#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zoy s THR 7 N 0.00 2.67 0.23 1.09 -4.23 -1.26 -4.92 115.64 109.22 1zoy s THR 7 Ca 0.00 -0.75 -0.06 0.00 -1.18 0.00 0.00 61.69 59.69 1zoy s THR 7 Cb 0.00 -2.91 0.19 0.00 1.34 0.00 0.00 72.50 71.11 1zoy s THR 7 CO 0.00 0.00 1.81 0.00 -0.54 0.00 0.00 174.62 175.89 1zoy h ALA 8 N 0.15 1.06 -0.08 3.99 0.00 -2.05 0.14 119.26 122.46 1zoy h ALA 8 Ca -0.40 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1zoy h ALA 8 Cb 1.29 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1zoy h ALA 8 CO 0.49 0.08 -0.00 -0.22 0.00 0.00 0.00 179.25 179.59 1zoy h LYS 9 N 0.75 0.15 -0.48 0.00 3.64 -1.99 -1.72 116.57 116.91 1zoy h LYS 9 Ca 0.36 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.67 1zoy h LYS 9 Cb 0.28 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1zoy h LYS 9 CO -0.22 0.43 0.24 0.93 -2.27 0.00 0.00 179.45 178.56 1zoy h GLU 10 N -0.15 0.67 -0.73 1.90 5.08 -1.84 -0.49 114.58 119.03 1zoy h GLU 10 Ca 0.02 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 1zoy h GLU 10 Cb 0.36 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1zoy h GLU 10 CO 0.01 0.51 0.21 0.93 -1.00 0.00 0.00 179.01 179.67 1zoy h GLU 11 N 0.67 1.14 -0.34 2.33 5.08 -0.53 0.07 114.58 123.00 1zoy h GLU 11 Ca 0.17 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1zoy h GLU 11 Cb 0.06 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1zoy h GLU 11 CO -0.02 0.98 0.04 0.52 -1.00 0.00 0.00 179.01 179.52 1zoy h MET 12 N 1.08 0.57 -0.43 2.33 2.86 -0.30 -1.39 114.93 119.64 1zoy h MET 12 Ca 0.23 -0.16 0.04 0.00 -2.06 0.00 0.00 59.70 57.75 1zoy h MET 12 Cb 0.32 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 1zoy h MET 12 CO -0.00 0.66 0.20 1.49 1.06 0.00 0.00 176.91 180.31 1zoy h GLU 13 N 0.39 0.39 -0.92 1.72 4.22 -0.84 -1.82 114.58 117.72 1zoy h GLU 13 Ca 0.10 -0.02 0.03 0.00 0.08 0.00 0.00 59.36 59.55 1zoy h GLU 13 Cb 0.38 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.49 1zoy h GLU 13 CO 0.01 0.26 0.60 0.00 -2.18 0.00 0.00 179.01 177.69 1zoy h ARG 14 N 0.40 1.13 -0.12 1.92 3.08 -0.78 -1.79 114.38 118.21 1zoy h ARG 14 Ca 0.19 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 60.20 1zoy h ARG 14 Cb 0.13 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1zoy h ARG 14 CO -0.16 0.75 -0.02 0.35 -1.07 0.00 0.00 179.97 179.82 1zoy h PHE 15 N 1.16 -0.04 -0.31 3.04 3.57 -0.43 -1.66 116.94 122.28 1zoy h PHE 15 Ca 0.36 0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.70 1zoy h PHE 15 Cb -0.01 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1zoy h PHE 15 CO -0.01 -0.04 -0.51 -1.49 -2.23 0.00 0.00 178.31 174.04 1zoy h TRP 16 N 0.02 1.07 -0.17 0.41 4.06 -1.24 -2.24 115.95 117.86 1zoy h TRP 16 Ca 0.06 -0.37 -0.03 0.00 2.06 0.00 0.00 58.89 60.61 1zoy h TRP 16 Cb 0.08 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.02 1zoy h TRP 16 CO -0.15 1.19 -0.05 -0.91 -3.56 0.00 0.00 178.44 174.96 1zoy h ASN 17 N 0.68 0.24 0.03 -3.49 -0.26 -1.23 -1.55 115.58 110.00 1zoy h ASN 17 Ca 0.03 -0.03 -0.15 0.00 -0.56 0.00 0.00 56.30 55.58 1zoy h ASN 17 Cb 1.11 -0.06 0.01 0.00 -1.06 0.00 0.00 38.32 38.32 1zoy h ASN 17 CO 0.11 0.32 -0.60 0.50 -1.06 0.00 0.00 177.43 176.71 1zoy h LYS 18 N 0.25 0.34 0.11 0.81 3.64 -1.19 -3.28 116.57 117.26 1zoy h LYS 18 Ca 0.06 -0.42 -0.19 0.00 -1.27 0.00 0.00 60.65 58.83 1zoy h LYS 18 Cb 0.25 0.13 0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1zoy h LYS 18 CO 0.01 1.11 -0.81 -0.91 -2.27 0.00 0.00 179.45 176.59 1zoy h ASN 19 N -0.24 0.51 -0.91 4.20 2.35 -1.29 -3.32 115.58 116.88 1zoy h ASN 19 Ca -0.08 -0.90 0.06 0.00 -0.55 0.00 0.00 56.30 54.82 1zoy h ASN 19 Cb 1.35 -0.16 -0.06 0.00 0.05 0.00 0.00 38.32 39.49 1zoy h ASN 19 CO 0.12 1.37 0.58 -0.07 -1.65 0.00 0.00 177.43 177.78 1zoy h LEU 20 N -0.26 0.93 -6.49 1.61 3.38 -1.48 -2.94 115.31 110.06 1zoy h LEU 20 Ca -0.13 0.01 -0.78 0.00 0.09 0.00 0.00 57.88 57.07 1zoy h LEU 20 Cb 1.60 -0.19 -0.20 0.00 0.09 0.00 0.00 40.66 41.96 1zoy h LEU 20 CO 0.15 0.61 1.62 0.61 0.09 0.00 0.00 178.44 181.52 1zoy n GLY 21 N -1.34 5.03 3.76 0.83 0.00 -1.24 -4.91 105.19 107.32 1zoy n GLY 21 Ca 0.13 -2.30 -0.03 0.00 0.00 0.00 0.00 46.02 43.82 1zoy n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zoy s SER 22 N -0.18 -0.14 -0.33 1.61 1.04 -1.11 -4.89 113.70 109.70 1zoy s SER 22 Ca 0.38 -0.42 0.07 0.00 0.48 0.00 0.00 55.95 56.46 1zoy s SER 22 Cb 0.10 0.47 0.66 0.00 0.10 0.00 0.00 66.02 67.34 1zoy s SER 22 CO 0.02 -0.87 1.75 -0.46 0.98 0.00 0.00 173.24 174.65 1zoy n ASN 23 N -0.56 4.32 -4.71 7.02 6.94 -1.26 -4.94 115.26 122.07 1zoy n ASN 23 Ca -0.06 -3.20 -0.42 0.00 -0.02 0.00 0.00 54.58 50.88 1zoy n ASN 23 Cb 0.61 -0.75 -0.03 0.00 -2.36 0.00 0.00 39.78 37.25 1zoy n ASN 23 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1zoy s ARG 24 N -2.81 4.50 0.31 -3.83 0.52 -1.26 -5.04 118.95 111.34 1zoy s ARG 24 Ca 0.50 1.56 -0.08 0.00 -0.52 0.00 0.00 55.73 57.19 1zoy s ARG 24 Cb 0.41 -3.42 -0.06 0.00 0.52 0.00 0.00 34.95 32.40 1zoy s ARG 24 CO 0.12 -0.14 0.62 -1.25 0.02 0.00 0.00 175.30 174.66 1zoy s PRO 25 N 1.07 3.72 -0.16 3.54 0.04 -1.26 -5.05 135.00 136.90 1zoy s PRO 25 Ca 0.55 0.21 -0.22 0.00 0.04 0.00 0.00 61.00 61.57 1zoy s PRO 25 Cb -0.24 -2.57 -0.03 0.00 0.04 0.00 0.00 34.50 31.70 1zoy s PRO 25 CO 0.28 0.16 0.67 -0.51 0.04 0.00 0.00 177.00 177.65 1zoy s LEU 26 N -3.47 4.20 0.47 -3.56 1.43 -1.26 -5.03 118.68 111.46 1zoy s LEU 26 Ca 0.47 0.98 -0.24 0.00 -1.03 0.00 0.00 54.13 54.30 1zoy s LEU 26 Cb -0.11 -2.98 -0.07 0.00 0.03 0.00 0.00 46.19 43.06 1zoy s LEU 26 CO 0.28 -0.24 1.39 -0.94 0.23 0.00 0.00 176.35 177.07 1zoy s SER 27 N 1.05 5.77 0.82 2.29 1.04 -1.26 -4.94 113.70 118.46 1zoy s SER 27 Ca 0.32 2.83 -0.13 0.00 0.48 0.00 0.00 55.95 59.45 1zoy s SER 27 Cb -0.16 -2.65 0.08 0.00 0.10 0.00 0.00 66.02 63.39 1zoy s SER 27 CO 0.13 -1.24 1.17 -0.81 0.98 0.00 0.00 173.24 173.46 1zoy n PRO 28 N -0.40 0.14 0.00 4.02 -0.04 -1.26 -5.01 135.00 132.45 1zoy n PRO 28 Ca 0.06 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1zoy n PRO 28 Cb 0.43 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 1zoy n PRO 28 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1zoy n HIS 29 N -3.34 0.00 0.01 0.54 1.44 -1.26 -4.81 115.22 107.80 1zoy n HIS 29 Ca 0.13 0.00 0.22 0.00 -2.01 0.00 0.00 57.72 56.06 1zoy n HIS 29 Cb 0.51 0.00 0.73 0.00 0.12 0.00 0.00 29.99 31.34 1zoy n HIS 29 CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 1zoy h ILE 30 N 0.00 0.50 0.00 0.61 -2.65 -1.95 0.34 117.51 114.37 1zoy h ILE 30 Ca 0.00 0.00 -0.00 0.00 1.03 0.00 0.00 64.86 65.89 1zoy h ILE 30 Cb 0.00 0.65 -0.00 0.00 -2.05 0.00 0.00 36.82 35.42 1zoy h ILE 30 CO 0.00 0.00 -0.02 0.74 0.03 0.00 0.00 178.15 178.90 1zoy h THR 31 N 0.00 0.04 0.00 0.16 2.02 -2.00 -3.35 112.91 109.77 1zoy h THR 31 Ca 0.26 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1zoy h THR 31 Cb 1.19 1.69 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1zoy h THR 31 CO -0.00 0.02 -0.92 2.30 0.37 0.00 0.00 175.52 177.29 1zoy n ILE 32 N -3.11 0.00 -2.06 3.11 -6.64 0.57 -5.05 119.36 106.19 1zoy n ILE 32 Ca 0.02 0.00 -0.41 0.00 -1.77 0.00 0.00 62.75 60.59 1zoy n ILE 32 Cb 0.39 -0.05 -0.02 0.00 -1.44 0.00 0.00 39.64 38.52 1zoy n ILE 32 CO 0.00 0.00 0.00 -0.47 -1.77 0.00 0.00 176.55 174.31 1zoy s TYR 33 N -1.86 3.02 -0.03 4.28 5.04 0.90 -4.94 117.35 123.76 1zoy s TYR 33 Ca 0.00 1.23 -0.30 0.00 -2.44 0.00 0.00 57.07 55.56 1zoy s TYR 33 Cb 0.00 -3.75 -0.05 0.00 0.35 0.00 0.00 41.96 38.51 1zoy s TYR 33 CO 0.00 -2.26 1.45 0.50 -1.34 0.00 0.00 175.55 173.89 1zoy s ARG 34 N -1.10 4.25 0.35 4.97 3.52 -1.26 -4.94 118.95 124.74 1zoy s ARG 34 Ca 0.54 1.98 -0.27 0.00 -0.13 0.00 0.00 55.73 57.85 1zoy s ARG 34 Cb -0.41 -3.69 -0.09 0.00 -1.56 0.00 0.00 34.95 29.20 1zoy s ARG 34 CO 0.49 -0.66 1.22 -1.58 -0.81 0.00 0.00 175.30 173.96 1zoy s TRP 35 N 2.91 3.13 0.12 5.12 0.52 -1.26 -5.05 118.94 124.44 1zoy s TRP 35 Ca 0.65 1.52 0.05 0.00 0.02 0.00 0.00 56.10 58.34 1zoy s TRP 35 Cb -0.31 -3.51 -0.04 0.00 -1.15 0.00 0.00 33.47 28.47 1zoy s TRP 35 CO 0.26 -1.45 -0.12 -1.54 0.02 0.00 0.00 176.95 174.12 1zoy s SER 36 N -0.81 1.80 0.14 2.95 1.04 -1.26 -5.04 113.70 112.53 1zoy s SER 36 Ca 0.52 -0.86 -0.24 0.00 0.48 0.00 0.00 55.95 55.85 1zoy s SER 36 Cb -0.35 -0.03 0.01 0.00 0.10 0.00 0.00 66.02 65.74 1zoy s SER 36 CO 0.45 -0.22 1.62 0.25 0.98 0.00 0.00 173.24 176.32 1zoy h LEU 37 N 3.34 -0.85 -0.75 2.42 5.85 -1.99 0.10 115.31 123.43 1zoy h LEU 37 Ca -0.38 0.14 0.13 0.00 0.84 0.00 0.00 57.88 58.61 1zoy h LEU 37 Cb 1.19 0.38 -0.09 0.00 0.37 0.00 0.00 40.66 42.52 1zoy h LEU 37 CO 0.54 -0.31 0.33 -0.65 -0.34 0.00 0.00 178.44 178.01 1zoy h PRO 38 N -0.30 0.49 -0.64 5.25 0.11 -1.97 0.35 132.00 135.28 1zoy h PRO 38 Ca 0.12 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.13 1zoy h PRO 38 Cb 0.49 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 1zoy h PRO 38 CO -0.37 0.32 0.12 1.98 -0.21 0.00 0.00 178.00 179.84 1zoy h MET 39 N 0.50 1.06 -0.26 1.05 4.05 -1.79 -0.59 114.93 118.94 1zoy h MET 39 Ca 0.40 -0.28 -0.05 0.00 -0.28 0.00 0.00 59.70 59.49 1zoy h MET 39 Cb 0.56 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 1zoy h MET 39 CO -0.36 0.97 -0.04 0.00 0.23 0.00 0.00 176.91 177.71 1zoy h ALA 40 N 1.04 0.36 0.00 0.39 0.00 0.55 -2.47 119.26 119.12 1zoy h ALA 40 Ca 0.20 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1zoy h ALA 40 Cb 0.42 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1zoy h ALA 40 CO 0.01 0.14 -0.02 0.52 0.00 0.00 0.00 179.25 179.90 1zoy h MET 41 N 0.25 0.00 -0.03 0.00 2.86 -0.20 -2.03 114.93 115.78 1zoy h MET 41 Ca 0.07 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.53 1zoy h MET 41 Cb 0.50 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.17 1zoy h MET 41 CO 0.02 0.02 -0.68 1.03 1.06 0.00 0.00 176.91 178.37 1zoy h SER 42 N 0.00 0.66 0.21 1.22 0.87 -0.75 -2.68 113.55 113.07 1zoy h SER 42 Ca -0.00 -0.72 -0.01 0.00 -1.23 0.00 0.00 61.79 59.83 1zoy h SER 42 Cb 0.32 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1zoy h SER 42 CO 0.00 1.28 -0.10 0.40 -0.53 0.00 0.00 176.83 177.88 1zoy h ILE 43 N 0.09 0.80 -0.74 2.23 2.04 -0.96 -2.84 117.51 118.13 1zoy h ILE 43 Ca -0.07 -0.05 0.10 0.00 1.00 0.00 0.00 64.86 65.84 1zoy h ILE 43 Cb 1.36 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 1zoy h ILE 43 CO 0.13 0.01 0.49 0.00 0.00 0.00 0.00 178.15 178.78 1zoy h HIS 45 N 0.62 0.49 0.33 0.00 6.17 -1.23 0.16 115.15 121.68 1zoy h HIS 45 Ca 0.34 0.02 -0.02 0.00 0.71 0.00 0.00 60.37 61.42 1zoy h HIS 45 Cb 0.51 -0.15 0.00 0.00 2.52 0.00 0.00 27.41 30.29 1zoy h HIS 45 CO -0.00 0.27 -0.16 0.00 0.71 0.00 0.00 177.93 178.75 1zoy h ARG 46 N 0.52 -0.43 -0.92 5.26 3.08 -1.20 -0.02 114.38 120.69 1zoy h ARG 46 Ca 0.19 0.03 0.17 0.00 0.07 0.00 0.00 59.98 60.44 1zoy h ARG 46 Cb 0.04 0.10 -0.17 0.00 0.08 0.00 0.00 29.97 30.02 1zoy h ARG 46 CO -0.10 -0.28 -0.27 0.41 -1.07 0.00 0.00 179.97 178.66 1zoy n GLY 47 N -0.83 -1.65 0.22 0.04 0.00 -0.45 0.12 105.19 102.65 1zoy n GLY 47 Ca -0.05 1.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.85 1zoy n GLY 47 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1zoy h THR 48 N 0.00 1.27 -0.91 2.61 1.35 -0.65 0.18 112.91 116.76 1zoy h THR 48 Ca 0.40 -1.07 0.05 0.00 -0.55 0.00 0.00 66.41 65.24 1zoy h THR 48 Cb 0.63 1.16 -0.06 0.00 -1.73 0.00 0.00 68.15 68.16 1zoy h THR 48 CO -0.94 0.36 0.58 1.23 -0.25 0.00 0.00 175.52 176.51 1zoy h GLY 49 N 0.55 1.35 0.76 5.82 0.00 0.16 0.45 103.07 112.16 1zoy h GLY 49 Ca 0.11 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1zoy h GLY 49 CO 0.03 0.33 -0.17 -2.22 0.00 0.00 0.00 176.54 174.51 1zoy h ILE 50 N 1.09 0.64 -0.94 2.60 2.04 0.08 -1.00 117.51 122.02 1zoy h ILE 50 Ca 0.38 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.88 1zoy h ILE 50 Cb 0.09 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 1zoy h ILE 50 CO -0.15 0.08 0.60 0.00 0.00 0.00 0.00 178.15 178.68 1zoy h ALA 51 N -0.19 1.31 -0.60 1.87 0.00 -0.29 -0.28 119.26 121.08 1zoy h ALA 51 Ca -0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1zoy h ALA 51 Cb 0.50 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1zoy h ALA 51 CO 0.08 0.37 0.21 -0.07 0.00 0.00 0.00 179.25 179.83 1zoy h LEU 52 N 1.09 0.86 -0.47 0.00 4.07 -0.03 -1.08 115.31 119.74 1zoy h LEU 52 Ca 0.41 -0.19 -0.11 0.00 0.08 0.00 0.00 57.88 58.07 1zoy h LEU 52 Cb 0.18 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 1zoy h LEU 52 CO -0.18 0.82 -0.12 0.28 -1.08 0.00 0.00 178.44 178.16 1zoy h SER 53 N 0.85 0.92 -0.40 -0.43 0.02 -0.57 -2.34 113.55 111.60 1zoy h SER 53 Ca 0.20 -0.36 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1zoy h SER 53 Cb 0.26 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1zoy h SER 53 CO -0.01 1.07 0.15 0.00 -1.14 0.00 0.00 176.83 176.90 1zoy h ALA 54 N 0.88 0.47 0.15 3.77 0.00 -0.76 -0.52 119.26 123.24 1zoy h ALA 54 Ca 0.12 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1zoy h ALA 54 Cb 0.67 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1zoy h ALA 54 CO 0.05 -0.24 -0.23 0.78 0.00 0.00 0.00 179.25 179.61 1zoy h GLY 55 N 0.32 -0.45 0.71 0.00 0.00 -1.02 0.22 103.07 102.85 1zoy h GLY 55 Ca 0.18 0.27 0.10 0.00 0.00 0.00 0.00 47.33 47.88 1zoy h GLY 55 CO -0.17 -0.21 0.58 -2.08 0.00 0.00 0.00 176.54 174.65 1zoy h VAL 56 N -0.45 0.96 -0.37 4.60 2.07 -1.08 -0.21 116.25 121.76 1zoy h VAL 56 Ca 0.02 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.09 1zoy h VAL 56 Cb 0.46 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1zoy h VAL 56 CO -0.11 0.16 -0.33 0.28 0.02 0.00 0.00 177.57 177.58 1zoy h SER 57 N 0.88 0.94 0.01 0.57 0.02 -0.62 -1.89 113.55 113.46 1zoy h SER 57 Ca 0.42 -0.46 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1zoy h SER 57 Cb 0.42 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1zoy h SER 57 CO -0.18 1.20 -0.08 -0.07 -1.14 0.00 0.00 176.83 176.56 1zoy h LEU 58 N 0.69 0.16 -0.17 5.07 4.07 0.19 0.12 115.31 125.44 1zoy h LEU 58 Ca 0.06 -0.02 -0.23 0.00 0.08 0.00 0.00 57.88 57.78 1zoy h LEU 58 Cb 0.92 -0.04 0.01 0.00 1.08 0.00 0.00 40.66 42.63 1zoy h LEU 58 CO 0.08 0.27 -0.82 0.15 -1.08 0.00 0.00 178.44 177.05 1zoy h PHE 59 N 0.17 0.98 0.02 1.13 3.57 -0.81 -2.36 116.94 119.64 1zoy h PHE 59 Ca 0.04 -0.45 -0.26 0.00 3.53 0.00 0.00 57.97 60.83 1zoy h PHE 59 Cb 0.26 -0.14 0.02 0.00 2.79 0.00 0.00 35.95 38.87 1zoy h PHE 59 CO 0.00 1.27 -1.04 0.78 -2.23 0.00 0.00 178.31 177.10 1zoy h GLY 60 N 0.67 0.66 1.14 2.40 0.00 -0.80 -2.63 103.07 104.51 1zoy h GLY 60 Ca -0.06 -1.18 -0.18 0.00 0.00 0.00 0.00 47.33 45.90 1zoy h GLY 60 CO 0.16 1.04 -0.53 1.41 0.00 0.00 0.00 176.54 178.63 1zoy h LEU 61 N 0.32 0.97 -1.20 3.11 4.07 -0.88 -2.80 115.31 118.89 1zoy h LEU 61 Ca -0.12 -0.53 0.00 0.00 0.08 0.00 0.00 57.88 57.31 1zoy h LEU 61 Cb 1.69 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 43.11 1zoy h LEU 61 CO 0.19 1.32 0.48 0.77 -1.08 0.00 0.00 178.44 180.12 1zoy h SER 62 N 0.67 0.89 0.40 -0.43 4.64 -1.50 0.55 113.55 118.76 1zoy h SER 62 Ca 0.02 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1zoy h SER 62 Cb 1.14 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1zoy h SER 62 CO 0.12 0.67 0.00 0.00 -0.87 0.00 0.00 176.83 176.75 1zoy h ALA 63 N 1.49 1.00 0.00 5.18 0.00 -1.20 -1.73 119.26 124.00 1zoy h ALA 63 Ca 0.27 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.96 1zoy h ALA 63 Cb -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1zoy h ALA 63 CO -0.05 0.00 -2.02 1.28 0.00 0.00 0.00 179.25 178.45 1zoy n LEU 64 N -2.48 0.00 -0.11 0.00 4.77 0.05 -4.79 117.00 114.44 1zoy n LEU 64 Ca -0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 1zoy n LEU 64 Cb 0.15 0.31 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 1zoy n LEU 64 CO 0.17 0.31 -1.28 0.18 -1.33 0.00 0.00 177.39 175.44 1zoy n LEU 65 N -2.48 2.11 -4.77 2.23 4.77 -0.43 -5.00 117.00 113.42 1zoy n LEU 65 Ca -0.21 0.15 -0.35 0.00 -0.03 0.00 0.00 56.01 55.57 1zoy n LEU 65 Cb 0.89 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1zoy n LEU 65 CO 0.34 0.62 0.79 -0.76 -1.33 0.00 0.00 177.39 177.05 1zoy s LEU 66 N -6.93 3.76 0.60 2.23 1.43 -0.66 -5.04 118.68 114.07 1zoy s LEU 66 Ca -0.32 2.19 -0.04 0.00 -1.03 0.00 0.00 54.13 54.93 1zoy s LEU 66 Cb 0.11 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.79 1zoy s LEU 66 CO 0.44 -1.22 0.89 -2.16 0.23 0.00 0.00 176.35 174.53 1zoy s PRO 67 N -3.26 2.69 0.00 1.29 0.04 -1.26 -4.83 135.00 129.67 1zoy s PRO 67 Ca 0.73 -0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1zoy s PRO 67 Cb -0.24 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 31.99 1zoy s PRO 67 CO 0.28 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.93 1zoy n GLY 68 N -2.58 -2.37 3.97 0.56 0.00 -1.26 -4.96 105.19 98.54 1zoy n GLY 68 Ca 0.06 -1.46 -0.24 0.00 0.00 0.00 0.00 46.02 44.38 1zoy n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zoy s ASN 69 N -3.67 4.72 0.28 1.61 4.22 -1.26 -4.93 114.94 115.91 1zoy s ASN 69 Ca 0.00 0.01 0.02 0.00 -2.14 0.00 0.00 52.86 50.74 1zoy s ASN 69 Cb 0.00 -0.61 0.59 0.00 1.28 0.00 0.00 41.25 42.52 1zoy s ASN 69 CO 0.00 -1.60 1.80 0.15 -2.04 0.00 0.00 177.10 175.41 1zoy h PHE 70 N -0.40 1.01 -0.62 1.54 3.57 -2.00 -1.33 116.94 118.72 1zoy h PHE 70 Ca -0.41 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.08 1zoy h PHE 70 Cb 1.29 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 1zoy h PHE 70 CO 0.08 0.31 0.21 0.93 -2.23 0.00 0.00 178.31 177.61 1zoy h GLU 71 N 0.81 0.95 -0.66 1.11 5.08 -1.99 0.82 114.58 120.71 1zoy h GLU 71 Ca 0.51 -0.19 0.13 0.00 -1.00 0.00 0.00 59.36 58.81 1zoy h GLU 71 Cb 0.65 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1zoy h GLU 71 CO -0.33 0.83 0.45 1.03 -1.00 0.00 0.00 179.01 179.99 1zoy h SER 72 N 0.87 0.31 0.10 1.42 0.87 -1.61 -0.39 113.55 115.12 1zoy h SER 72 Ca 0.20 0.01 -0.26 0.00 -1.23 0.00 0.00 61.79 60.51 1zoy h SER 72 Cb 0.27 -0.05 0.03 0.00 -0.44 0.00 0.00 62.40 62.20 1zoy h SER 72 CO -0.01 0.17 -1.08 0.45 -0.53 0.00 0.00 176.83 175.83 1zoy h HIS 73 N 0.33 0.89 0.59 2.24 3.86 -0.89 -2.94 115.15 119.23 1zoy h HIS 73 Ca 0.32 -0.56 -0.03 0.00 -1.16 0.00 0.00 60.37 58.94 1zoy h HIS 73 Cb 0.78 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 29.18 1zoy h HIS 73 CO -0.00 1.40 -0.28 -0.07 0.86 0.00 0.00 177.93 179.84 1zoy h LEU 74 N 0.13 -0.67 -1.70 2.43 3.38 0.14 -2.62 115.31 116.40 1zoy h LEU 74 Ca -0.16 0.02 0.32 0.00 0.09 0.00 0.00 57.88 58.15 1zoy h LEU 74 Cb 1.78 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 42.63 1zoy h LEU 74 CO 0.21 -0.37 0.78 -0.33 0.09 0.00 0.00 178.44 178.82 1zoy h GLU 75 N -1.00 0.16 -0.18 1.13 4.39 -1.28 1.94 114.58 119.74 1zoy h GLU 75 Ca -0.08 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 1zoy h GLU 75 Cb 0.61 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 1zoy h GLU 75 CO 0.13 0.11 0.09 1.25 -1.16 0.00 0.00 179.01 179.43 1zoy h LEU 76 N 0.16 0.21 0.09 1.33 5.85 -1.30 -2.44 115.31 119.21 1zoy h LEU 76 Ca 0.60 -0.01 -0.34 0.00 0.84 0.00 0.00 57.88 58.97 1zoy h LEU 76 Cb 1.99 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.94 1zoy h LEU 76 CO -0.15 0.18 -1.88 0.58 -0.34 0.00 0.00 178.44 176.83 1zoy h VAL 77 N 0.25 0.72 -0.86 1.05 2.07 0.33 -3.36 116.25 116.46 1zoy h VAL 77 Ca 0.06 -2.48 0.15 0.00 0.82 0.00 0.00 66.70 65.26 1zoy h VAL 77 Cb 0.02 2.50 -0.10 0.00 -1.52 0.00 0.00 31.29 32.19 1zoy h VAL 77 CO -0.01 0.77 0.44 0.11 0.02 0.00 0.00 177.57 178.90 1zoy h LYS 78 N 0.05 0.59 -3.19 1.57 1.57 -0.67 -1.94 116.57 114.55 1zoy h LYS 78 Ca -0.37 -0.04 -0.77 0.00 -1.87 0.00 0.00 60.65 57.60 1zoy h LYS 78 Cb 2.03 -0.13 -0.18 0.00 0.08 0.00 0.00 32.23 34.02 1zoy h LYS 78 CO 0.09 0.39 1.75 0.43 -0.57 0.00 0.00 179.45 181.55 1zoy n SER 79 N -4.88 5.87 -2.55 0.86 7.64 -0.95 -4.18 113.62 115.42 1zoy n SER 79 Ca 0.18 -3.21 -0.02 0.00 1.01 0.00 0.00 58.87 56.83 1zoy n SER 79 Cb 0.46 -1.40 0.09 0.00 -1.01 0.00 0.00 64.21 62.35 1zoy n SER 79 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1zoy n LEU 80 N 2.82 -0.64 -0.59 -3.43 0.00 -0.73 -4.94 117.00 109.50 1zoy n LEU 80 Ca 0.40 -3.05 -0.03 0.00 0.00 0.00 0.00 56.01 53.32 1zoy n LEU 80 Cb 0.34 0.17 -0.01 0.00 0.00 0.00 0.00 43.42 43.91 1zoy n LEU 80 CO 0.77 1.51 -0.03 0.00 0.00 0.00 0.00 177.39 179.63 1zoy n LEU 82 N -0.72 0.09 -4.69 0.00 4.77 -1.26 -4.86 117.00 110.34 1zoy n LEU 82 Ca -0.03 0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 1zoy n LEU 82 Cb 0.20 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 1zoy n LEU 82 CO 0.05 -0.21 0.91 -0.83 -1.33 0.00 0.00 177.39 175.99 1zoy s GLY 83 N 2.56 2.14 0.31 -0.72 0.00 -1.26 -4.90 107.32 105.45 1zoy s GLY 83 Ca 0.39 0.54 0.07 0.00 0.00 0.00 0.00 44.72 45.72 1zoy s GLY 83 CO 0.14 2.14 1.66 -2.55 0.00 0.00 0.00 173.10 174.49 1zoy h PRO 84 N 7.39 0.27 -1.96 2.90 0.11 -1.99 0.21 132.00 138.91 1zoy h PRO 84 Ca -0.33 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.52 1zoy h PRO 84 Cb 1.15 -0.06 -0.09 0.00 0.11 0.00 0.00 31.00 32.11 1zoy h PRO 84 CO 0.88 0.18 -0.07 2.41 -0.21 0.00 0.00 178.00 181.18 1zoy n THR 85 N -5.14 2.92 0.00 -1.15 -1.04 -1.26 -2.34 114.28 106.26 1zoy n THR 85 Ca 0.25 -1.74 0.00 0.00 -2.04 0.00 0.00 64.05 60.53 1zoy n THR 85 Cb 0.79 -1.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.53 1zoy n THR 85 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1zoy n LEU 86 N 1.78 0.00 0.05 -4.42 7.94 0.58 -4.71 117.00 118.21 1zoy n LEU 86 Ca 0.37 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 55.24 1zoy n LEU 86 Cb 0.74 0.00 0.22 0.00 0.53 0.00 0.00 43.42 44.91 1zoy n LEU 86 CO 0.18 0.00 0.71 -0.29 -1.11 0.00 0.00 177.39 176.87 1zoy h ILE 87 N 0.00 1.27 -0.05 1.96 6.09 -0.86 0.39 117.51 126.32 1zoy h ILE 87 Ca 0.00 -1.33 -0.24 0.00 -1.37 0.00 0.00 64.86 61.92 1zoy h ILE 87 Cb 0.00 1.46 0.01 0.00 0.47 0.00 0.00 36.82 38.76 1zoy h ILE 87 CO 0.00 0.41 -0.92 0.22 -3.07 0.00 0.00 178.15 174.79 1zoy h TYR 88 N 0.34 0.88 0.82 2.19 5.03 -1.73 -1.64 116.97 122.88 1zoy h TYR 88 Ca 0.05 -0.45 -0.04 0.00 2.58 0.00 0.00 58.73 60.87 1zoy h TYR 88 Cb 0.71 -0.11 0.01 0.00 1.55 0.00 0.00 36.73 38.88 1zoy h TYR 88 CO 0.02 1.27 -0.41 1.15 -1.32 0.00 0.00 178.16 178.87 1zoy h THR 89 N 0.38 0.16 -0.74 1.81 2.02 -1.70 0.20 112.91 115.04 1zoy h THR 89 Ca -0.09 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.16 1zoy h THR 89 Cb 1.55 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 68.08 1zoy h THR 89 CO 0.17 0.00 0.49 0.00 0.37 0.00 0.00 175.52 176.55 1zoy h ALA 90 N -0.95 1.69 -0.06 6.16 0.00 -1.01 0.12 119.26 125.21 1zoy h ALA 90 Ca -0.11 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1zoy h ALA 90 Cb 0.87 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1zoy h ALA 90 CO 0.18 0.19 -0.39 -0.22 0.00 0.00 0.00 179.25 179.01 1zoy h LYS 91 N 0.78 0.12 -0.01 0.00 3.64 -0.96 -2.89 116.57 117.25 1zoy h LYS 91 Ca 0.32 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.62 1zoy h LYS 91 Cb 0.26 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1zoy h LYS 91 CO -0.11 0.49 -0.11 0.35 -2.27 0.00 0.00 179.45 177.80 1zoy h PHE 92 N 0.10 0.13 -0.63 1.91 3.57 0.60 -2.70 116.94 119.92 1zoy h PHE 92 Ca 0.01 -0.06 0.18 0.00 3.53 0.00 0.00 57.97 61.63 1zoy h PHE 92 Cb 0.73 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.43 1zoy h PHE 92 CO 0.01 0.80 0.51 0.78 -2.23 0.00 0.00 178.31 178.17 1zoy h GLY 93 N -0.56 0.00 1.13 2.40 0.00 -0.97 0.54 103.07 105.61 1zoy h GLY 93 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 46.99 1zoy h GLY 93 CO 0.02 0.00 -1.60 -2.22 0.00 0.00 0.00 176.54 172.74 1zoy h ILE 94 N 0.00 1.10 0.00 2.60 1.08 -1.51 -3.34 117.51 117.44 1zoy h ILE 94 Ca 0.30 -2.69 -0.15 0.00 -0.39 0.00 0.00 64.86 61.94 1zoy h ILE 94 Cb 1.32 2.80 -0.02 0.00 -3.07 0.00 0.00 36.82 37.85 1zoy h ILE 94 CO -0.00 0.83 -0.71 0.58 -0.69 0.00 0.00 178.15 178.16 1zoy h VAL 95 N 0.09 1.48 0.49 1.67 2.07 -0.66 -3.29 116.25 118.10 1zoy h VAL 95 Ca -0.28 -2.44 -0.02 0.00 0.82 0.00 0.00 66.70 64.77 1zoy h VAL 95 Cb 2.07 2.33 -0.00 0.00 -1.52 0.00 0.00 31.29 34.16 1zoy h VAL 95 CO 0.18 0.69 -0.29 0.15 0.02 0.00 0.00 177.57 178.33 1zoy h PHE 96 N 0.00 -0.76 -0.50 1.57 3.57 -0.14 -1.15 116.94 119.53 1zoy h PHE 96 Ca -0.01 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.50 1zoy h PHE 96 Cb 1.27 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 40.25 1zoy h PHE 96 CO 0.00 -0.43 0.33 -1.00 -2.23 0.00 0.00 178.31 174.98 1zoy h PRO 97 N -0.72 0.62 -0.05 6.41 0.13 -1.72 -0.92 132.00 135.75 1zoy h PRO 97 Ca -0.07 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1zoy h PRO 97 Cb 0.57 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.56 1zoy h PRO 97 CO 0.08 0.41 0.01 1.25 -0.23 0.00 0.00 178.00 179.52 1zoy h LEU 98 N 0.63 0.07 -0.02 1.56 7.12 -1.61 -1.39 115.31 121.67 1zoy h LEU 98 Ca 0.19 -0.21 -0.00 0.00 0.13 0.00 0.00 57.88 57.99 1zoy h LEU 98 Cb -0.00 -0.02 -0.00 0.00 -0.53 0.00 0.00 40.66 40.11 1zoy h LEU 98 CO -0.05 0.26 0.01 0.24 -0.13 0.00 0.00 178.44 178.78 1zoy h MET 99 N -0.13 0.03 -0.03 1.25 2.86 -0.89 0.17 114.93 118.20 1zoy h MET 99 Ca 0.02 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1zoy h MET 99 Cb 0.22 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.82 1zoy h MET 99 CO -0.00 0.18 -0.41 -0.92 1.06 0.00 0.00 176.91 176.82 1zoy h TYR 100 N -0.12 -1.15 -0.88 -0.22 3.20 -1.18 0.15 116.97 116.77 1zoy h TYR 100 Ca 0.01 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.97 1zoy h TYR 100 Cb 0.16 0.51 -0.05 0.00 1.54 0.00 0.00 36.73 38.89 1zoy h TYR 100 CO -0.02 -0.48 0.57 1.25 -1.64 0.00 0.00 178.16 177.84 1zoy h HIS 101 N -0.55 1.02 0.25 -3.82 2.76 -1.18 -0.43 115.15 113.20 1zoy h HIS 101 Ca 0.05 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1zoy h HIS 101 Cb 0.64 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.26 1zoy h HIS 101 CO -0.43 0.56 -0.12 1.15 -1.30 0.00 0.00 177.93 177.79 1zoy h THR 102 N 1.03 0.80 -0.24 6.26 2.02 0.71 -0.04 112.91 123.45 1zoy h THR 102 Ca 0.37 -0.33 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 1zoy h THR 102 Cb 0.14 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1zoy h THR 102 CO -0.13 0.07 0.03 -0.50 0.37 0.00 0.00 175.52 175.36 1zoy h TRP 103 N -0.51 0.44 -0.45 3.16 4.06 -0.54 -1.89 115.95 120.23 1zoy h TRP 103 Ca -0.03 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 60.84 1zoy h TRP 103 Cb 0.38 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.40 1zoy h TRP 103 CO -0.01 0.55 0.24 -0.97 -3.56 0.00 0.00 178.44 174.68 1zoy h ASN 104 N 0.20 0.54 -0.76 -3.49 -0.00 -1.14 -1.10 115.58 109.83 1zoy h ASN 104 Ca 0.07 -0.04 -0.04 0.00 -0.00 0.00 0.00 56.30 56.30 1zoy h ASN 104 Cb 0.35 -0.14 -0.03 0.00 -0.00 0.00 0.00 38.32 38.50 1zoy h ASN 104 CO 0.01 0.45 0.33 1.23 -0.00 0.00 0.00 177.43 179.45 1zoy h GLY 105 N 0.70 1.21 1.02 1.57 0.00 -0.64 0.22 103.07 107.15 1zoy h GLY 105 Ca 0.16 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 1zoy h GLY 105 CO -0.03 0.60 0.42 -2.22 0.00 0.00 0.00 176.54 175.31 1zoy h ILE 106 N 1.09 1.24 -0.18 2.60 2.04 -0.43 0.37 117.51 124.25 1zoy h ILE 106 Ca 0.26 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1zoy h ILE 106 Cb 0.17 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1zoy h ILE 106 CO -0.03 0.28 0.11 -0.09 0.00 0.00 0.00 178.15 178.43 1zoy h ARG 107 N 1.13 0.23 -0.77 2.37 2.43 -0.37 -1.06 114.38 118.33 1zoy h ARG 107 Ca 0.28 -0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.53 1zoy h ARG 107 Cb 0.06 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.49 1zoy h ARG 107 CO -0.04 0.15 0.42 0.45 -1.51 0.00 0.00 179.97 179.43 1zoy h HIS 108 N 0.23 0.75 -0.54 2.20 3.86 0.18 -1.39 115.15 120.44 1zoy h HIS 108 Ca 0.07 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1zoy h HIS 108 Cb -0.02 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.20 1zoy h HIS 108 CO -0.07 0.29 0.28 -0.07 0.86 0.00 0.00 177.93 179.22 1zoy h LEU 109 N 0.69 0.69 -0.99 2.43 3.38 -0.21 -2.19 115.31 119.12 1zoy h LEU 109 Ca 0.38 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.28 1zoy h LEU 109 Cb 0.38 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1zoy h LEU 109 CO -0.26 0.61 0.65 0.40 0.09 0.00 0.00 178.44 179.92 1zoy h ILE 110 N 0.73 1.15 -0.92 1.22 2.04 -0.22 -1.21 117.51 120.30 1zoy h ILE 110 Ca 0.19 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1zoy h ILE 110 Cb 0.08 -0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 35.92 1zoy h ILE 110 CO -0.03 0.23 0.53 -0.50 0.00 0.00 0.00 178.15 178.38 1zoy h TRP 111 N 1.24 1.24 0.00 1.37 6.55 -0.86 -1.36 115.95 124.12 1zoy h TRP 111 Ca 0.40 -0.02 -0.01 0.00 0.95 0.00 0.00 58.89 60.22 1zoy h TRP 111 Cb 0.04 -0.40 -0.00 0.00 -0.86 0.00 0.00 29.16 27.94 1zoy h TRP 111 CO -0.00 0.84 -0.04 -0.44 -1.05 0.00 0.00 178.44 177.74 1zoy h ASP 112 N 1.28 0.00 0.77 -3.49 3.45 -0.62 1.20 116.42 119.01 1zoy h ASP 112 Ca 0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.79 1zoy h ASP 112 Cb -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 1zoy h ASP 112 CO -0.06 0.04 0.00 0.18 -1.57 0.00 0.00 179.24 177.84 1zoy n LEU 113 N -3.77 0.00 0.00 1.55 4.32 -0.54 -4.88 117.00 113.67 1zoy n LEU 113 Ca -0.03 0.42 0.00 0.00 -0.02 0.00 0.00 56.01 56.38 1zoy n LEU 113 Cb 0.14 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.52 1zoy n LEU 113 CO 0.28 -0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.03 1zoy n GLY 114 N 1.21 0.60 3.82 -0.72 0.00 0.41 -5.07 105.19 105.44 1zoy n GLY 114 Ca 0.09 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 1zoy n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zoy s LYS 115 N -1.15 2.96 -1.40 1.61 1.02 -1.07 -4.58 119.74 117.14 1zoy s LYS 115 Ca 0.00 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.13 1zoy s LYS 115 Cb 0.00 -2.67 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 1zoy s LYS 115 CO 0.00 0.48 0.00 0.41 -0.92 0.00 0.00 175.35 175.32 1zoy n GLY 116 N -0.45 1.37 2.90 -3.33 0.00 -1.26 -3.93 105.19 100.48 1zoy n GLY 116 Ca -0.08 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 1zoy n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1zoy n LEU 117 N -1.50 6.65 -3.92 0.99 4.77 -1.26 -4.07 117.00 118.66 1zoy n LEU 117 Ca -0.13 -4.90 -0.10 0.00 -0.03 0.00 0.00 56.01 50.85 1zoy n LEU 117 Cb 0.47 -1.38 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 1zoy n LEU 117 CO 0.20 1.55 -0.24 0.42 -1.33 0.00 0.00 177.39 177.99 1zoy s THR 118 N -1.06 0.10 0.13 -5.08 -4.23 -1.26 -5.03 115.64 99.21 1zoy s THR 118 Ca 0.37 -0.82 -0.23 0.00 -1.18 0.00 0.00 61.69 59.83 1zoy s THR 118 Cb 0.08 -0.43 -0.03 0.00 1.34 0.00 0.00 72.50 73.46 1zoy s THR 118 CO 0.04 -0.45 1.67 0.40 -0.54 0.00 0.00 174.62 175.73 1zoy h ILE 119 N 4.32 0.58 0.13 2.99 1.08 -1.99 0.29 117.51 124.92 1zoy h ILE 119 Ca -0.31 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.17 1zoy h ILE 119 Cb 1.20 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 35.49 1zoy h ILE 119 CO 0.42 0.00 -0.35 1.55 -0.69 0.00 0.00 178.15 179.08 1zoy h PRO 120 N -0.22 -0.57 -0.39 2.37 0.13 -1.97 -1.47 132.00 129.89 1zoy h PRO 120 Ca 0.08 0.04 0.07 0.00 -0.87 0.00 0.00 66.00 65.32 1zoy h PRO 120 Cb 0.34 0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 1zoy h PRO 120 CO -0.22 -0.38 0.27 1.96 -0.23 0.00 0.00 178.00 179.40 1zoy h GLN 121 N -0.59 0.22 0.27 0.86 4.20 -1.80 -2.83 115.11 115.45 1zoy h GLN 121 Ca 0.03 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1zoy h GLN 121 Cb 0.61 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1zoy h GLN 121 CO -0.20 0.15 -0.13 1.25 -0.67 0.00 0.00 178.83 179.23 1zoy h LEU 122 N 0.23 -0.31 -0.78 1.46 5.85 0.63 -2.47 115.31 119.91 1zoy h LEU 122 Ca 0.18 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1zoy h LEU 122 Cb 0.40 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1zoy h LEU 122 CO -0.03 -0.16 0.43 0.74 -0.34 0.00 0.00 178.44 179.07 1zoy h THR 123 N -0.43 1.23 0.46 1.05 2.02 -1.20 -1.78 112.91 114.26 1zoy h THR 123 Ca -0.04 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 1zoy h THR 123 Cb 0.33 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1zoy h THR 123 CO 0.06 0.26 -0.51 1.56 0.37 0.00 0.00 175.52 177.26 1zoy h GLN 124 N 1.08 -0.95 -0.99 6.66 4.20 -1.44 -1.42 115.11 122.25 1zoy h GLN 124 Ca 0.28 0.06 0.13 0.00 0.06 0.00 0.00 58.65 59.18 1zoy h GLN 124 Cb 0.03 0.22 -0.09 0.00 0.30 0.00 0.00 27.48 27.94 1zoy h GLN 124 CO -0.04 -0.63 0.62 0.66 -0.67 0.00 0.00 178.83 178.76 1zoy h SER 125 N -0.99 0.86 -0.17 1.46 4.64 -1.33 -0.36 113.55 117.67 1zoy h SER 125 Ca -0.06 0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1zoy h SER 125 Cb 0.87 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.83 1zoy h SER 125 CO -0.09 0.43 0.09 1.23 -0.87 0.00 0.00 176.83 177.63 1zoy h GLY 126 N 0.91 0.22 0.99 -0.77 0.00 -0.93 0.32 103.07 103.82 1zoy h GLY 126 Ca 0.50 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.76 1zoy h GLY 126 CO -0.27 0.06 -0.01 -2.08 0.00 0.00 0.00 176.54 174.24 1zoy h VAL 127 N 0.19 0.98 0.18 4.60 2.07 -0.24 -0.73 116.25 123.30 1zoy h VAL 127 Ca 0.07 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1zoy h VAL 127 Cb 0.00 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1zoy h VAL 127 CO -0.04 0.01 -0.52 0.58 0.02 0.00 0.00 177.57 177.62 1zoy h VAL 128 N -0.04 0.00 -1.01 2.57 2.07 -0.79 -0.08 116.25 118.98 1zoy h VAL 128 Ca -0.00 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.75 1zoy h VAL 128 Cb 0.03 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.68 1zoy h VAL 128 CO 0.01 0.00 0.60 0.58 0.02 0.00 0.00 177.57 178.78 1zoy h VAL 129 N -0.78 0.59 -0.52 2.57 2.07 -0.23 0.16 116.25 120.10 1zoy h VAL 129 Ca -0.02 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 1zoy h VAL 129 Cb 0.76 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1zoy h VAL 129 CO -0.25 0.12 0.04 0.25 0.02 0.00 0.00 177.57 177.75 1zoy h LEU 130 N 0.63 0.87 -0.14 2.57 5.85 -0.18 -1.84 115.31 123.07 1zoy h LEU 130 Ca 0.63 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 59.03 1zoy h LEU 130 Cb 1.14 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.93 1zoy h LEU 130 CO -0.45 0.94 -0.01 0.40 -0.34 0.00 0.00 178.44 178.98 1zoy h ILE 131 N 0.77 1.27 -0.71 4.05 1.08 0.10 -2.74 117.51 121.34 1zoy h ILE 131 Ca 0.15 -0.90 0.04 0.00 -0.39 0.00 0.00 64.86 63.77 1zoy h ILE 131 Cb 0.47 1.59 -0.04 0.00 -3.07 0.00 0.00 36.82 35.77 1zoy h ILE 131 CO 0.02 0.26 0.47 -0.07 -0.69 0.00 0.00 178.15 178.14 1zoy h LEU 132 N -0.03 0.70 0.33 1.44 3.38 -0.84 -1.60 115.31 118.69 1zoy h LEU 132 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1zoy h LEU 132 Cb 0.41 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1zoy h LEU 132 CO 0.01 0.47 -0.24 0.74 0.09 0.00 0.00 178.44 179.51 1zoy h THR 133 N 0.81 0.00 -0.51 0.22 2.02 -1.12 -0.43 112.91 113.90 1zoy h THR 133 Ca 0.29 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.57 1zoy h THR 133 Cb 0.14 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.44 1zoy h THR 133 CO -0.09 0.00 -0.26 0.58 0.37 0.00 0.00 175.52 176.12 1zoy h VAL 134 N -0.55 0.28 0.36 3.16 2.07 -1.24 0.11 116.25 120.44 1zoy h VAL 134 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1zoy h VAL 134 Cb 0.45 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1zoy h VAL 134 CO 0.02 0.00 -0.45 -0.07 0.02 0.00 0.00 177.57 177.09 1zoy h LEU 135 N -0.14 -1.24 -2.23 2.57 3.38 -1.20 -1.31 115.31 115.13 1zoy h LEU 135 Ca 0.23 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 1zoy h LEU 135 Cb 0.51 0.43 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 1zoy h LEU 135 CO -0.60 -0.58 -0.05 0.77 0.09 0.00 0.00 178.44 178.08 1zoy h SER 136 N -0.84 0.00 0.28 -0.43 4.64 -0.75 0.11 113.55 116.57 1zoy h SER 136 Ca -0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1zoy h SER 136 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1zoy h SER 136 CO -0.11 0.05 -0.14 0.28 -0.87 0.00 0.00 176.83 176.03 1zoy h SER 137 N 0.00 -0.32 -1.00 4.97 0.02 -0.48 -0.98 113.55 115.75 1zoy h SER 137 Ca -0.00 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 60.98 1zoy h SER 137 Cb 0.11 0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 1zoy h SER 137 CO 0.01 0.15 0.65 0.58 -1.14 0.00 0.00 176.83 177.07 1zoy h VAL 138 N -1.08 1.07 0.42 2.27 2.07 -1.19 0.97 116.25 120.78 1zoy h VAL 138 Ca -0.04 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1zoy h VAL 138 Cb 0.35 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 1zoy h VAL 138 CO 0.06 0.21 -0.41 1.23 0.02 0.00 0.00 177.57 178.68 1zoy h GLY 139 N 1.16 -0.99 1.82 2.17 0.00 -0.81 -2.83 103.07 103.58 1zoy h GLY 139 Ca 0.44 0.48 -0.05 0.00 0.00 0.00 0.00 47.33 48.20 1zoy h GLY 139 CO -0.18 -0.33 -0.12 1.41 0.00 0.00 0.00 176.54 177.32 1zoy h LEU 140 N -0.85 0.21 0.00 3.11 3.38 -0.67 -2.44 115.31 118.06 1zoy h LEU 140 Ca -0.04 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1zoy h LEU 140 Cb 0.75 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1zoy h LEU 140 CO -0.06 0.35 0.00 0.00 0.09 0.00 0.00 178.44 178.82 1zoy n ALA 141 N -2.49 1.96 -2.43 1.53 0.00 0.29 -1.98 120.51 117.38 1zoy n ALA 141 Ca -0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.34 1zoy n ALA 141 Cb 0.26 -1.17 0.06 0.00 0.00 0.00 0.00 19.45 18.59 1zoy n ALA 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zoy n ALA 142 N -0.91 3.12 0.21 0.00 0.00 -0.92 -4.92 120.51 117.09 1zoy n ALA 142 Ca 0.08 -2.91 0.03 0.00 0.00 0.00 0.00 53.44 50.63 1zoy n ALA 142 Cb 0.04 -0.67 0.02 0.00 0.00 0.00 0.00 19.45 18.84 1zoy n ALA 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17