL 68 Ca -0.12 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.14 1boc h VAL 68 Cb 1.88 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 1boc h VAL 68 CO 0.13 0.05 -0.75 0.25 0.02 0.00 0.00 177.57 177.27 1boc h LEU 69 N 0.27 0.25 -1.61 2.57 6.46 -1.80 -3.17 115.31 118.27 1boc h LEU 69 Ca 0.57 -0.18 0.13 0.00 -0.12 0.00 0.00 57.88 58.28 1boc h LEU 69 Cb 1.68 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 41.50 1boc h LEU 69 CO -0.20 0.91 0.46 1.62 -0.62 0.00 0.00 178.44 180.61 1boc h VAL 70 N 0.13 0.84 -0.38 1.05 3.04 0.13 0.45 116.25 121.52 1boc h VAL 70 Ca -0.03 -0.14 -0.05 0.00 -1.01 0.00 0.00 66.70 65.47 1boc h VAL 70 Cb 1.33 0.40 -0.03 0.00 -2.01 0.00 0.00 31.29 30.97 1boc h VAL 70 CO 0.11 0.07 0.07 1.17 -1.01 0.00 0.00 177.57 177.99 1boc n LYS 71 N -4.47 3.02 -0.00 4.17 4.81 -1.12 -3.53 118.16 121.04 1boc n LYS 71 Ca 0.12 -1.83 0.03 0.00 -0.87 0.00 0.00 58.31 55.76 1boc n LYS 71 Cb 0.46 -1.91 -0.03 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 1.17 0.00 0.00 177.40 180.20 1boc n LYS 72 N 0.22 4.38 -0.12 1.64 4.01 0.16 -4.71 118.16 123.73 1boc n LYS 72 Ca 0.20 -0.01 -0.22 0.00 -0.51 0.00 0.00 58.31 57.76 1boc n LYS 72 Cb 0.88 -0.82 -0.10 0.00 -0.51 0.00 0.00 35.03 34.48 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 -1.22 1.37 0.00 -0.18 2.08 -1.17 -5.01 119.36 115.23 1boc n ILE 73 Ca 0.01 -0.43 0.00 0.00 0.56 0.00 0.00 62.75 62.89 1boc n ILE 73 Cb 0.10 -1.62 0.00 0.00 -0.75 0.00 0.00 39.64 37.37 1boc n ILE 73 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1boc n SER 74 N -3.71 -0.44 0.00 4.38 2.88 -0.06 -4.90 113.62 111.76 1boc n SER 74 Ca -0.46 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.08 1boc n SER 74 Cb 0.89 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.35 1boc n SER 74 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48