#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ncy s SER 2 N 0.00 2.30 0.05 0.00 1.04 -1.26 -4.75 113.70 111.07 1ncy s SER 2 Ca 0.00 0.45 -0.24 0.00 0.48 0.00 0.00 55.95 56.64 1ncy s SER 2 Cb 0.00 -0.60 -0.17 0.00 0.10 0.00 0.00 66.02 65.35 1ncy s SER 2 CO 0.00 -3.26 1.57 -0.03 0.98 0.00 0.00 173.24 172.51 1ncy h MET 3 N -2.00 -0.01 -0.43 4.02 -1.53 -2.05 0.13 114.93 113.07 1ncy h MET 3 Ca -0.45 0.00 -0.05 0.00 -3.44 0.00 0.00 59.70 55.77 1ncy h MET 3 Cb 1.26 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 32.30 1ncy h MET 3 CO 0.38 0.16 0.08 1.79 0.14 0.00 0.00 176.91 179.45 1ncy h THR 4 N -0.18 1.20 -0.29 -0.77 1.35 -1.98 0.24 112.91 112.47 1ncy h THR 4 Ca -0.00 -0.75 -0.13 0.00 -0.55 0.00 0.00 66.41 64.98 1ncy h THR 4 Cb 0.18 0.80 -0.00 0.00 -1.73 0.00 0.00 68.15 67.39 1ncy h THR 4 CO 0.00 0.27 -0.31 0.44 -0.25 0.00 0.00 175.52 175.67 1ncy h ASP 5 N 0.63 0.78 -0.38 5.36 5.19 -1.87 -1.76 116.42 124.38 1ncy h ASP 5 Ca 0.14 -0.48 -0.10 0.00 -0.62 0.00 0.00 57.03 55.98 1ncy h ASP 5 Cb 0.28 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 1ncy h ASP 5 CO 0.00 1.10 -0.11 1.56 -3.12 0.00 0.00 179.24 178.68 1ncy h GLN 6 N 0.48 0.82 -0.26 3.56 4.20 -0.29 -1.44 115.11 122.19 1ncy h GLN 6 Ca 0.04 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 1ncy h GLN 6 Cb 0.89 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1ncy h GLN 6 CO 0.08 0.89 -0.13 1.96 -0.67 0.00 0.00 178.83 180.96 1ncy h GLN 7 N 0.74 0.55 -0.73 1.46 4.20 -0.93 0.23 115.11 120.63 1ncy h GLN 7 Ca 0.12 -0.24 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1ncy h GLN 7 Cb 0.60 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1ncy h GLN 7 CO 0.04 0.80 0.22 0.00 -0.67 0.00 0.00 178.83 179.22 1ncy h ALA 8 N 0.73 1.02 -0.03 3.87 0.00 -1.08 -2.21 119.26 121.56 1ncy h ALA 8 Ca 0.06 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 1ncy h ALA 8 Cb 0.64 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ncy h ALA 8 CO 0.04 0.66 -0.79 0.93 0.00 0.00 0.00 179.25 180.09 1ncy h GLU 9 N 1.08 0.26 -0.65 0.00 5.08 -1.01 -2.54 114.58 116.80 1ncy h GLU 9 Ca 0.23 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1ncy h GLU 9 Cb 0.31 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1ncy h GLU 9 CO -0.01 0.92 0.12 0.00 -1.00 0.00 0.00 179.01 179.04 1ncy h ALA 10 N 1.00 0.86 -0.19 3.43 0.00 -0.26 -2.44 119.26 121.66 1ncy h ALA 10 Ca -0.04 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 1ncy h ALA 10 Cb 1.38 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1ncy h ALA 10 CO 0.12 0.61 -0.41 0.00 0.00 0.00 0.00 179.25 179.58 1ncy h ARG 11 N 0.99 0.45 0.00 0.00 3.08 -1.35 -2.62 114.38 114.92 1ncy h ARG 11 Ca 0.20 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1ncy h ARG 11 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1ncy h ARG 11 CO 0.01 0.79 -0.07 0.00 -1.07 0.00 0.00 179.97 179.62 1ncy h ALA 12 N 1.19 1.02 0.00 0.04 0.00 -1.29 -2.97 119.26 117.24 1ncy h ALA 12 Ca 0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1ncy h ALA 12 Cb 0.88 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1ncy h ALA 12 CO 0.07 0.09 -0.33 0.35 0.00 0.00 0.00 179.25 179.44 1ncy h PHE 13 N 0.00 0.00 -2.93 0.00 3.04 -1.05 -3.46 116.94 112.54 1ncy h PHE 13 Ca -0.00 0.00 -0.60 0.00 3.98 0.00 0.00 57.97 61.35 1ncy h PHE 13 Cb 0.58 0.00 -0.09 0.00 2.56 0.00 0.00 35.95 39.00 1ncy h PHE 13 CO 0.00 0.33 -0.61 -0.51 -2.02 0.00 0.00 178.31 175.50 1ncy s LEU 14 N -6.39 3.63 0.59 0.59 1.43 -1.12 -5.11 118.68 112.29 1ncy s LEU 14 Ca 0.05 -0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 52.82 1ncy s LEU 14 Cb 0.07 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1ncy s LEU 14 CO 0.72 0.11 1.03 -0.94 0.23 0.00 0.00 176.35 177.50 1ncy s SER 15 N -2.81 6.01 0.39 2.29 1.04 -1.26 -4.89 113.70 114.47 1ncy s SER 15 Ca 0.29 1.68 0.08 0.00 0.48 0.00 0.00 55.95 58.48 1ncy s SER 15 Cb -0.11 -2.52 0.79 0.00 0.10 0.00 0.00 66.02 64.29 1ncy s SER 15 CO 0.21 -1.01 1.97 -0.08 0.98 0.00 0.00 173.24 175.31 1ncy h GLU 16 N 0.35 0.40 -0.08 4.02 4.57 -1.99 -1.46 114.58 120.39 1ncy h GLU 16 Ca -0.46 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 57.57 1ncy h GLU 16 Cb 1.21 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 1ncy h GLU 16 CO 0.59 0.39 -0.37 1.05 -1.18 0.00 0.00 179.01 179.49 1ncy h GLU 17 N 0.40 0.17 -0.44 1.92 9.09 -1.99 -1.32 114.58 122.40 1ncy h GLU 17 Ca 0.09 -0.07 -0.10 0.00 0.05 0.00 0.00 59.36 59.33 1ncy h GLU 17 Cb 0.19 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.27 1ncy h GLU 17 CO -0.00 0.52 -0.13 1.98 0.05 0.00 0.00 179.01 181.43 1ncy h MET 18 N 0.15 0.87 -0.69 1.06 4.05 -1.76 -1.74 114.93 116.86 1ncy h MET 18 Ca 0.02 -0.34 -0.04 0.00 -0.28 0.00 0.00 59.70 59.06 1ncy h MET 18 Cb 0.73 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.45 1ncy h MET 18 CO 0.05 0.98 0.28 0.82 0.23 0.00 0.00 176.91 179.27 1ncy h ILE 19 N 0.70 1.24 -0.60 1.77 2.04 -0.70 0.04 117.51 122.01 1ncy h ILE 19 Ca 0.11 -0.75 -0.10 0.00 1.00 0.00 0.00 64.86 65.12 1ncy h ILE 19 Cb 0.67 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1ncy h ILE 19 CO 0.05 0.30 -0.02 0.00 0.00 0.00 0.00 178.15 178.48 1ncy h ALA 20 N 1.13 0.81 -0.42 1.87 0.00 -1.14 -1.25 119.26 120.27 1ncy h ALA 20 Ca 0.23 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1ncy h ALA 20 Cb 0.20 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ncy h ALA 20 CO -0.02 0.67 0.19 1.49 0.00 0.00 0.00 179.25 181.58 1ncy h GLU 21 N 0.97 0.60 -0.85 0.00 4.81 -0.97 -0.57 114.58 118.58 1ncy h GLU 21 Ca 0.17 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1ncy h GLU 21 Cb 0.59 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 1ncy h GLU 21 CO 0.03 0.53 0.46 0.74 -0.73 0.00 0.00 179.01 180.04 1ncy h PHE 22 N 0.53 1.17 -0.08 0.92 0.04 -0.67 -2.95 116.94 115.90 1ncy h PHE 22 Ca 0.14 -0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.75 1ncy h PHE 22 Cb 0.13 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 37.89 1ncy h PHE 22 CO -0.01 0.81 -0.53 -0.22 -0.60 0.00 0.00 178.31 177.77 1ncy h LYS 23 N 1.19 0.22 -0.78 1.51 3.64 -0.89 -2.04 116.57 119.43 1ncy h LYS 23 Ca 0.30 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1ncy h LYS 23 Cb 0.04 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1ncy h LYS 23 CO -0.05 0.70 0.34 0.00 -2.27 0.00 0.00 179.45 178.17 1ncy h ALA 24 N 1.28 1.13 -0.03 5.00 0.00 -0.95 0.15 119.26 125.85 1ncy h ALA 24 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1ncy h ALA 24 Cb 0.99 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ncy h ALA 24 CO 0.08 0.64 -0.12 0.00 0.00 0.00 0.00 179.25 179.85 1ncy h ALA 25 N 1.25 0.05 -0.71 0.00 0.00 -1.35 -3.24 119.26 115.26 1ncy h ALA 25 Ca 0.26 -0.37 0.11 0.00 0.00 0.00 0.00 54.91 54.91 1ncy h ALA 25 Cb 0.17 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1ncy h ALA 25 CO -0.03 -0.04 0.32 0.35 0.00 0.00 0.00 179.25 179.86 1ncy h PHE 26 N -0.47 0.57 -0.08 0.00 3.04 -1.23 -1.78 116.94 116.99 1ncy h PHE 26 Ca -0.01 0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.00 1ncy h PHE 26 Cb 0.77 -0.15 -0.00 0.00 2.56 0.00 0.00 35.95 39.13 1ncy h PHE 26 CO 0.15 0.16 0.08 -0.44 -2.02 0.00 0.00 178.31 176.23 1ncy h ASP 27 N 0.53 0.00 0.70 0.41 3.32 -0.74 -0.51 116.42 120.13 1ncy h ASP 27 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1ncy h ASP 27 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1ncy h ASP 27 CO -0.31 0.00 0.00 0.80 -1.72 0.00 0.00 179.24 178.01 1ncy n MET 28 N -3.97 0.07 0.00 3.56 0.00 -0.67 -1.88 117.12 114.23 1ncy n MET 28 Ca -0.01 0.26 0.05 0.00 -0.00 0.00 0.00 57.70 58.00 1ncy n MET 28 Cb 0.18 -1.62 0.01 0.00 0.00 0.00 0.00 33.22 31.79 1ncy n MET 28 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1ncy n PHE 29 N -1.74 0.00 0.00 1.12 3.01 -0.22 -4.73 117.46 114.90 1ncy n PHE 29 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1ncy n PHE 29 Cb 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 1ncy n PHE 29 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1ncy n ASP 30 N -0.04 0.00 0.00 4.37 -0.08 -0.79 -4.66 116.55 115.34 1ncy n ASP 30 Ca 0.05 0.10 0.00 0.00 -1.51 0.00 0.00 54.79 53.43 1ncy n ASP 30 Cb 0.24 -0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.57 1ncy n ASP 30 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ncy n ALA 31 N -1.12 0.00 1.32 -1.67 0.00 -1.24 -4.53 120.51 113.27 1ncy n ALA 31 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1ncy n ALA 31 Cb 0.00 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.06 1ncy n ALA 31 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ncy n ASP 32 N 2.49 0.30 -3.55 0.00 2.03 -1.26 -4.93 116.55 111.64 1ncy n ASP 32 Ca 0.00 -0.31 -0.26 0.00 0.52 0.00 0.00 54.79 54.74 1ncy n ASP 32 Cb 0.00 -0.15 0.02 0.00 -0.72 0.00 0.00 41.12 40.28 1ncy n ASP 32 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ncy n GLY 33 N 1.33 -0.50 0.07 0.27 0.00 -1.26 -4.87 105.19 100.23 1ncy n GLY 33 Ca 0.13 0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.42 1ncy n GLY 33 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ncy h GLY 34 N -1.67 0.00 0.00 -0.02 0.00 -1.91 -3.47 103.07 95.99 1ncy h GLY 34 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1ncy h GLY 34 CO 0.60 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.75 1ncy n GLY 35 N 1.32 0.81 3.26 4.60 0.00 -1.26 -5.07 105.19 108.85 1ncy n GLY 35 Ca 0.03 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 1ncy n GLY 35 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ncy s ASP 36 N -2.25 0.16 0.14 1.61 1.47 -1.26 -2.53 116.67 114.01 1ncy s ASP 36 Ca 0.00 -1.15 -0.00 0.00 1.18 0.00 0.00 52.55 52.58 1ncy s ASP 36 Cb 0.00 0.38 -0.04 0.00 -0.34 0.00 0.00 42.92 42.92 1ncy s ASP 36 CO 0.00 -0.84 0.04 0.27 0.68 0.00 0.00 175.17 175.31 1ncy s ILE 37 N -4.06 0.30 0.39 2.11 -4.36 -0.82 -4.47 121.20 110.29 1ncy s ILE 37 Ca 0.26 -1.93 -0.25 0.00 -0.26 0.00 0.00 60.65 58.47 1ncy s ILE 37 Cb 0.05 -2.07 -0.09 0.00 1.25 0.00 0.00 42.46 41.61 1ncy s ILE 37 CO 0.05 -0.47 1.14 -0.55 0.24 0.00 0.00 174.94 175.35 1ncy s SER 38 N -3.09 6.60 0.57 4.36 0.15 -1.26 -1.11 113.70 119.91 1ncy s SER 38 Ca 0.24 2.28 0.35 0.00 0.70 0.00 0.00 55.95 59.52 1ncy s SER 38 Cb 0.07 -2.61 1.52 0.00 -1.71 0.00 0.00 66.02 63.30 1ncy s SER 38 CO 0.02 -0.62 2.04 0.71 1.20 0.00 0.00 173.24 176.60 1ncy h THR 39 N 2.33 0.00 0.00 6.45 1.35 -1.77 -1.19 112.91 120.08 1ncy h THR 39 Ca -0.49 -0.43 -0.04 0.00 -0.55 0.00 0.00 66.41 64.91 1ncy h THR 39 Cb 1.23 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 1ncy h THR 39 CO 0.63 0.00 -0.18 0.11 -0.25 0.00 0.00 175.52 175.83 1ncy h LYS 40 N 0.00 0.00 -0.02 4.72 1.79 -1.90 -3.00 116.57 118.17 1ncy h LYS 40 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ncy h LYS 40 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1ncy h LYS 40 CO 0.00 0.18 -0.28 0.39 -1.08 0.00 0.00 179.45 178.66 1ncy n GLU 41 N -3.29 1.61 -0.14 3.15 -0.58 -0.45 -4.59 120.64 116.35 1ncy n GLU 41 Ca 0.01 -1.31 -0.07 0.00 -0.42 0.00 0.00 57.16 55.37 1ncy n GLU 41 Cb 0.44 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.85 1ncy n GLU 41 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1ncy h LEU 42 N 3.19 0.47 -0.33 -4.62 5.85 -1.52 -2.55 115.31 115.80 1ncy h LEU 42 Ca 0.00 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.77 1ncy h LEU 42 Cb 0.82 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 1ncy h LEU 42 CO 0.00 0.34 0.04 1.23 -0.34 0.00 0.00 178.44 179.70 1ncy h GLY 43 N 0.56 0.35 1.00 3.75 0.00 -1.81 -2.03 103.07 104.90 1ncy h GLY 43 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1ncy h GLY 43 CO -0.05 -0.04 0.38 -0.84 0.00 0.00 0.00 176.54 175.99 1ncy h THR 44 N 0.14 1.20 -0.29 4.70 2.02 -1.74 -1.85 112.91 117.09 1ncy h THR 44 Ca 0.16 -0.48 -0.16 0.00 0.77 0.00 0.00 66.41 66.70 1ncy h THR 44 Cb 0.19 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1ncy h THR 44 CO -0.23 0.21 -0.47 0.58 0.37 0.00 0.00 175.52 175.98 1ncy h VAL 45 N 0.91 1.29 -0.47 3.16 2.07 -1.32 -2.00 116.25 119.88 1ncy h VAL 45 Ca 0.24 -1.66 0.01 0.00 0.82 0.00 0.00 66.70 66.10 1ncy h VAL 45 Cb 0.01 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1ncy h VAL 45 CO -0.04 0.54 0.30 0.24 0.02 0.00 0.00 177.57 178.63 1ncy h MET 46 N 0.60 0.60 -0.29 1.57 2.86 -1.24 -2.10 114.93 116.94 1ncy h MET 46 Ca 0.03 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 1ncy h MET 46 Cb 1.04 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 1ncy h MET 46 CO 0.10 0.40 -0.34 0.00 1.06 0.00 0.00 176.91 178.13 1ncy h ARG 47 N 0.62 0.63 -0.25 1.72 3.08 -1.21 -1.11 114.38 117.86 1ncy h ARG 47 Ca 0.18 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1ncy h ARG 47 Cb -0.05 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1ncy h ARG 47 CO -0.05 0.88 0.16 0.52 -1.07 0.00 0.00 179.97 180.40 1ncy h MET 48 N 0.53 0.32 -0.87 0.04 2.86 -1.18 -1.68 114.93 114.95 1ncy h MET 48 Ca 0.06 -0.02 -0.33 0.00 -2.06 0.00 0.00 59.70 57.35 1ncy h MET 48 Cb 0.84 -0.07 -0.20 0.00 0.06 0.00 0.00 31.60 32.23 1ncy h MET 48 CO 0.07 0.22 0.42 1.28 1.06 0.00 0.00 176.91 179.96 1ncy n LEU 49 N -4.49 6.21 0.00 1.22 4.77 -0.80 -4.92 117.00 118.98 1ncy n LEU 49 Ca 0.01 -3.27 0.00 0.00 -0.03 0.00 0.00 56.01 52.72 1ncy n LEU 49 Cb 0.08 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 1ncy n LEU 49 CO 0.35 0.88 0.00 0.61 -1.33 0.00 0.00 177.39 177.90 1ncy n GLY 50 N -0.51 0.59 3.92 -0.72 0.00 -0.63 -5.03 105.19 102.82 1ncy n GLY 50 Ca 0.47 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.22 1ncy n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ncy s GLN 51 N -0.20 3.55 -0.42 1.61 -1.52 -0.47 -4.99 119.66 117.22 1ncy s GLN 51 Ca 0.00 -0.23 0.07 0.00 -1.95 0.00 0.00 55.36 53.25 1ncy s GLN 51 Cb 0.00 -2.73 0.23 0.00 -0.22 0.00 0.00 33.01 30.28 1ncy s GLN 51 CO 0.00 0.28 0.49 0.27 -0.25 0.00 0.00 175.29 176.08 1ncy n ASN 52 N -1.02 0.34 -4.79 5.90 6.94 -1.26 -3.62 115.26 117.76 1ncy n ASN 52 Ca -0.04 -2.68 -0.34 0.00 -0.02 0.00 0.00 54.58 51.50 1ncy n ASN 52 Cb 0.54 -0.62 -0.01 0.00 -2.36 0.00 0.00 39.78 37.33 1ncy n ASN 52 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1ncy s PRO 53 N -0.98 3.56 0.70 -0.53 0.04 -1.26 -5.05 135.00 131.48 1ncy s PRO 53 Ca 0.35 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.81 1ncy s PRO 53 Cb 0.13 -2.05 0.06 0.00 0.04 0.00 0.00 34.50 32.69 1ncy s PRO 53 CO -0.13 -0.66 1.00 0.95 0.04 0.00 0.00 177.00 178.21 1ncy s THR 54 N -1.89 2.29 0.23 1.26 -4.23 -1.26 -4.87 115.64 107.17 1ncy s THR 54 Ca 0.70 -0.30 -0.03 0.00 -1.18 0.00 0.00 61.69 60.89 1ncy s THR 54 Cb -0.20 -2.99 0.05 0.00 1.34 0.00 0.00 72.50 70.70 1ncy s THR 54 CO 0.24 0.00 1.66 0.11 -0.54 0.00 0.00 174.62 176.09 1ncy h LYS 55 N -0.57 0.70 -0.92 3.99 1.79 -1.99 -2.18 116.57 117.39 1ncy h LYS 55 Ca -0.44 -0.27 -0.00 0.00 -2.18 0.00 0.00 60.65 57.76 1ncy h LYS 55 Cb 1.31 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.88 1ncy h LYS 55 CO 0.59 0.86 0.57 1.49 -1.08 0.00 0.00 179.45 181.88 1ncy h GLU 56 N 0.62 1.25 -0.55 3.15 4.22 -1.99 0.91 114.58 122.19 1ncy h GLU 56 Ca 0.09 -0.11 -0.08 0.00 0.08 0.00 0.00 59.36 59.35 1ncy h GLU 56 Cb 0.69 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1ncy h GLU 56 CO 0.05 0.86 0.03 0.93 -2.18 0.00 0.00 179.01 178.71 1ncy h GLU 57 N 1.27 0.92 -0.37 1.92 5.08 -1.88 -1.22 114.58 120.29 1ncy h GLU 57 Ca 0.33 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1ncy h GLU 57 Cb -0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1ncy h GLU 57 CO -0.06 0.89 0.10 1.25 -1.00 0.00 0.00 179.01 180.18 1ncy h LEU 58 N 0.85 0.56 -0.79 1.33 5.85 -0.75 -1.82 115.31 120.55 1ncy h LEU 58 Ca 0.16 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1ncy h LEU 58 Cb 0.46 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1ncy h LEU 58 CO 0.02 0.64 0.52 0.44 -0.34 0.00 0.00 178.44 179.72 1ncy h ASP 59 N 0.46 0.88 -0.37 1.25 3.32 -0.62 -1.67 116.42 119.67 1ncy h ASP 59 Ca 0.12 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1ncy h ASP 59 Cb 0.29 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1ncy h ASP 59 CO 0.00 0.62 -0.09 0.00 -1.72 0.00 0.00 179.24 178.05 1ncy h ALA 60 N 1.31 1.00 -0.18 3.45 0.00 -0.98 -1.26 119.26 122.61 1ncy h ALA 60 Ca 0.30 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ncy h ALA 60 Cb -0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1ncy h ALA 60 CO -0.08 0.60 -0.24 0.82 0.00 0.00 0.00 179.25 180.35 1ncy h ILE 61 N 0.73 1.34 -0.76 0.00 2.04 -1.00 -0.80 117.51 119.06 1ncy h ILE 61 Ca 0.13 -1.45 0.04 0.00 1.00 0.00 0.00 64.86 64.58 1ncy h ILE 61 Cb 0.57 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 1ncy h ILE 61 CO 0.03 0.44 0.47 0.40 0.00 0.00 0.00 178.15 179.49 1ncy h ILE 62 N 0.12 1.07 -0.30 -0.67 2.04 -1.20 0.19 117.51 118.75 1ncy h ILE 62 Ca 0.02 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 1ncy h ILE 62 Cb 0.81 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1ncy h ILE 62 CO 0.06 0.16 -0.20 -0.33 0.00 0.00 0.00 178.15 177.84 1ncy h GLU 63 N 0.89 0.55 -0.38 2.37 5.08 -1.06 0.26 114.58 122.29 1ncy h GLU 63 Ca 0.32 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1ncy h GLU 63 Cb 0.08 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1ncy h GLU 63 CO -0.14 0.72 -0.01 1.49 -1.00 0.00 0.00 179.01 180.08 1ncy h GLU 64 N 0.50 0.68 0.00 2.33 4.81 -0.19 -3.33 114.58 119.38 1ncy h GLU 64 Ca 0.08 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1ncy h GLU 64 Cb 0.62 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1ncy h GLU 64 CO 0.04 0.78 -0.79 1.33 -0.73 0.00 0.00 179.01 179.64 1ncy n VAL 65 N -4.46 0.35 -1.50 0.32 0.24 0.59 -4.44 118.33 109.42 1ncy n VAL 65 Ca -0.01 -0.31 -0.34 0.00 -2.04 0.00 0.00 64.34 61.64 1ncy n VAL 65 Cb 0.29 -0.08 0.07 0.00 -1.47 0.00 0.00 33.84 32.65 1ncy n VAL 65 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1ncy n ASP 66 N -2.16 7.22 0.20 -1.34 2.03 0.05 -4.70 116.55 117.85 1ncy n ASP 66 Ca 0.02 -3.79 0.07 0.00 0.52 0.00 0.00 54.79 51.62 1ncy n ASP 66 Cb 0.46 -0.88 0.40 0.00 -0.72 0.00 0.00 41.12 40.37 1ncy n ASP 66 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1ncy h GLU 67 N 2.11 0.00 -0.02 -0.67 5.08 -1.78 -2.04 114.58 117.26 1ncy h GLU 67 Ca 0.56 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.92 1ncy h GLU 67 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1ncy h GLU 67 CO 1.44 0.32 0.00 -0.40 -1.00 0.00 0.00 179.01 179.37 1ncy n ASP 68 N -3.53 0.85 -0.82 1.42 5.68 -1.26 -4.94 116.55 113.94 1ncy n ASP 68 Ca -0.00 -1.33 -0.10 0.00 -0.50 0.00 0.00 54.79 52.86 1ncy n ASP 68 Cb 0.46 -0.01 -0.04 0.00 -1.14 0.00 0.00 41.12 40.39 1ncy n ASP 68 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ncy n GLY 69 N 1.08 1.05 0.21 6.12 0.00 -0.77 -4.90 105.19 107.98 1ncy n GLY 69 Ca 0.20 -0.55 0.14 0.00 0.00 0.00 0.00 46.02 45.81 1ncy n GLY 69 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ncy h SER 70 N 0.00 0.00 -0.42 1.61 4.64 -1.92 -3.47 113.55 113.98 1ncy h SER 70 Ca -0.21 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.96 1ncy h SER 70 Cb 0.72 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.76 1ncy h SER 70 CO 0.31 0.00 -0.14 0.61 -0.87 0.00 0.00 176.83 176.74 1ncy n GLY 71 N 0.75 0.82 3.32 -0.77 0.00 -1.26 -5.02 105.19 103.02 1ncy n GLY 71 Ca 0.03 -0.71 -0.17 0.00 0.00 0.00 0.00 46.02 45.18 1ncy n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ncy s THR 72 N -2.28 0.86 -0.02 2.61 -4.23 -1.26 -2.36 115.64 108.97 1ncy s THR 72 Ca 0.00 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.51 1ncy s THR 72 Cb 0.00 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.43 1ncy s THR 72 CO 0.00 -0.24 -0.04 -0.51 -0.54 0.00 0.00 174.62 173.29 1ncy s ILE 73 N -3.54 0.41 0.60 2.99 2.07 -0.27 -4.65 121.20 118.81 1ncy s ILE 73 Ca 0.31 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.40 1ncy s ILE 73 Cb 0.07 -0.40 0.06 0.00 0.13 0.00 0.00 42.46 42.32 1ncy s ILE 73 CO 0.10 0.15 0.84 1.51 -1.91 0.00 0.00 174.94 175.63 1ncy s ASP 74 N 0.35 5.03 0.19 4.50 -4.77 -1.26 -1.95 116.67 118.76 1ncy s ASP 74 Ca -0.04 -0.07 -0.12 0.00 -3.30 0.00 0.00 52.55 49.02 1ncy s ASP 74 Cb -0.08 -0.67 0.13 0.00 -1.09 0.00 0.00 42.92 41.21 1ncy s ASP 74 CO -0.00 -1.34 1.84 0.15 0.70 0.00 0.00 175.17 176.52 1ncy h PHE 75 N -0.11 0.75 -0.53 2.11 3.57 -1.90 -0.91 116.94 119.91 1ncy h PHE 75 Ca -0.41 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.07 1ncy h PHE 75 Cb 1.29 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.76 1ncy h PHE 75 CO 0.24 0.45 0.15 0.93 -2.23 0.00 0.00 178.31 177.85 1ncy h GLU 76 N 0.80 0.84 -0.04 1.11 4.39 -1.95 -1.18 114.58 118.55 1ncy h GLU 76 Ca 0.24 -0.19 -0.10 0.00 0.34 0.00 0.00 59.36 59.65 1ncy h GLU 76 Cb -0.04 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 1ncy h GLU 76 CO -0.08 0.78 -0.44 0.93 -1.16 0.00 0.00 179.01 179.05 1ncy h GLU 77 N 0.74 0.08 -0.31 2.33 5.08 -1.90 -2.77 114.58 117.83 1ncy h GLU 77 Ca 0.17 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ncy h GLU 77 Cb 0.31 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1ncy h GLU 77 CO -0.00 0.51 0.21 0.35 -1.00 0.00 0.00 179.01 179.07 1ncy h PHE 78 N 0.07 0.39 -0.81 4.33 3.57 -0.65 -1.64 116.94 122.20 1ncy h PHE 78 Ca 0.00 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1ncy h PHE 78 Cb 0.80 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 1ncy h PHE 78 CO 0.00 0.25 0.35 -0.07 -2.23 0.00 0.00 178.31 176.61 1ncy h LEU 79 N 0.42 1.09 -0.71 0.59 3.38 -1.00 0.33 115.31 119.41 1ncy h LEU 79 Ca 0.12 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1ncy h LEU 79 Cb -0.05 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 1ncy h LEU 79 CO -0.03 0.95 0.37 0.58 0.09 0.00 0.00 178.44 180.40 1ncy h VAL 80 N 1.17 1.22 -0.43 1.22 2.07 -1.15 -1.84 116.25 118.52 1ncy h VAL 80 Ca 0.27 -0.59 -0.11 0.00 0.82 0.00 0.00 66.70 67.09 1ncy h VAL 80 Cb 0.18 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1ncy h VAL 80 CO -0.03 0.25 -0.16 0.24 0.02 0.00 0.00 177.57 177.89 1ncy h MET 81 N 0.98 0.82 -0.30 1.57 2.86 -0.59 -2.17 114.93 118.09 1ncy h MET 81 Ca 0.25 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1ncy h MET 81 Cb 0.07 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1ncy h MET 81 CO -0.04 0.93 0.16 0.52 1.06 0.00 0.00 176.91 179.54 1ncy h MET 82 N 0.72 0.42 -0.48 1.72 2.07 -0.68 -1.72 114.93 116.98 1ncy h MET 82 Ca 0.11 -0.05 -0.06 0.00 -2.07 0.00 0.00 59.70 57.63 1ncy h MET 82 Cb 0.67 -0.08 -0.02 0.00 -1.87 0.00 0.00 31.60 30.30 1ncy h MET 82 CO 0.05 0.36 0.05 0.28 1.07 0.00 0.00 176.91 178.72 1ncy h VAL 83 N 0.37 1.23 0.01 -2.22 2.07 -1.18 -0.42 116.25 116.10 1ncy h VAL 83 Ca 0.11 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1ncy h VAL 83 Cb 0.06 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1ncy h VAL 83 CO -0.02 0.32 -0.02 0.03 0.02 0.00 0.00 177.57 177.91 1ncy h ARG 84 N 0.73 -0.04 -0.54 1.57 3.08 -1.21 -1.73 114.38 116.25 1ncy h ARG 84 Ca 0.15 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 1ncy h ARG 84 Cb 0.38 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1ncy h ARG 84 CO 0.01 -0.02 0.20 0.37 -1.07 0.00 0.00 179.97 179.46 1ncy h GLN 85 N -0.04 0.81 -0.39 0.04 5.75 -1.08 -2.51 115.11 117.70 1ncy h GLN 85 Ca 0.01 -0.15 0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1ncy h GLN 85 Cb 0.04 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.41 1ncy h GLN 85 CO -0.02 0.71 0.07 0.52 -2.65 0.00 0.00 178.83 177.47 1ncy h MET 86 N 0.73 0.19 -0.67 1.69 2.86 -0.95 0.33 114.93 119.11 1ncy h MET 86 Ca 0.18 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1ncy h MET 86 Cb 0.22 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1ncy h MET 86 CO -0.01 0.13 0.16 0.87 1.06 0.00 0.00 176.91 179.11 1ncy h LYS 87 N 0.20 1.07 -0.27 1.72 1.57 -1.24 -0.28 116.57 119.33 1ncy h LYS 87 Ca 0.19 -0.25 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1ncy h LYS 87 Cb 0.22 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1ncy h LYS 87 CO -0.24 0.95 -0.14 1.49 -0.57 0.00 0.00 179.45 180.94 1ncy h GLU 88 N 1.01 0.57 -0.14 3.15 4.81 -1.05 -2.25 114.58 120.68 1ncy h GLU 88 Ca 0.21 -0.25 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1ncy h GLU 88 Cb 0.36 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1ncy h GLU 88 CO 0.00 0.82 0.01 -0.44 -0.73 0.00 0.00 179.01 178.68 1ncy h ASP 89 N 0.31 0.24 -0.90 1.04 3.32 -0.87 -2.54 116.42 117.01 1ncy h ASP 89 Ca 0.06 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 1ncy h ASP 89 Cb 0.65 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.10 1ncy h ASP 89 CO 0.04 0.46 0.50 0.00 -1.72 0.00 0.00 179.24 178.52 1ncy h ALA 90 N 0.79 1.19 0.00 3.45 0.00 -1.07 -0.28 119.26 123.34 1ncy h ALA 90 Ca 0.04 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1ncy h ALA 90 Cb 0.33 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ncy h ALA 90 CO 0.00 0.66 -0.25 -0.22 0.00 0.00 0.00 179.25 179.44 1ncy h LYS 91 N 1.26 0.00 -0.11 0.00 1.63 -1.25 -0.96 116.57 117.13 1ncy h LYS 91 Ca 0.32 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.98 1ncy h LYS 91 Cb 0.01 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1ncy h LYS 91 CO -0.05 0.25 -0.46 0.78 -3.45 0.00 0.00 179.45 176.52 1ncy h GLY 92 N 0.97 0.55 0.88 5.01 0.00 -0.94 -2.76 103.07 106.79 1ncy h GLY 92 Ca -0.00 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 46.56 1ncy h GLY 92 CO 0.03 0.68 0.01 1.70 0.00 0.00 0.00 176.54 178.97 1ncy h LYS 93 N 0.10 0.04 -0.84 4.80 3.11 -0.72 -1.48 116.57 121.57 1ncy h LYS 93 Ca -0.03 -0.01 0.04 0.00 -2.81 0.00 0.00 60.65 57.84 1ncy h LYS 93 Cb 1.10 -0.01 -0.05 0.00 -1.00 0.00 0.00 32.23 32.27 1ncy h LYS 93 CO 0.10 0.15 0.53 0.66 -2.81 0.00 0.00 179.45 178.08 1ncy h SER 94 N -0.08 0.88 -0.34 4.20 4.64 -1.15 -1.28 113.55 120.42 1ncy h SER 94 Ca 0.01 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1ncy h SER 94 Cb 0.12 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1ncy h SER 94 CO -0.00 0.60 0.19 -0.33 -0.87 0.00 0.00 176.83 176.41 1ncy h GLU 95 N 1.03 0.48 0.04 4.77 5.08 -1.45 -1.16 114.58 123.37 1ncy h GLU 95 Ca 0.34 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1ncy h GLU 95 Cb 0.03 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1ncy h GLU 95 CO -0.12 0.40 -0.04 0.93 -1.00 0.00 0.00 179.01 179.18 1ncy h GLU 96 N 0.43 -0.09 -0.53 2.33 5.08 -1.03 -1.35 114.58 119.42 1ncy h GLU 96 Ca 0.12 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1ncy h GLU 96 Cb 0.06 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1ncy h GLU 96 CO -0.02 -0.06 0.28 0.93 -1.00 0.00 0.00 179.01 179.14 1ncy h GLU 97 N -0.09 0.73 -0.43 2.33 4.39 -1.03 -2.00 114.58 118.47 1ncy h GLU 97 Ca 0.00 -0.08 -0.15 0.00 0.34 0.00 0.00 59.36 59.48 1ncy h GLU 97 Cb 0.09 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1ncy h GLU 97 CO -0.02 0.55 -0.30 -0.07 -1.16 0.00 0.00 179.01 178.02 1ncy h LEU 98 N 0.74 1.01 -0.98 1.33 3.38 -0.63 -1.40 115.31 118.76 1ncy h LEU 98 Ca 0.19 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1ncy h LEU 98 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1ncy h LEU 98 CO -0.03 1.22 0.27 0.00 0.09 0.00 0.00 178.44 180.00 1ncy h ALA 99 N 0.82 1.19 -0.45 1.53 0.00 -1.01 -0.17 119.26 121.17 1ncy h ALA 99 Ca 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1ncy h ALA 99 Cb 0.89 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ncy h ALA 99 CO 0.08 0.59 0.11 -0.91 0.00 0.00 0.00 179.25 179.12 1ncy h ASN 100 N 0.99 0.67 -0.35 0.00 2.35 -1.07 -2.05 115.58 116.12 1ncy h ASN 100 Ca 0.23 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.79 1ncy h ASN 100 Cb 0.19 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.35 1ncy h ASN 100 CO -0.02 0.73 0.13 0.00 -1.65 0.00 0.00 177.43 176.61 1ncy h PHE 102 N 0.28 0.54 -0.74 0.00 3.57 -0.77 -1.41 116.94 118.41 1ncy h PHE 102 Ca 0.16 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.69 1ncy h PHE 102 Cb 0.12 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.67 1ncy h PHE 102 CO -0.14 0.58 0.49 0.00 -2.23 0.00 0.00 178.31 177.01 1ncy h ARG 103 N 0.34 0.60 0.11 1.11 3.08 -1.01 0.15 114.38 118.76 1ncy h ARG 103 Ca 0.10 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1ncy h ARG 103 Cb 0.32 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1ncy h ARG 103 CO 0.00 0.40 -0.05 0.82 -1.07 0.00 0.00 179.97 180.07 1ncy h ILE 104 N 0.62 1.11 -0.81 2.04 2.04 -1.30 -3.28 117.51 117.93 1ncy h ILE 104 Ca 0.34 -1.11 0.03 0.00 1.00 0.00 0.00 64.86 65.12 1ncy h ILE 104 Cb 0.50 1.78 -0.05 0.00 -0.74 0.00 0.00 36.82 38.31 1ncy h ILE 104 CO -0.12 0.26 0.52 -0.26 0.00 0.00 0.00 178.15 178.55 1ncy h PHE 105 N -0.68 0.98 -0.92 1.37 0.04 -0.91 -3.31 116.94 113.51 1ncy h PHE 105 Ca -0.01 0.03 -0.69 0.00 2.80 0.00 0.00 57.97 60.09 1ncy h PHE 105 Cb 0.53 -0.33 -0.09 0.00 2.20 0.00 0.00 35.95 38.26 1ncy h PHE 105 CO 0.09 0.57 2.21 -3.47 -0.60 0.00 0.00 178.31 177.11 1ncy n ASP 106 N -4.57 4.86 -0.31 2.17 2.03 0.01 -4.83 116.55 115.91 1ncy n ASP 106 Ca 0.09 -2.92 0.03 0.00 0.52 0.00 0.00 54.79 52.51 1ncy n ASP 106 Cb 0.08 -1.72 0.17 0.00 -0.72 0.00 0.00 41.12 38.93 1ncy n ASP 106 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1ncy h LYS 107 N 7.34 0.86 -0.43 -0.67 1.57 -1.78 -2.21 116.57 121.23 1ncy h LYS 107 Ca 0.45 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 1ncy h LYS 107 Cb 0.84 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1ncy h LYS 107 CO 1.48 0.57 0.00 0.27 -0.57 0.00 0.00 179.45 181.20 1ncy n ASN 108 N -4.68 2.64 -3.99 0.86 6.94 -1.26 -4.96 115.26 110.81 1ncy n ASN 108 Ca 0.14 -1.95 -0.30 0.00 -0.02 0.00 0.00 54.58 52.45 1ncy n ASN 108 Cb 0.26 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 1ncy n ASN 108 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ncy n ALA 109 N 0.94 -1.50 1.29 -2.53 0.00 -0.83 -4.89 120.51 112.98 1ncy n ALA 109 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.74 1ncy n ALA 109 Cb 0.44 -3.31 0.35 0.00 0.00 0.00 0.00 19.45 16.93 1ncy n ALA 109 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ncy n ASP 110 N -2.84 1.79 0.00 0.00 5.75 -1.26 -4.92 116.55 115.08 1ncy n ASP 110 Ca -0.06 -1.49 0.00 0.00 -0.01 0.00 0.00 54.79 53.23 1ncy n ASP 110 Cb 0.56 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 1ncy n ASP 110 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ncy n GLY 111 N 1.27 0.70 3.07 6.12 0.00 -1.26 -5.07 105.19 110.03 1ncy n GLY 111 Ca 0.16 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1ncy n GLY 111 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ncy s PHE 112 N -2.00 0.16 -0.31 1.61 0.08 -1.26 -4.27 117.98 111.98 1ncy s PHE 112 Ca 0.00 -0.36 -0.12 0.00 0.12 0.00 0.00 56.93 56.57 1ncy s PHE 112 Cb 0.00 -0.12 -0.03 0.00 -0.57 0.00 0.00 43.02 42.30 1ncy s PHE 112 CO 0.00 -0.28 0.21 0.42 -0.10 0.00 0.00 175.22 175.47 1ncy s ILE 113 N -1.74 5.26 0.60 0.64 1.01 0.13 -4.74 121.20 122.36 1ncy s ILE 113 Ca -0.12 -0.03 0.04 0.00 0.00 0.00 0.00 60.65 60.53 1ncy s ILE 113 Cb -0.07 -3.60 0.08 0.00 0.01 0.00 0.00 42.46 38.89 1ncy s ILE 113 CO -0.01 0.13 0.83 1.51 0.00 0.00 0.00 174.94 177.40 1ncy s ASP 114 N 1.74 4.92 0.35 3.58 1.47 -1.26 -1.54 116.67 125.92 1ncy s ASP 114 Ca 0.06 -0.48 0.02 0.00 1.18 0.00 0.00 52.55 53.34 1ncy s ASP 114 Cb -0.17 -0.13 0.62 0.00 -0.34 0.00 0.00 42.92 42.91 1ncy s ASP 114 CO 0.10 -1.43 1.98 0.16 0.68 0.00 0.00 175.17 176.67 1ncy h ILE 115 N -0.04 1.17 0.19 2.11 -0.00 -1.99 0.76 117.51 119.71 1ncy h ILE 115 Ca -0.35 -0.40 -0.01 0.00 -0.00 0.00 0.00 64.86 64.09 1ncy h ILE 115 Cb 1.28 0.39 0.00 0.00 -0.00 0.00 0.00 36.82 38.50 1ncy h ILE 115 CO 0.43 0.18 -0.09 -0.33 -0.00 0.00 0.00 178.15 178.34 1ncy h GLU 116 N 0.78 -0.25 -0.18 0.16 3.07 -1.96 0.37 114.58 116.57 1ncy h GLU 116 Ca 0.20 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 59.09 1ncy h GLU 116 Cb 0.00 0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1ncy h GLU 116 CO -0.04 -0.10 0.07 0.93 -1.40 0.00 0.00 179.01 178.48 1ncy h GLU 117 N -0.34 0.16 -0.45 2.33 5.08 -1.85 -1.66 114.58 117.86 1ncy h GLU 117 Ca -0.03 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1ncy h GLU 117 Cb 0.26 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1ncy h GLU 117 CO 0.04 0.11 0.26 1.25 -1.00 0.00 0.00 179.01 179.67 1ncy h LEU 118 N 0.16 0.43 -0.87 1.33 5.85 -0.74 -2.11 115.31 119.36 1ncy h LEU 118 Ca 0.08 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 1ncy h LEU 118 Cb 0.04 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1ncy h LEU 118 CO -0.07 0.31 0.05 1.23 -0.34 0.00 0.00 178.44 179.62 1ncy h GLY 119 N 0.53 0.95 0.88 3.75 0.00 -0.73 -2.21 103.07 106.25 1ncy h GLY 119 Ca 0.18 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1ncy h GLY 119 CO -0.08 0.58 0.07 -2.09 0.00 0.00 0.00 176.54 175.02 1ncy h GLU 120 N 0.83 0.29 -0.45 4.80 4.81 -1.15 0.42 114.58 124.13 1ncy h GLU 120 Ca 0.17 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1ncy h GLU 120 Cb 0.43 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1ncy h GLU 120 CO 0.01 0.36 -0.04 0.82 -0.73 0.00 0.00 179.01 179.44 1ncy h ILE 121 N 0.15 1.27 -0.32 2.32 1.08 -1.28 -2.16 117.51 118.57 1ncy h ILE 121 Ca 0.06 -1.11 -0.16 0.00 -0.39 0.00 0.00 64.86 63.27 1ncy h ILE 121 Cb 0.19 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.02 1ncy h ILE 121 CO -0.00 0.38 -0.43 -0.07 -0.69 0.00 0.00 178.15 177.34 1ncy h LEU 122 N 0.66 0.86 -1.03 1.44 3.38 -1.27 -2.94 115.31 116.41 1ncy h LEU 122 Ca 0.12 -0.41 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 1ncy h LEU 122 Cb 0.55 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1ncy h LEU 122 CO 0.03 1.17 -0.20 0.03 0.09 0.00 0.00 178.44 179.56 1ncy h ARG 123 N 0.65 0.45 0.00 1.13 3.08 -0.08 -2.38 114.38 117.23 1ncy h ARG 123 Ca 0.05 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1ncy h ARG 123 Cb 1.00 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1ncy h ARG 123 CO 0.10 0.64 0.00 0.00 -1.07 0.00 0.00 179.97 179.63 1ncy n ALA 124 N -2.48 1.52 0.27 0.04 0.00 -0.82 -2.31 120.51 116.72 1ncy n ALA 124 Ca -0.00 0.01 0.16 0.00 0.00 0.00 0.00 53.44 53.61 1ncy n ALA 124 Cb 0.37 -1.24 0.59 0.00 0.00 0.00 0.00 19.45 19.16 1ncy n ALA 124 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1ncy h THR 125 N 0.00 0.00 0.00 0.00 1.35 -1.34 -3.46 112.91 109.46 1ncy h THR 125 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 1ncy h THR 125 Cb 0.22 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1ncy h THR 125 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1ncy n GLY 126 N 0.23 0.87 3.77 5.82 0.00 -0.98 -5.04 105.19 109.86 1ncy n GLY 126 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1ncy n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ncy s GLU 127 N -0.70 2.73 -1.17 1.61 0.41 -1.26 -4.90 118.70 115.42 1ncy s GLU 127 Ca 0.00 1.42 -0.14 0.00 -0.41 0.00 0.00 54.97 55.84 1ncy s GLU 127 Cb 0.00 -1.94 0.16 0.00 -1.78 0.00 0.00 34.13 30.57 1ncy s GLU 127 CO 0.00 -1.31 1.40 -1.01 -0.49 0.00 0.00 175.26 173.85 1ncy s HIS 128 N -2.32 3.44 0.01 1.61 3.76 -1.26 -4.90 115.29 115.64 1ncy s HIS 128 Ca 0.67 -2.03 -0.13 0.00 -0.15 0.00 0.00 55.06 53.42 1ncy s HIS 128 Cb -0.21 -4.32 -0.06 0.00 1.11 0.00 0.00 32.58 29.10 1ncy s HIS 128 CO 0.42 -1.42 0.38 0.08 -0.85 0.00 0.00 174.74 173.36 1ncy s VAL 129 N 1.77 5.08 0.40 -0.90 1.01 -1.26 -5.12 120.40 121.38 1ncy s VAL 129 Ca 0.42 0.69 0.08 0.00 0.00 0.00 0.00 61.98 63.16 1ncy s VAL 129 Cb -0.03 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 1ncy s VAL 129 CO -0.01 0.51 0.40 0.42 0.00 0.00 0.00 175.10 176.42 1ncy s THR 130 N -1.16 2.96 0.40 3.92 -4.23 -1.26 -4.99 115.64 111.29 1ncy s THR 130 Ca 0.25 -1.27 0.12 0.00 -1.18 0.00 0.00 61.69 59.62 1ncy s THR 130 Cb -0.16 -3.06 0.14 0.00 1.34 0.00 0.00 72.50 70.77 1ncy s THR 130 CO 0.14 -0.04 1.91 -0.08 -0.54 0.00 0.00 174.62 176.01 1ncy h GLU 131 N 1.00 0.07 -0.49 3.99 4.57 -2.00 -2.32 114.58 119.41 1ncy h GLU 131 Ca -0.42 -0.02 0.08 0.00 -1.18 0.00 0.00 59.36 57.82 1ncy h GLU 131 Cb 1.27 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.78 1ncy h GLU 131 CO 0.55 0.30 0.10 1.49 -1.18 0.00 0.00 179.01 180.27 1ncy h GLU 132 N 0.06 0.23 -0.23 1.92 4.81 -1.98 0.96 114.58 120.35 1ncy h GLU 132 Ca 0.01 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1ncy h GLU 132 Cb 0.45 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1ncy h GLU 132 CO 0.03 0.15 0.09 -0.44 -0.73 0.00 0.00 179.01 178.12 1ncy h ASP 133 N 0.24 0.31 -0.14 1.04 3.32 -1.88 0.71 116.42 120.02 1ncy h ASP 133 Ca 0.24 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1ncy h ASP 133 Cb 0.32 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1ncy h ASP 133 CO -0.31 0.39 0.02 0.40 -1.72 0.00 0.00 179.24 178.01 1ncy h ILE 134 N 0.22 1.23 -0.67 0.35 2.04 -0.85 -2.00 117.51 117.83 1ncy h ILE 134 Ca 0.08 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1ncy h ILE 134 Cb 0.17 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1ncy h ILE 134 CO -0.01 0.22 0.36 -0.33 0.00 0.00 0.00 178.15 178.39 1ncy h GLU 135 N 0.00 0.92 -0.25 2.37 5.08 -0.66 -1.09 114.58 120.95 1ncy h GLU 135 Ca 0.04 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1ncy h GLU 135 Cb 0.32 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1ncy h GLU 135 CO 0.00 0.68 0.12 -0.44 -1.00 0.00 0.00 179.01 178.37 1ncy h ASP 136 N 0.93 0.32 -0.44 1.42 3.32 -0.74 -1.19 116.42 120.04 1ncy h ASP 136 Ca 0.24 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ncy h ASP 136 Cb 0.03 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1ncy h ASP 136 CO -0.04 0.35 0.26 0.25 -1.72 0.00 0.00 179.24 178.34 1ncy h LEU 137 N 0.28 0.53 0.11 1.55 5.85 -0.86 -1.94 115.31 120.82 1ncy h LEU 137 Ca 0.09 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1ncy h LEU 137 Cb 0.11 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1ncy h LEU 137 CO -0.01 0.44 -0.30 -0.03 -0.34 0.00 0.00 178.44 178.20 1ncy h MET 138 N 0.58 -0.49 -0.77 1.25 4.05 -1.08 -0.87 114.93 117.60 1ncy h MET 138 Ca 0.16 0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.64 1ncy h MET 138 Cb 0.01 0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 30.87 1ncy h MET 138 CO -0.03 -0.33 0.49 0.87 0.23 0.00 0.00 176.91 178.14 1ncy h LYS 139 N -0.51 0.93 -0.18 0.39 1.57 -1.19 0.22 116.57 117.80 1ncy h LYS 139 Ca 0.03 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 1ncy h LYS 139 Cb 0.54 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1ncy h LYS 139 CO -0.18 0.62 -0.39 -0.44 -0.57 0.00 0.00 179.45 178.49 1ncy h ASP 140 N 0.96 0.42 0.94 0.86 3.32 -1.19 -3.26 116.42 118.47 1ncy h ASP 140 Ca 0.30 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 1ncy h ASP 140 Cb -0.00 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1ncy h ASP 140 CO -0.11 0.78 -1.14 0.28 -1.72 0.00 0.00 179.24 177.33 1ncy h SER 141 N 0.34 0.00 -0.79 6.45 0.02 -0.58 -3.43 113.55 115.57 1ncy h SER 141 Ca 0.03 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.38 1ncy h SER 141 Cb 0.84 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.31 1ncy h SER 141 CO 0.07 0.47 1.93 -0.62 -1.14 0.00 0.00 176.83 177.54 1ncy s ASP 142 N -5.88 6.43 0.42 3.07 2.15 0.01 -4.85 116.67 118.02 1ncy s ASP 142 Ca -0.01 -2.23 0.15 0.00 0.43 0.00 0.00 52.55 50.90 1ncy s ASP 142 Cb 0.08 -2.58 0.93 0.00 -0.30 0.00 0.00 42.92 41.05 1ncy s ASP 142 CO 0.79 -1.60 1.92 0.11 -0.17 0.00 0.00 175.17 176.22 1ncy h LYS 143 N 8.15 0.00 -0.61 4.34 1.79 -1.84 -2.82 116.57 125.59 1ncy h LYS 143 Ca 0.39 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 1ncy h LYS 143 Cb 0.89 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1ncy h LYS 143 CO 1.41 0.26 0.00 0.27 -1.08 0.00 0.00 179.45 180.31 1ncy n ASN 144 N -4.11 4.68 -4.15 0.86 6.94 -1.26 -4.97 115.26 113.25 1ncy n ASN 144 Ca -0.02 -2.49 -0.33 0.00 -0.02 0.00 0.00 54.58 51.72 1ncy n ASN 144 Cb 0.32 -0.56 -0.02 0.00 -2.36 0.00 0.00 39.78 37.15 1ncy n ASN 144 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1ncy n ASN 145 N 0.96 -2.68 -1.10 0.53 3.02 -1.06 -4.88 115.26 110.06 1ncy n ASN 145 Ca 0.25 -1.00 0.10 0.00 -0.03 0.00 0.00 54.58 53.90 1ncy n ASN 145 Cb 0.89 -2.88 0.23 0.00 -0.61 0.00 0.00 39.78 37.41 1ncy n ASN 145 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1ncy n ASP 146 N -2.75 3.46 0.00 6.41 5.68 -1.26 -4.95 116.55 123.14 1ncy n ASP 146 Ca -0.02 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 1ncy n ASP 146 Cb 0.54 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 1ncy n ASP 146 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ncy n GLY 147 N 1.34 0.79 3.28 6.12 0.00 -1.26 -5.03 105.19 110.43 1ncy n GLY 147 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 1ncy n GLY 147 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ncy s ARG 148 N -0.25 1.07 -0.30 1.61 1.70 -1.26 -4.28 118.95 117.24 1ncy s ARG 148 Ca 0.00 -1.22 -0.09 0.00 -0.47 0.00 0.00 55.73 53.95 1ncy s ARG 148 Cb 0.00 0.34 -0.01 0.00 -0.57 0.00 0.00 34.95 34.71 1ncy s ARG 148 CO 0.00 -0.37 0.14 0.42 -1.08 0.00 0.00 175.30 174.41 1ncy s ILE 149 N -3.98 4.59 0.77 4.99 1.01 -0.59 -4.73 121.20 123.26 1ncy s ILE 149 Ca 0.18 -0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.45 1ncy s ILE 149 Cb 0.04 -3.30 0.16 0.00 0.01 0.00 0.00 42.46 39.37 1ncy s ILE 149 CO -0.01 0.12 1.05 -0.90 0.00 0.00 0.00 174.94 175.21 1ncy n ASP 150 N 4.97 1.13 -0.17 3.58 5.68 -1.26 0.21 116.55 130.70 1ncy n ASP 150 Ca -0.14 -2.02 -0.08 0.00 -0.50 0.00 0.00 54.79 52.05 1ncy n ASP 150 Cb 0.50 -0.71 0.01 0.00 -1.14 0.00 0.00 41.12 39.78 1ncy n ASP 150 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1ncy h PHE 151 N -0.81 0.67 -0.53 2.11 3.57 -2.00 0.13 116.94 120.09 1ncy h PHE 151 Ca -0.35 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.20 1ncy h PHE 151 Cb 1.21 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 39.68 1ncy h PHE 151 CO 0.00 0.50 0.22 0.22 -2.23 0.00 0.00 178.31 177.02 1ncy h ASP 152 N 0.64 0.26 -0.61 0.41 3.58 -1.97 -1.92 116.42 116.82 1ncy h ASP 152 Ca 0.17 0.05 -0.06 0.00 0.42 0.00 0.00 57.03 57.61 1ncy h ASP 152 Cb 0.05 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 1ncy h ASP 152 CO -0.03 0.18 0.16 -0.33 -2.88 0.00 0.00 179.24 176.34 1ncy h GLU 153 N 0.42 1.00 -0.41 0.28 5.08 -1.83 -2.47 114.58 116.64 1ncy h GLU 153 Ca 0.25 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ncy h GLU 153 Cb 0.24 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1ncy h GLU 153 CO -0.23 0.88 0.27 0.35 -1.00 0.00 0.00 179.01 179.29 1ncy h PHE 154 N 0.95 0.51 -0.83 4.33 3.57 -0.19 -0.05 116.94 125.23 1ncy h PHE 154 Ca 0.20 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1ncy h PHE 154 Cb 0.33 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 1ncy h PHE 154 CO 0.02 0.32 0.46 -0.07 -2.23 0.00 0.00 178.31 176.82 1ncy h LEU 155 N 0.55 1.03 -0.42 0.59 4.07 -1.24 -0.66 115.31 119.23 1ncy h LEU 155 Ca 0.15 -0.09 -0.11 0.00 0.08 0.00 0.00 57.88 57.91 1ncy h LEU 155 Cb -0.06 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.41 1ncy h LEU 155 CO -0.03 0.83 -0.17 0.11 -1.08 0.00 0.00 178.44 178.09 1ncy h LYS 156 N 1.15 0.86 -0.37 1.13 1.57 -1.22 0.18 116.57 119.87 1ncy h LYS 156 Ca 0.29 -0.36 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1ncy h LYS 156 Cb 0.02 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1ncy h LYS 156 CO -0.05 1.00 0.03 1.98 -0.57 0.00 0.00 179.45 181.85 1ncy h MET 157 N 0.68 0.63 0.30 3.15 4.05 -0.52 -1.74 114.93 121.48 1ncy h MET 157 Ca 0.10 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.32 1ncy h MET 157 Cb 0.73 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 1ncy h MET 157 CO 0.06 0.71 -0.14 0.52 0.23 0.00 0.00 176.91 178.29 1ncy h MET 158 N 0.46 -0.38 0.00 0.39 2.86 -1.05 -3.02 114.93 114.19 1ncy h MET 158 Ca 0.11 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1ncy h MET 158 Cb 0.41 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1ncy h MET 158 CO 0.01 -0.04 0.00 0.39 1.06 0.00 0.00 176.91 178.33 1ncy n GLU 159 N -5.08 0.13 0.00 1.72 1.02 0.61 -4.86 120.64 114.18 1ncy n GLU 159 Ca -0.09 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1ncy n GLU 159 Cb 0.27 -1.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1ncy n GLU 159 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ncy n GLY 160 N -0.26 0.20 0.24 0.62 0.00 -0.65 -3.85 105.19 101.49 1ncy n GLY 160 Ca 0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1ncy n GLY 160 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ncy h VAL 161 N 0.00 0.38 0.00 1.61 2.07 -1.89 -3.47 116.25 114.95 1ncy h VAL 161 Ca 0.00 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1ncy h VAL 161 Cb 0.00 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1ncy h VAL 161 CO 0.00 0.00 0.00 1.67 0.02 0.00 0.00 177.57 179.26