#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ami s VAL 2 N 0.00 4.27 0.00 8.89 -7.23 -1.26 -4.97 120.40 120.11 2ami s VAL 2 Ca 0.00 1.63 0.00 0.00 -1.81 0.00 0.00 61.98 61.80 2ami s VAL 2 Cb 0.00 -4.04 0.00 0.00 0.56 0.00 0.00 36.38 32.90 2ami s VAL 2 CO 0.00 0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2ami n GLY 3 N 3.16 3.40 2.94 2.32 0.00 -1.26 -5.10 105.19 110.64 2ami n GLY 3 Ca 0.08 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 2ami n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ami s LEU 4 N 0.00 4.18 0.80 0.99 1.43 -1.26 -5.07 118.68 119.74 2ami s LEU 4 Ca 0.00 -2.57 -0.12 0.00 -1.03 0.00 0.00 54.13 50.42 2ami s LEU 4 Cb 0.00 -1.52 0.08 0.00 0.03 0.00 0.00 46.19 44.78 2ami s LEU 4 CO 0.00 -0.30 1.13 -0.89 0.23 0.00 0.00 176.35 176.52 2ami s THR 5 N 0.34 2.70 0.28 5.49 2.01 -1.26 -4.67 115.64 120.53 2ami s THR 5 Ca 0.14 0.26 -0.00 0.00 0.31 0.00 0.00 61.69 62.40 2ami s THR 5 Cb -0.23 -2.60 0.31 0.00 0.01 0.00 0.00 72.50 69.99 2ami s THR 5 CO -0.05 -0.27 1.64 -0.33 -0.69 0.00 0.00 174.62 174.92 2ami h GLU 6 N -1.11 0.16 -0.41 4.92 5.08 -1.99 0.20 114.58 121.43 2ami h GLU 6 Ca -0.44 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 57.96 2ami h GLU 6 Cb 1.26 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 2ami h GLU 6 CO 0.48 0.11 0.13 0.93 -1.00 0.00 0.00 179.01 179.65 2ami h GLU 7 N 0.16 0.27 -0.53 2.33 3.07 -1.99 0.20 114.58 118.09 2ami h GLU 7 Ca 0.52 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.35 2ami h GLU 7 Cb 1.01 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.84 2ami h GLU 7 CO -0.68 0.18 0.27 1.96 -1.40 0.00 0.00 179.01 179.35 2ami h GLN 8 N 0.28 0.75 -0.61 2.33 4.20 -1.03 0.06 115.11 121.10 2ami h GLN 8 Ca 0.19 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 58.82 2ami h GLN 8 Cb 0.19 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 2ami h GLN 8 CO -0.21 0.60 0.39 0.87 -0.67 0.00 0.00 178.83 179.81 2ami h LYS 9 N 0.71 0.75 0.06 1.46 1.57 -0.19 0.11 116.57 121.04 2ami h LYS 9 Ca 0.19 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2ami h LYS 9 Cb 0.08 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2ami h LYS 9 CO -0.03 0.50 -0.11 1.96 -0.57 0.00 0.00 179.45 181.20 2ami h GLN 10 N 0.78 -0.21 -0.34 3.15 4.20 -0.26 0.66 115.11 123.08 2ami h GLN 10 Ca 0.24 0.01 0.07 0.00 0.06 0.00 0.00 58.65 59.03 2ami h GLN 10 Cb -0.03 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.73 2ami h GLN 10 CO -0.08 -0.14 -0.10 0.93 -0.67 0.00 0.00 178.83 178.77 2ami h GLU 11 N -0.22 -0.02 -0.52 1.46 5.08 -0.48 0.92 114.58 120.79 2ami h GLU 11 Ca 0.02 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 2ami h GLU 11 Cb 0.24 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 2ami h GLU 11 CO -0.07 -0.01 0.22 0.82 -1.00 0.00 0.00 179.01 178.96 2ami h ILE 12 N -0.02 0.87 -0.08 3.13 2.04 -0.52 0.93 117.51 123.86 2ami h ILE 12 Ca 0.16 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 2ami h ILE 12 Cb 0.27 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2ami h ILE 12 CO -0.36 0.08 0.04 -0.09 0.00 0.00 0.00 178.15 177.82 2ami h ARG 13 N 0.42 0.11 -0.03 2.37 1.12 -0.01 0.16 114.38 118.52 2ami h ARG 13 Ca 0.25 -0.01 0.03 0.00 -1.11 0.00 0.00 59.98 59.13 2ami h ARG 13 Cb 0.23 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.14 2ami h ARG 13 CO -0.22 0.13 -0.16 0.93 -3.11 0.00 0.00 179.97 177.54 2ami h GLU 14 N 0.05 -0.24 -0.40 0.20 4.39 -0.47 -0.34 114.58 117.78 2ami h GLU 14 Ca 0.03 0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.80 2ami h GLU 14 Cb 0.05 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.70 2ami h GLU 14 CO -0.00 -0.16 0.09 0.00 -1.16 0.00 0.00 179.01 177.78 2ami h ALA 15 N 0.71 0.44 0.00 3.43 0.00 -0.67 0.15 119.26 123.33 2ami h ALA 15 Ca 0.06 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2ami h ALA 15 Cb 0.33 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2ami h ALA 15 CO -0.17 -0.31 -0.33 0.35 0.00 0.00 0.00 179.25 178.79 2ami h PHE 16 N 0.23 -0.91 -0.20 0.00 3.57 -0.32 0.10 116.94 119.40 2ami h PHE 16 Ca 0.19 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.76 2ami h PHE 16 Cb 0.22 0.40 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 2ami h PHE 16 CO -0.19 -0.42 -0.07 -0.44 -2.23 0.00 0.00 178.31 174.96 2ami h ASP 17 N -0.48 -0.23 0.07 0.41 3.32 -0.57 0.11 116.42 119.04 2ami h ASP 17 Ca 0.06 0.07 0.02 0.00 0.02 0.00 0.00 57.03 57.20 2ami h ASP 17 Cb 0.57 0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 2ami h ASP 17 CO -0.27 -0.09 -0.21 0.25 -1.72 0.00 0.00 179.24 177.20 2ami h LEU 18 N -0.03 -0.61 -1.32 1.55 6.46 -0.65 -2.53 115.31 118.19 2ami h LEU 18 Ca 0.10 0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2ami h LEU 18 Cb 0.18 0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 2ami h LEU 18 CO -0.22 -0.29 0.46 -0.26 -0.62 0.00 0.00 178.44 177.51 2ami h PHE 19 N -0.38 0.87 0.00 1.25 0.04 -0.37 -2.66 116.94 115.69 2ami h PHE 19 Ca 0.04 0.02 -0.48 0.00 2.80 0.00 0.00 57.97 60.35 2ami h PHE 19 Cb 0.42 -0.29 0.02 0.00 2.20 0.00 0.00 35.95 38.30 2ami h PHE 19 CO -0.22 0.54 2.95 -3.47 -0.60 0.00 0.00 178.31 177.51 2ami n ASP 20 N -4.43 5.81 -0.27 2.17 2.03 0.33 -4.64 116.55 117.55 2ami n ASP 20 Ca 0.07 -2.42 0.12 0.00 0.52 0.00 0.00 54.79 53.09 2ami n ASP 20 Cb 0.04 -1.24 0.38 0.00 -0.72 0.00 0.00 41.12 39.59 2ami n ASP 20 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2ami h THR 21 N 3.39 0.82 0.00 5.18 1.35 -1.60 0.11 112.91 122.16 2ami h THR 21 Ca 0.60 -0.23 -0.02 0.00 -0.55 0.00 0.00 66.41 66.21 2ami h THR 21 Cb 0.23 0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 66.73 2ami h THR 21 CO 1.58 0.12 -0.08 -0.78 -0.25 0.00 0.00 175.52 176.11 2ami h ASP 22 N 0.68 0.00 -2.53 5.36 3.58 -1.90 -3.46 116.42 118.15 2ami h ASP 22 Ca 0.46 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.60 2ami h ASP 22 Cb 0.76 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.81 2ami h ASP 22 CO -0.21 0.08 -0.41 0.61 -2.88 0.00 0.00 179.24 176.43 2ami n GLY 23 N -0.57 -0.24 0.25 -0.78 0.00 0.38 -4.91 105.19 99.31 2ami n GLY 23 Ca -0.01 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.92 2ami n GLY 23 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ami h SER 24 N -0.29 0.00 0.00 1.61 4.64 -1.91 -3.46 113.55 114.14 2ami h SER 24 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2ami h SER 24 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2ami h SER 24 CO 0.43 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.15 2ami n GLY 25 N -0.34 1.61 2.96 -0.77 0.00 -1.26 -5.03 105.19 102.35 2ami n GLY 25 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 2ami n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ami s THR 26 N -2.43 0.24 -0.31 2.61 -4.23 -1.26 -4.41 115.64 105.85 2ami s THR 26 Ca 0.00 -0.54 -0.28 0.00 -1.18 0.00 0.00 61.69 59.69 2ami s THR 26 Cb 0.00 -0.28 0.01 0.00 1.34 0.00 0.00 72.50 73.57 2ami s THR 26 CO 0.00 -0.20 1.04 -0.63 -0.54 0.00 0.00 174.62 174.29 2ami s ILE 27 N -0.74 4.56 0.52 2.99 1.01 0.26 -4.78 121.20 125.03 2ami s ILE 27 Ca -0.06 1.70 -0.21 0.00 0.00 0.00 0.00 60.65 62.07 2ami s ILE 27 Cb -0.05 -4.38 -0.06 0.00 0.01 0.00 0.00 42.46 37.98 2ami s ILE 27 CO -0.00 -0.43 1.23 -0.62 0.00 0.00 0.00 174.94 175.12 2ami s ASP 28 N 1.61 5.65 0.29 3.58 -1.08 -1.26 -0.08 116.67 125.37 2ami s ASP 28 Ca 0.44 2.45 0.01 0.00 -0.52 0.00 0.00 52.55 54.94 2ami s ASP 28 Cb -0.13 -2.61 0.70 0.00 -1.46 0.00 0.00 42.92 39.43 2ami s ASP 28 CO 0.14 -1.29 1.47 0.00 0.52 0.00 0.00 175.17 176.01 2ami n ALA 29 N -0.95 0.47 -0.11 3.66 0.00 -0.35 -0.08 120.51 123.14 2ami n ALA 29 Ca 0.10 1.01 -0.08 0.00 0.00 0.00 0.00 53.44 54.46 2ami n ALA 29 Cb 0.48 -0.73 -0.01 0.00 0.00 0.00 0.00 19.45 19.19 2ami n ALA 29 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2ami h LYS 30 N 0.00 0.48 -0.81 0.00 1.57 -1.91 0.91 116.57 116.81 2ami h LYS 30 Ca 0.56 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 59.30 2ami h LYS 30 Cb 1.15 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.31 2ami h LYS 30 CO -0.89 0.32 0.44 0.93 -0.57 0.00 0.00 179.45 179.68 2ami h GLU 31 N 0.49 1.12 -0.54 3.15 5.08 -0.83 0.06 114.58 123.11 2ami h GLU 31 Ca 0.13 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2ami h GLU 31 Cb -0.06 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 28.95 2ami h GLU 31 CO -0.03 0.82 0.24 1.25 -1.00 0.00 0.00 179.01 180.29 2ami h LEU 32 N 1.13 0.73 -0.26 1.33 5.85 -0.21 0.15 115.31 124.03 2ami h LEU 32 Ca 0.28 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.89 2ami h LEU 32 Cb 0.03 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2ami h LEU 32 CO -0.05 0.68 0.05 0.50 -0.34 0.00 0.00 178.44 179.28 2ami h LYS 33 N 0.73 0.14 -0.40 1.25 3.11 -0.24 0.13 116.57 121.30 2ami h LYS 33 Ca 0.18 -0.01 0.06 0.00 -2.81 0.00 0.00 60.65 58.08 2ami h LYS 33 Cb 0.16 -0.03 -0.05 0.00 -1.00 0.00 0.00 32.23 31.30 2ami h LYS 33 CO -0.02 0.09 0.08 0.28 -2.81 0.00 0.00 179.45 177.07 2ami h VAL 34 N 0.15 0.79 -0.37 2.00 2.07 -0.65 0.50 116.25 120.73 2ami h VAL 34 Ca 0.12 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.63 2ami h VAL 34 Cb 0.12 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.40 2ami h VAL 34 CO -0.16 0.04 0.01 0.00 0.02 0.00 0.00 177.57 177.48 2ami h ALA 35 N 1.30 0.35 -0.73 1.67 0.00 -0.09 0.12 119.26 121.88 2ami h ALA 35 Ca 0.19 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2ami h ALA 35 Cb 0.23 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2ami h ALA 35 CO -0.25 -0.39 0.38 0.52 0.00 0.00 0.00 179.25 179.51 2ami h MET 36 N 0.11 1.02 -0.63 0.00 2.86 -0.15 0.21 114.93 118.35 2ami h MET 36 Ca 0.18 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2ami h MET 36 Cb 0.25 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.68 2ami h MET 36 CO -0.30 0.76 0.37 0.00 1.06 0.00 0.00 176.91 178.81 2ami h ARG 37 N 1.02 0.85 -0.78 1.72 2.47 -0.02 0.64 114.38 120.29 2ami h ARG 37 Ca 0.26 -0.08 0.03 0.00 -1.26 0.00 0.00 59.98 58.93 2ami h ARG 37 Cb 0.05 -0.18 -0.04 0.00 -1.65 0.00 0.00 29.97 28.15 2ami h ARG 37 CO -0.04 0.61 0.51 0.00 0.56 0.00 0.00 179.97 181.62 2ami h ALA 38 N 1.19 1.52 0.00 0.04 0.00 0.60 0.14 119.26 122.74 2ami h ALA 38 Ca 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2ami h ALA 38 Cb -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2ami h ALA 38 CO -0.04 0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.90 2ami n LEU 39 N -4.44 0.00 -0.32 0.00 4.77 0.59 -4.88 117.00 112.71 2ami n LEU 39 Ca 0.10 0.03 -0.04 0.00 -0.03 0.00 0.00 56.01 56.07 2ami n LEU 39 Cb 0.10 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2ami n LEU 39 CO 0.35 -0.01 -0.04 0.61 -1.33 0.00 0.00 177.39 176.97 2ami n GLY 40 N 0.25 0.48 3.89 -0.72 0.00 0.49 -5.04 105.19 104.55 2ami n GLY 40 Ca 0.14 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 2ami n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ami s PHE 41 N -2.15 3.22 -0.52 1.61 0.40 0.14 -4.99 117.98 115.69 2ami s PHE 41 Ca 0.00 0.97 0.00 0.00 -0.60 0.00 0.00 56.93 57.30 2ami s PHE 41 Cb 0.00 -3.18 0.14 0.00 0.51 0.00 0.00 43.02 40.48 2ami s PHE 41 CO 0.00 -1.34 0.29 -2.00 0.70 0.00 0.00 175.22 172.88 2ami s GLU 42 N -5.42 2.14 0.32 0.44 2.12 -1.26 -4.58 118.70 112.46 2ami s GLU 42 Ca 0.59 -2.38 -0.28 0.00 0.36 0.00 0.00 54.97 53.26 2ami s GLU 42 Cb -0.11 -3.50 -0.13 0.00 0.26 0.00 0.00 34.13 30.65 2ami s GLU 42 CO 0.51 -1.11 1.16 -2.30 -0.54 0.00 0.00 175.26 172.99 2ami n PRO 43 N 3.60 1.78 -3.76 4.30 -0.02 -1.26 -5.03 135.00 134.61 2ami n PRO 43 Ca 0.05 0.62 -0.23 0.00 -2.02 0.00 0.00 63.50 61.92 2ami n PRO 43 Cb 0.37 -2.11 -0.18 0.00 -0.02 0.00 0.00 33.50 31.56 2ami n PRO 43 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ami s LYS 44 N -1.74 0.54 0.18 -0.52 1.02 -1.26 -5.06 119.74 112.89 2ami s LYS 44 Ca 0.57 0.10 -0.28 0.00 0.02 0.00 0.00 55.97 56.38 2ami s LYS 44 Cb -0.63 -1.02 0.01 0.00 -0.52 0.00 0.00 37.83 35.67 2ami s LYS 44 CO 0.61 -0.33 1.54 1.57 -0.92 0.00 0.00 175.35 177.82 2ami h LYS 45 N 8.33 -0.02 0.12 1.68 2.10 -1.98 0.43 116.57 127.24 2ami h LYS 45 Ca -0.19 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.46 2ami h LYS 45 Cb 1.12 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.46 2ami h LYS 45 CO 0.26 -0.01 -0.07 1.05 -2.00 0.00 0.00 179.45 178.67 2ami h GLU 46 N -0.02 -0.18 -0.07 0.07 9.09 -1.98 0.85 114.58 122.34 2ami h GLU 46 Ca 0.20 0.01 0.02 0.00 0.05 0.00 0.00 59.36 59.65 2ami h GLU 46 Cb 0.46 0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 27.58 2ami h GLU 46 CO -0.94 -0.12 -0.06 0.93 0.05 0.00 0.00 179.01 178.87 2ami h GLU 47 N -0.19 -0.08 -0.02 1.06 5.08 -1.82 -0.13 114.58 118.48 2ami h GLU 47 Ca -0.01 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2ami h GLU 47 Cb 0.16 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 2ami h GLU 47 CO 0.01 -0.05 -0.27 0.82 -1.00 0.00 0.00 179.01 178.53 2ami h ILE 48 N -0.08 0.40 -0.15 3.13 1.08 -0.77 0.67 117.51 121.79 2ami h ILE 48 Ca 0.05 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.56 2ami h ILE 48 Cb 0.15 0.40 -0.04 0.00 -3.07 0.00 0.00 36.82 34.26 2ami h ILE 48 CO -0.12 0.00 -0.10 0.50 -0.69 0.00 0.00 178.15 177.74 2ami h LYS 49 N -0.40 -0.10 0.13 2.37 3.64 -0.54 0.11 116.57 121.78 2ami h LYS 49 Ca 0.07 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2ami h LYS 49 Cb 0.49 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2ami h LYS 49 CO -0.24 -0.06 -0.06 -0.22 -2.27 0.00 0.00 179.45 176.59 2ami h LYS 50 N -0.10 -0.17 -0.01 1.90 3.11 -0.72 0.12 116.57 120.70 2ami h LYS 50 Ca 0.09 0.01 0.03 0.00 -2.81 0.00 0.00 60.65 57.97 2ami h LYS 50 Cb 0.24 0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.46 2ami h LYS 50 CO -0.22 0.01 -0.21 1.98 -2.81 0.00 0.00 179.45 178.20 2ami h MET 51 N -0.31 -0.32 -0.50 1.90 4.05 -0.71 -0.02 114.93 119.03 2ami h MET 51 Ca -0.02 0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.52 2ami h MET 51 Cb 0.25 0.07 -0.09 0.00 -0.80 0.00 0.00 31.60 31.03 2ami h MET 51 CO 0.03 -0.21 -0.07 0.82 0.23 0.00 0.00 176.91 177.70 2ami h ILE 52 N -0.33 0.54 -0.56 1.77 2.04 -0.68 -0.99 117.51 119.29 2ami h ILE 52 Ca 0.06 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.93 2ami h ILE 52 Cb 0.42 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2ami h ILE 52 CO -0.21 0.01 0.34 0.77 0.00 0.00 0.00 178.15 179.06 2ami h SER 53 N 0.05 0.55 -0.28 1.72 4.64 0.40 0.43 113.55 121.07 2ami h SER 53 Ca 0.25 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.59 2ami h SER 53 Cb 0.38 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2ami h SER 53 CO -0.48 0.39 0.13 -0.33 -0.87 0.00 0.00 176.83 175.67 2ami h GLU 54 N 0.67 0.28 -0.13 4.77 5.08 -0.25 -2.73 114.58 122.27 2ami h GLU 54 Ca 0.23 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.42 2ami h GLU 54 Cb 0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2ami h GLU 54 CO -0.10 0.18 -0.58 0.82 -1.00 0.00 0.00 179.01 178.33 2ami h ILE 55 N 0.28 1.35 -0.20 3.13 1.08 -0.73 -3.37 117.51 119.06 2ami h ILE 55 Ca 0.11 -1.88 -0.71 0.00 -0.39 0.00 0.00 64.86 61.99 2ami h ILE 55 Cb 0.04 1.89 -0.05 0.00 -3.07 0.00 0.00 36.82 35.62 2ami h ILE 55 CO -0.08 0.57 2.97 -0.67 -0.69 0.00 0.00 178.15 180.25 2ami n ASP 56 N -3.92 4.05 -0.28 1.72 -0.08 0.15 -4.68 116.55 113.51 2ami n ASP 56 Ca -0.03 -2.87 -0.06 0.00 -1.51 0.00 0.00 54.79 50.32 2ami n ASP 56 Cb 0.61 -1.64 0.06 0.00 2.34 0.00 0.00 41.12 42.49 2ami n ASP 56 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2ami h LYS 57 N 6.04 1.11 0.00 -0.67 1.79 -1.73 -3.42 116.57 119.69 2ami h LYS 57 Ca 0.54 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 2ami h LYS 57 Cb 0.65 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2ami h LYS 57 CO 1.84 0.87 -0.06 -0.40 -1.08 0.00 0.00 179.45 180.62 2ami n ASP 58 N -4.37 0.32 0.07 0.86 5.75 -1.26 -4.92 116.55 113.00 2ami n ASP 58 Ca 0.07 0.00 0.05 0.00 -0.01 0.00 0.00 54.79 54.90 2ami n ASP 58 Cb 0.14 0.04 0.26 0.00 -1.03 0.00 0.00 41.12 40.53 2ami n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ami n GLY 59 N 0.61 -0.67 3.57 6.12 0.00 -1.26 -4.89 105.19 108.68 2ami n GLY 59 Ca 0.00 0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 2ami n GLY 59 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ami n SER 60 N -1.83 -5.77 0.00 1.61 7.64 -1.26 -1.57 113.62 112.44 2ami n SER 60 Ca -0.01 -0.74 0.00 0.00 1.01 0.00 0.00 58.87 59.13 2ami n SER 60 Cb 0.02 -3.09 0.00 0.00 -1.01 0.00 0.00 64.21 60.12 2ami n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ami n GLY 61 N -1.72 3.27 3.71 0.23 0.00 -1.26 -5.02 105.19 104.40 2ami n GLY 61 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 2ami n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ami s THR 62 N -2.34 2.70 -0.21 2.61 -4.23 -0.61 -1.21 115.64 112.34 2ami s THR 62 Ca 0.00 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 58.74 2ami s THR 62 Cb 0.00 -2.93 0.03 0.00 1.34 0.00 0.00 72.50 70.94 2ami s THR 62 CO 0.00 -0.13 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.17 2ami s ILE 63 N -2.50 2.33 0.75 2.99 -1.09 0.88 -4.08 121.20 120.48 2ami s ILE 63 Ca 0.38 -1.08 -0.11 0.00 -2.23 0.00 0.00 60.65 57.61 2ami s ILE 63 Cb 0.00 -2.11 0.04 0.00 -1.58 0.00 0.00 42.46 38.81 2ami s ILE 63 CO 0.22 0.34 1.08 -0.62 -1.23 0.00 0.00 174.94 174.73 2ami s ASP 64 N 1.27 4.79 0.21 3.58 2.15 -1.26 -0.57 116.67 126.83 2ami s ASP 64 Ca 0.01 1.69 -0.11 0.00 0.43 0.00 0.00 52.55 54.57 2ami s ASP 64 Cb -0.15 -2.46 0.28 0.00 -0.30 0.00 0.00 42.92 40.29 2ami s ASP 64 CO -0.09 -1.84 1.65 0.15 -0.17 0.00 0.00 175.17 174.87 2ami h PHE 65 N -0.99 -0.13 -0.71 -5.34 3.57 -1.99 0.12 116.94 111.46 2ami h PHE 65 Ca -0.44 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.05 2ami h PHE 65 Cb 1.23 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 40.09 2ami h PHE 65 CO 0.58 -0.20 0.23 0.93 -2.23 0.00 0.00 178.31 177.62 2ami h GLU 66 N 0.08 1.10 -0.21 1.11 4.39 -1.97 0.20 114.58 119.27 2ami h GLU 66 Ca 0.32 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 2ami h GLU 66 Cb 0.51 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2ami h GLU 66 CO -0.57 0.94 0.09 0.93 -1.16 0.00 0.00 179.01 179.25 2ami h GLU 67 N 1.04 0.31 -0.36 2.33 5.08 -1.61 0.90 114.58 122.26 2ami h GLU 67 Ca 0.23 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2ami h GLU 67 Cb 0.29 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2ami h GLU 67 CO -0.01 0.35 0.22 0.35 -1.00 0.00 0.00 179.01 178.92 2ami h PHE 68 N 0.20 0.41 -0.38 4.33 3.57 -0.52 -0.21 116.94 124.34 2ami h PHE 68 Ca 0.07 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.64 2ami h PHE 68 Cb 0.14 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 2ami h PHE 68 CO -0.02 0.25 0.07 1.25 -2.23 0.00 0.00 178.31 177.62 2ami h LEU 69 N 0.45 -0.01 -0.07 0.59 5.85 -0.44 0.91 115.31 122.59 2ami h LEU 69 Ca 0.14 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.95 2ami h LEU 69 Cb -0.01 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2ami h LEU 69 CO -0.06 0.03 -0.09 0.74 -0.34 0.00 0.00 178.44 178.72 2ami h THR 70 N 0.19 0.75 -0.28 1.05 2.02 -0.23 0.27 112.91 116.68 2ami h THR 70 Ca 0.18 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.43 2ami h THR 70 Cb 0.22 0.75 -0.07 0.00 -1.74 0.00 0.00 68.15 67.31 2ami h THR 70 CO -0.25 0.00 -0.19 -0.03 0.37 0.00 0.00 175.52 175.42 2ami h MET 71 N -0.12 -0.16 -0.91 6.66 1.85 -0.52 0.04 114.93 121.76 2ami h MET 71 Ca 0.06 0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.15 2ami h MET 71 Cb 0.21 0.04 -0.04 0.00 0.43 0.00 0.00 31.60 32.23 2ami h MET 71 CO -0.14 -0.11 0.51 0.52 -0.40 0.00 0.00 176.91 177.29 2ami h MET 72 N -0.17 1.26 -0.44 0.39 2.07 -0.37 0.10 114.93 117.77 2ami h MET 72 Ca 0.15 -0.14 0.03 0.00 -2.07 0.00 0.00 59.70 57.67 2ami h MET 72 Cb 0.40 -0.25 -0.03 0.00 -1.87 0.00 0.00 31.60 29.85 2ami h MET 72 CO -0.39 0.92 0.25 1.15 1.07 0.00 0.00 176.91 179.91 2ami h THR 73 N 1.27 1.02 0.17 2.22 2.02 0.29 0.25 112.91 120.16 2ami h THR 73 Ca 0.32 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 2ami h THR 73 Cb 0.01 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2ami h THR 73 CO -0.05 0.09 -0.08 0.00 0.37 0.00 0.00 175.52 175.84 2ami h ALA 74 N 1.21 -0.23 0.20 6.16 0.00 -0.31 -3.36 119.26 122.93 2ami h ALA 74 Ca 0.18 -0.18 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 2ami h ALA 74 Cb 0.04 0.09 0.02 0.00 0.00 0.00 0.00 17.79 17.95 2ami h ALA 74 CO -0.10 -0.46 -1.46 0.87 0.00 0.00 0.00 179.25 178.10 2ami h LYS 75 N -0.58 0.43 0.00 0.00 1.79 -0.78 -3.52 116.57 113.92 2ami h LYS 75 Ca -0.02 -0.73 0.00 0.00 -2.18 0.00 0.00 60.65 57.71 2ami h LYS 75 Cb 0.43 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 2ami h LYS 75 CO 0.04 1.34 0.00 -1.33 -1.08 0.00 0.00 179.45 178.42