#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 2.42 -4.10 0.03 -0.00 -1.26 -4.56 118.16 110.69 1boc n LYS 1 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.05 1boc n LYS 1 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 34.97 1boc n LYS 1 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1boc s SER 2 N -2.02 4.48 0.56 -5.58 1.04 -1.26 -4.45 113.70 106.47 1boc s SER 2 Ca 0.00 -1.15 0.29 0.00 0.48 0.00 0.00 55.95 55.57 1boc s SER 2 Cb 0.00 -0.20 1.59 0.00 0.10 0.00 0.00 66.02 67.51 1boc s SER 2 CO 0.00 -0.70 1.88 -0.65 0.98 0.00 0.00 173.24 174.74 1boc h PRO 3 N 1.25 0.00 0.00 4.02 0.11 -2.00 -3.15 132.00 132.23 1boc h PRO 3 Ca -0.42 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.51 1boc h PRO 3 Cb 1.27 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.24 1boc h PRO 3 CO 0.67 0.00 -0.28 -0.85 -0.21 0.00 0.00 178.00 177.33 1boc n GLU 4 N -2.70 1.19 -0.00 1.05 0.28 -1.26 -4.93 120.64 114.27 1boc n GLU 4 Ca -0.02 -1.44 0.01 0.00 -0.16 0.00 0.00 57.16 55.55 1boc n GLU 4 Cb 0.26 0.17 -0.01 0.00 1.43 0.00 0.00 31.44 33.28 1boc n GLU 4 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1boc n GLU 5 N -1.00 1.88 0.08 3.44 -0.58 -1.19 -4.00 120.64 119.28 1boc n GLU 5 Ca -0.11 -0.01 -0.11 0.00 -0.42 0.00 0.00 57.16 56.52 1boc n GLU 5 Cb 0.84 -0.90 -0.07 0.00 -0.57 0.00 0.00 31.44 30.74 1boc n GLU 5 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1boc h LEU 6 N 0.00 -0.23 -0.11 -4.62 6.46 -1.84 -1.73 115.31 113.24 1boc h LEU 6 Ca 0.00 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 1boc h LEU 6 Cb 0.05 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.04 1boc h LEU 6 CO 0.00 0.29 -0.10 1.17 -0.62 0.00 0.00 178.44 179.19 1boc n LYS 7 N -4.97 0.45 0.02 1.25 4.81 -1.26 -3.36 118.16 115.10 1boc n LYS 7 Ca -0.08 -0.11 -0.21 0.00 -0.87 0.00 0.00 58.31 57.05 1boc n LYS 7 Cb 0.26 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.67 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 4.98 0.28 0.68 3.14 0.00 -1.67 -3.21 103.07 107.27 1boc h GLY 8 Ca 0.00 -0.72 -0.00 0.00 0.00 0.00 0.00 47.33 46.60 1boc h GLY 8 CO 0.00 0.63 -0.01 1.19 0.00 0.00 0.00 176.54 178.35 1boc h ILE 9 N -0.39 1.21 0.00 2.60 6.09 -1.38 -2.52 117.51 123.12 1boc h ILE 9 Ca -0.23 -0.74 0.00 0.00 -1.37 0.00 0.00 64.86 62.52 1boc h ILE 9 Cb 1.66 1.71 0.00 0.00 0.47 0.00 0.00 36.82 40.66 1boc h ILE 9 CO 0.08 0.19 0.00 0.49 -3.07 0.00 0.00 178.15 175.84 1boc n PHE 10 N -4.95 0.00 0.29 2.19 3.01 -1.21 -0.16 117.46 116.62 1boc n PHE 10 Ca -0.08 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.42 1boc n PHE 10 Cb 0.18 -0.05 0.24 0.00 -0.01 0.00 0.00 39.48 39.84 1boc n PHE 10 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 1boc h GLU 11 N 0.00 0.00 0.00 -1.08 -0.00 -1.31 1.09 114.58 113.28 1boc h GLU 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1boc h GLU 11 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1boc h GLU 11 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 179.01 180.18 1boc n LYS 12 N -2.42 0.00 0.09 1.06 4.81 -0.13 -3.79 118.16 117.79 1boc n LYS 12 Ca -0.01 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.28 1boc n LYS 12 Cb 0.74 -0.30 -0.11 0.00 0.02 0.00 0.00 35.03 35.38 1boc n LYS 12 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1boc h TYR 13 N 0.00 0.56 0.00 5.64 -1.99 -0.30 -2.98 116.97 117.90 1boc h TYR 13 Ca 0.00 -0.37 -0.00 0.00 2.00 0.00 0.00 58.73 60.36 1boc h TYR 13 Cb 0.00 -0.04 -0.00 0.00 2.00 0.00 0.00 36.73 38.69 1boc h TYR 13 CO 0.00 1.25 -0.02 0.00 -0.00 0.00 0.00 178.16 179.38 1boc h ALA 14 N 0.62 1.08 0.00 3.88 0.00 0.13 -0.73 119.26 124.24 1boc h ALA 14 Ca -0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1boc h ALA 14 Cb 1.84 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 1boc h ALA 14 CO 0.19 0.03 -0.27 0.22 0.00 0.00 0.00 179.25 179.42 1boc h ASP 15 N 0.00 0.00 0.00 0.00 3.58 -1.05 -3.19 116.42 115.75 1boc h ASP 15 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1boc h ASP 15 Cb 0.22 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.27 1boc h ASP 15 CO 0.00 0.27 0.20 0.50 -2.88 0.00 0.00 179.24 177.34 1boc h LYS 16 N 0.00 0.00 -4.35 0.28 1.63 -1.12 -3.36 116.57 109.64 1boc h LYS 16 Ca -0.00 0.00 -0.60 0.00 -0.85 0.00 0.00 60.65 59.20 1boc h LYS 16 Cb 1.15 0.00 -0.38 0.00 -0.60 0.00 0.00 32.23 32.40 1boc h LYS 16 CO 0.04 0.00 -0.79 -1.21 -3.45 0.00 0.00 179.45 174.03 1boc s GLU 17 N -4.05 1.67 4.80 1.90 2.02 -1.21 -5.01 118.70 118.83 1boc s GLU 17 Ca -0.04 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.11 1boc s GLU 17 Cb 0.10 -2.42 0.00 0.00 0.10 0.00 0.00 34.13 31.90 1boc s GLU 17 CO 0.31 -0.52 0.00 0.41 0.02 0.00 0.00 175.26 175.48 1boc n GLY 18 N 4.72 0.86 1.37 -1.39 0.00 -1.26 -4.59 105.19 104.91 1boc n GLY 18 Ca -0.13 0.53 -0.07 0.00 0.00 0.00 0.00 46.02 46.35 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 9.80 0.64 -1.04 1.61 2.03 -1.26 -4.91 116.55 123.42 1boc n ASP 19 Ca 0.00 -1.49 0.08 0.00 0.52 0.00 0.00 54.79 53.90 1boc n ASP 19 Cb 0.00 -0.18 0.27 0.00 -0.72 0.00 0.00 41.12 40.49 1boc n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1boc n GLY 20 N 2.43 3.58 0.69 0.27 0.00 -1.24 -2.89 105.19 108.03 1boc n GLY 20 Ca 0.06 -0.90 0.09 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.05 2.43 -3.92 1.61 5.03 -1.26 -1.65 115.26 117.45 1boc n ASN 21 Ca 0.21 -1.71 -0.10 0.00 0.87 0.00 0.00 54.58 53.84 1boc n ASN 21 Cb 0.85 0.01 -0.11 0.00 -1.02 0.00 0.00 39.78 39.51 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 -1.45 0.31 0.23 3.52 1.11 -1.26 -3.15 119.66 118.97 1boc s GLN 22 Ca 0.20 -0.39 0.01 0.00 0.01 0.00 0.00 55.36 55.19 1boc s GLN 22 Cb 0.14 0.12 0.01 0.00 -1.01 0.00 0.00 33.01 32.27 1boc s GLN 22 CO 0.22 -0.06 0.05 1.28 0.01 0.00 0.00 175.29 176.79 1boc n LEU 23 N 1.88 0.00 0.00 2.90 4.77 -1.25 -4.40 117.00 120.90 1boc n LEU 23 Ca -0.21 -1.35 -0.07 0.00 -0.03 0.00 0.00 56.01 54.35 1boc n LEU 23 Cb 0.56 0.11 -0.00 0.00 -2.33 0.00 0.00 43.42 41.76 1boc n LEU 23 CO 0.21 -0.25 0.21 -1.20 -1.33 0.00 0.00 177.39 175.03 1boc n SER 24 N -1.36 -1.12 0.17 -1.43 7.64 -1.25 -1.09 113.62 115.17 1boc n SER 24 Ca -0.07 -2.08 0.05 0.00 1.01 0.00 0.00 58.87 57.78 1boc n SER 24 Cb 0.28 1.95 0.14 0.00 -1.01 0.00 0.00 64.21 65.57 1boc n SER 24 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1boc h LYS 25 N 0.00 0.00 -0.00 1.43 3.64 -1.95 -2.81 116.57 116.88 1boc h LYS 25 Ca -0.19 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1boc h LYS 25 Cb 0.75 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1boc h LYS 25 CO 0.24 0.40 -0.00 -1.91 -2.27 0.00 0.00 179.45 175.91 1boc n GLU 26 N -3.27 0.54 0.00 1.90 0.00 -1.26 -3.30 120.64 115.25 1boc n GLU 26 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1boc n GLU 26 Cb 0.64 -1.50 -0.00 0.00 0.00 0.00 0.00 31.44 30.58 1boc n GLU 26 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1boc n GLU 27 N -1.23 3.88 -0.00 5.31 4.71 -1.14 -4.34 120.64 127.83 1boc n GLU 27 Ca 0.16 -0.20 -0.20 0.00 -0.01 0.00 0.00 57.16 56.91 1boc n GLU 27 Cb 0.22 -0.71 -0.14 0.00 -1.01 0.00 0.00 31.44 29.80 1boc n GLU 27 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1boc n LEU 28 N -0.61 2.42 -0.11 -4.62 7.94 -1.07 -3.72 117.00 117.23 1boc n LEU 28 Ca 0.00 0.23 -0.06 0.00 -1.11 0.00 0.00 56.01 55.07 1boc n LEU 28 Cb 0.01 -0.95 0.02 0.00 0.53 0.00 0.00 43.42 43.03 1boc n LEU 28 CO 0.01 0.80 0.94 0.50 -1.11 0.00 0.00 177.39 178.52 1boc h LYS 29 N 0.06 0.27 -0.24 1.96 3.64 -1.80 0.12 116.57 120.58 1boc h LYS 29 Ca -0.41 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.02 1boc h LYS 29 Cb 2.03 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.78 1boc h LYS 29 CO 0.08 0.18 0.28 -0.07 -2.27 0.00 0.00 179.45 177.65 1boc h LEU 30 N 0.28 0.00 0.68 5.20 4.07 -1.76 -1.14 115.31 122.65 1boc h LEU 30 Ca 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 1boc h LEU 30 Cb 0.15 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.89 1boc h LEU 30 CO -0.17 0.00 -0.33 0.25 -1.08 0.00 0.00 178.44 177.11 1boc h LEU 31 N 0.00 -0.78 -0.10 1.67 6.46 -0.84 0.56 115.31 122.28 1boc h LEU 31 Ca 0.11 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.92 1boc h LEU 31 Cb 0.67 0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 40.75 1boc h LEU 31 CO -0.00 -0.53 -0.39 -0.07 -0.62 0.00 0.00 178.44 176.83 1boc h LEU 32 N -0.98 -1.23 -1.87 2.25 4.07 -1.13 0.83 115.31 117.26 1boc h LEU 32 Ca -0.09 0.15 0.37 0.00 0.08 0.00 0.00 57.88 58.38 1boc h LEU 32 Cb 0.71 0.48 -0.06 0.00 1.08 0.00 0.00 40.66 42.86 1boc h LEU 32 CO 0.15 -0.34 0.90 1.56 -1.08 0.00 0.00 178.44 179.63 1boc h GLN 33 N -0.41 0.06 0.04 1.13 4.20 -1.26 3.65 115.11 122.51 1boc h GLN 33 Ca 0.02 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1boc h GLN 33 Cb 0.48 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1boc h GLN 33 CO -0.31 0.04 -0.02 1.79 -0.67 0.00 0.00 178.83 179.66 1boc h THR 34 N 0.06 0.36 0.00 -0.54 1.35 0.14 -3.38 112.91 110.90 1boc h THR 34 Ca 0.63 -1.22 -0.30 0.00 -0.55 0.00 0.00 66.41 64.97 1boc h THR 34 Cb 2.38 0.68 -0.04 0.00 -1.73 0.00 0.00 68.15 69.43 1boc h THR 34 CO -0.07 0.12 -1.65 -0.62 -0.25 0.00 0.00 175.52 173.05 1boc n GLU 35 N -4.78 0.57 -3.28 4.72 1.02 -0.31 -4.83 120.64 113.75 1boc n GLU 35 Ca -0.03 0.48 -0.24 0.00 -0.02 0.00 0.00 57.16 57.36 1boc n GLU 35 Cb 0.11 -1.67 -0.08 0.00 -0.02 0.00 0.00 31.44 29.78 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 -4.37 -1.12 -0.12 -0.32 3.01 1.04 -4.96 117.46 110.62 1boc n PHE 36 Ca -0.39 -3.16 0.20 0.00 1.01 0.00 0.00 57.45 55.11 1boc n PHE 36 Cb 0.75 0.27 0.62 0.00 -0.01 0.00 0.00 39.48 41.11 1boc n PHE 36 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1boc h PRO 37 N 5.21 0.18 -0.49 -1.08 0.11 0.35 -0.17 132.00 136.10 1boc h PRO 37 Ca 0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1boc h PRO 37 Cb 0.92 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1boc h PRO 37 CO 0.36 0.12 0.00 -1.13 -0.21 0.00 0.00 178.00 177.13 1boc n SER 38 N -4.40 0.60 -0.02 -2.05 3.41 -1.26 -3.49 113.62 106.40 1boc n SER 38 Ca 0.14 -2.01 0.12 0.00 -0.26 0.00 0.00 58.87 56.86 1boc n SER 38 Cb 0.67 -0.25 0.71 0.00 -0.26 0.00 0.00 64.21 65.08 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 -0.22 0.07 -3.07 1.04 4.77 -0.08 -3.80 117.00 115.72 1boc n LEU 39 Ca 0.01 -0.03 -0.23 0.00 -0.03 0.00 0.00 56.01 55.73 1boc n LEU 39 Cb 0.14 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 1boc n LEU 39 CO 0.01 0.01 -0.03 0.00 -1.33 0.00 0.00 177.39 176.05 1boc n LEU 40 N -0.83 2.80 0.00 2.23 -0.00 -1.23 -2.04 117.00 117.93 1boc n LEU 40 Ca 0.18 -5.37 0.00 0.00 -0.00 0.00 0.00 56.01 50.83 1boc n LEU 40 Cb 0.09 0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.52 1boc n LEU 40 CO 0.14 2.31 0.14 0.29 -0.00 0.00 0.00 177.39 180.27 1boc n LYS 41 N 0.06 0.00 0.00 1.47 4.76 -1.25 -4.76 118.16 118.45 1boc n LYS 41 Ca 0.28 0.34 0.00 0.00 -2.87 0.00 0.00 58.31 56.06 1boc n LYS 41 Cb 0.51 -1.00 0.00 0.00 -1.84 0.00 0.00 35.03 32.70 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 1.17 0.00 0.00 0.72 0.00 -1.26 -4.96 105.19 100.85 1boc n GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.18 0.00 0.00 1.61 2.81 -1.26 -4.81 117.12 115.29 1boc n MET 43 Ca 0.00 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.93 1boc n MET 43 Cb 0.00 -0.40 0.20 0.00 -0.71 0.00 0.00 33.22 32.32 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 -1.09 0.00 -4.41 7.83 3.41 -1.26 -4.78 113.62 113.32 1boc n SER 44 Ca 0.00 0.29 -0.32 0.00 -0.26 0.00 0.00 58.87 58.58 1boc n SER 44 Cb 0.00 -0.37 0.15 0.00 -0.26 0.00 0.00 64.21 63.73 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 -1.37 0.00 0.86 6.66 5.66 -0.87 -4.62 114.28 120.60 1boc n THR 45 Ca 0.03 -0.22 0.10 0.00 -3.05 0.00 0.00 64.05 60.91 1boc n THR 45 Cb 0.08 -0.69 0.06 0.00 -1.55 0.00 0.00 70.33 68.24 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 -2.02 2.47 0.32 1.09 4.32 -1.26 -4.32 117.00 117.61 1boc n LEU 46 Ca 0.05 -0.94 -0.18 0.00 -0.02 0.00 0.00 56.01 54.92 1boc n LEU 46 Cb 0.56 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.26 1boc n LEU 46 CO 0.51 0.43 0.53 0.44 -1.22 0.00 0.00 177.39 178.08 1boc h ASP 47 N 3.51 -1.34 0.79 -1.43 5.19 -1.94 1.07 116.42 122.27 1boc h ASP 47 Ca 0.00 0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.48 1boc h ASP 47 Cb 0.80 0.43 -0.00 0.00 0.18 0.00 0.00 39.33 40.74 1boc h ASP 47 CO 0.00 -0.68 -0.13 1.05 -3.12 0.00 0.00 179.24 176.36 1boc h GLU 48 N -1.04 0.00 0.00 3.56 4.11 -1.94 -0.26 114.58 119.00 1boc h GLU 48 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.36 1boc h GLU 48 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1boc h GLU 48 CO -0.02 0.13 0.00 1.25 0.07 0.00 0.00 179.01 180.44 1boc h LEU 49 N 0.00 0.00 0.08 3.06 6.46 -1.40 -0.17 115.31 123.34 1boc h LEU 49 Ca -0.00 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.65 1boc h LEU 49 Cb 0.56 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.50 1boc h LEU 49 CO 0.02 0.00 -0.49 0.15 -0.62 0.00 0.00 178.44 177.50 1boc h PHE 50 N 0.00 0.31 0.00 1.25 3.57 0.30 -3.05 116.94 119.32 1boc h PHE 50 Ca 0.00 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1boc h PHE 50 Cb 0.62 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.35 1boc h PHE 50 CO 0.00 1.19 -0.06 1.49 -2.23 0.00 0.00 178.31 178.70 1boc h GLU 51 N -0.64 0.00 -0.01 1.11 4.81 -1.45 -3.22 114.58 115.18 1boc h GLU 51 Ca -0.09 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.94 1boc h GLU 51 Cb 1.37 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.75 1boc h GLU 51 CO 0.08 0.00 -0.87 0.93 -0.73 0.00 0.00 179.01 178.42 1boc h GLU 52 N 0.00 0.25 0.00 1.92 4.39 -1.10 -3.39 114.58 116.65 1boc h GLU 52 Ca 0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1boc h GLU 52 Cb 0.91 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1boc h GLU 52 CO 0.00 0.97 0.00 1.28 -1.16 0.00 0.00 179.01 180.10 1boc n LEU 53 N -3.70 0.00 -4.49 1.33 4.77 -1.15 -4.87 117.00 108.90 1boc n LEU 53 Ca -0.04 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.71 1boc n LEU 53 Cb 0.80 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.78 1boc n LEU 53 CO 0.48 0.00 -0.30 -0.62 -1.33 0.00 0.00 177.39 175.62 1boc s ASP 54 N -2.64 2.86 0.74 -1.43 2.15 -1.26 -5.10 116.67 111.98 1boc s ASP 54 Ca 0.00 -1.32 -0.17 0.00 0.43 0.00 0.00 52.55 51.49 1boc s ASP 54 Cb 0.00 -0.19 -0.10 0.00 -0.30 0.00 0.00 42.92 42.33 1boc s ASP 54 CO 0.00 -0.49 -0.06 2.29 -0.17 0.00 0.00 175.17 176.73 1boc n LYS 55 N -0.73 0.09 0.00 4.34 0.00 -1.26 -4.83 118.16 115.77 1boc n LYS 55 Ca -0.04 0.05 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1boc n LYS 55 Cb 0.66 -1.32 0.00 0.00 -0.00 0.00 0.00 35.03 34.36 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 1.64 0.00 -0.15 -5.58 5.15 -1.26 -4.96 115.26 110.10 1boc n ASN 56 Ca 0.06 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 54.03 1boc n ASN 56 Cb 0.51 0.12 -0.00 0.00 -0.53 0.00 0.00 39.78 39.87 1boc n ASN 56 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1boc n GLY 57 N -0.34 0.10 0.00 8.20 0.00 -1.26 -4.47 105.19 107.42 1boc n GLY 57 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1boc n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1boc n ASP 58 N 1.02 0.97 -0.72 1.61 -0.08 -1.26 -4.97 116.55 113.12 1boc n ASP 58 Ca -0.01 -1.35 -0.09 0.00 -1.51 0.00 0.00 54.79 51.83 1boc n ASP 58 Cb 0.24 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.66 1boc n ASP 58 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1boc n GLY 59 N -0.17 0.87 3.18 0.27 0.00 -1.26 -4.93 105.19 103.15 1boc n GLY 59 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.73 0.93 0.00 1.61 2.12 -1.26 -3.09 118.70 116.29 1boc s GLU 60 Ca 0.00 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.42 1boc s GLU 60 Cb 0.00 -0.98 0.00 0.00 0.26 0.00 0.00 34.13 33.41 1boc s GLU 60 CO 0.00 0.23 0.00 1.55 -0.54 0.00 0.00 175.26 176.50 1boc n VAL 61 N 1.49 0.00 -3.86 3.70 3.14 -0.25 -4.82 118.33 117.74 1boc n VAL 61 Ca -0.20 0.00 -0.07 0.00 -2.96 0.00 0.00 64.34 61.11 1boc n VAL 61 Cb 0.54 0.00 -0.02 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 -0.26 0.07 6.55 1.04 -1.26 -3.90 113.70 116.94 1boc s SER 62 Ca 0.00 -0.61 0.10 0.00 0.48 0.00 0.00 55.95 55.92 1boc s SER 62 Cb 0.00 0.73 0.45 0.00 0.10 0.00 0.00 66.02 67.29 1boc s SER 62 CO 0.00 -1.35 1.30 0.33 0.98 0.00 0.00 173.24 174.50 1boc n PHE 63 N -0.46 0.19 0.11 5.02 7.35 -1.19 -1.49 117.46 126.99 1boc n PHE 63 Ca -0.04 0.09 -0.23 0.00 -0.76 0.00 0.00 57.45 56.51 1boc n PHE 63 Cb 0.59 -0.64 -0.15 0.00 0.35 0.00 0.00 39.48 39.63 1boc n PHE 63 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 1boc h GLU 64 N 0.00 0.52 -0.70 -4.13 4.57 -1.94 -3.27 114.58 109.63 1boc h GLU 64 Ca 0.00 -0.80 0.00 0.00 -1.18 0.00 0.00 59.36 57.38 1boc h GLU 64 Cb 0.11 0.29 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1boc h GLU 64 CO 0.00 1.37 0.00 0.39 -1.18 0.00 0.00 179.01 179.59 1boc n GLU 65 N -3.85 2.95 -0.24 1.92 1.02 -0.92 -4.04 120.64 117.49 1boc n GLU 65 Ca -0.15 -2.69 0.10 0.00 -0.02 0.00 0.00 57.16 54.40 1boc n GLU 65 Cb 1.00 -1.63 0.22 0.00 -0.02 0.00 0.00 31.44 31.01 1boc n GLU 65 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1boc n PHE 66 N 1.48 0.62 -0.06 -0.32 7.35 -0.55 -4.55 117.46 121.43 1boc n PHE 66 Ca 0.24 -0.38 -0.05 0.00 -0.76 0.00 0.00 57.45 56.50 1boc n PHE 66 Cb 0.67 -0.01 -0.03 0.00 0.35 0.00 0.00 39.48 40.46 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 3.66 0.00 -0.12 -4.13 1.08 -1.70 -1.03 115.11 112.87 1boc h GLN 67 Ca 0.00 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 1boc h GLN 67 Cb 0.89 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1boc h GLN 67 CO 0.00 0.25 0.33 0.28 -0.95 0.00 0.00 178.83 178.74 1boc h VAL 68 N -1.00 0.13 0.00 -0.54 2.07 -1.86 0.21 116.25 115.26 1boc h VAL 68 Ca -0.03 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.19 1boc h VAL 68 Cb 0.41 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1boc h VAL 68 CO -0.02 0.00 -2.13 -0.11 0.02 0.00 0.00 177.57 175.33 1boc n LEU 69 N -3.18 1.53 0.13 2.57 -0.00 -1.25 -4.22 117.00 112.57 1boc n LEU 69 Ca 0.01 -0.06 0.11 0.00 -0.00 0.00 0.00 56.01 56.07 1boc n LEU 69 Cb 0.42 -0.17 0.49 0.00 -0.00 0.00 0.00 43.42 44.16 1boc n LEU 69 CO 0.18 0.62 0.84 0.55 -0.00 0.00 0.00 177.39 179.59 1boc n VAL 70 N -2.85 0.88 -0.37 1.96 3.14 -0.39 -0.23 118.33 120.47 1boc n VAL 70 Ca -0.31 0.31 -0.05 0.00 -2.96 0.00 0.00 64.34 61.33 1boc n VAL 70 Cb 0.95 -1.25 0.20 0.00 -1.06 0.00 0.00 33.84 32.68 1boc n VAL 70 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 1boc n LYS 71 N -2.20 2.81 -0.06 1.45 2.85 -0.03 -3.53 118.16 119.45 1boc n LYS 71 Ca 0.02 -2.07 0.02 0.00 -1.05 0.00 0.00 58.31 55.22 1boc n LYS 71 Cb 0.19 -1.91 0.05 0.00 -0.65 0.00 0.00 35.03 32.71 1boc n LYS 71 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1boc n LYS 72 N -0.05 2.72 -0.13 -1.58 4.76 0.68 -4.28 118.16 120.28 1boc n LYS 72 Ca 0.29 -1.63 -0.25 0.00 -2.87 0.00 0.00 58.31 53.85 1boc n LYS 72 Cb 1.07 -1.09 -0.11 0.00 -1.84 0.00 0.00 35.03 33.06 1boc n LYS 72 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1boc n ILE 73 N -0.12 1.52 0.00 -0.18 2.08 -1.23 -4.74 119.36 116.69 1boc n ILE 73 Ca 0.04 -0.45 0.00 0.00 0.56 0.00 0.00 62.75 62.90 1boc n ILE 73 Cb 0.30 -1.71 0.00 0.00 -0.75 0.00 0.00 39.64 37.48 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 -3.88 0.00 -0.32 4.38 2.88 -1.26 -4.94 113.62 110.48 1boc n SER 74 Ca -0.51 0.64 0.04 0.00 -1.33 0.00 0.00 58.87 57.71 1boc n SER 74 Cb 0.92 -0.25 0.03 0.00 -0.75 0.00 0.00 64.21 64.17 1boc n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81