#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1faz s PRO 2 N 0.00 1.96 0.51 0.00 0.02 -1.26 -4.89 135.00 131.34 1faz s PRO 2 Ca 0.00 1.84 0.19 0.00 0.02 0.00 0.00 61.00 63.04 1faz s PRO 2 Cb 0.00 -1.80 1.28 0.00 0.02 0.00 0.00 34.50 34.00 1faz s PRO 2 CO 0.00 -1.99 2.08 0.00 -0.33 0.00 0.00 177.00 176.76 1faz h ALA 3 N -0.43 2.17 -0.39 -1.55 0.00 -2.04 -2.46 119.26 114.56 1faz h ALA 3 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1faz h ALA 3 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1faz h ALA 3 CO 0.49 -0.23 0.00 -0.40 0.00 0.00 0.00 179.25 179.10 1faz n ASP 4 N -4.48 2.80 -0.21 0.00 5.75 -1.26 -4.48 116.55 114.67 1faz n ASP 4 Ca 0.03 -2.20 -0.00 0.00 -0.01 0.00 0.00 54.79 52.60 1faz n ASP 4 Cb 0.29 -0.41 0.11 0.00 -1.03 0.00 0.00 41.12 40.09 1faz n ASP 4 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 1faz h LYS 5 N 2.39 0.48 -0.73 0.11 3.64 -1.80 -0.56 116.57 120.10 1faz h LYS 5 Ca 0.00 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1faz h LYS 5 Cb 0.86 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 1faz h LYS 5 CO 0.11 0.32 0.48 -1.35 -2.27 0.00 0.00 179.45 176.74 1faz h PRO 6 N 0.50 0.91 -0.19 1.90 0.11 -1.85 0.27 132.00 133.64 1faz h PRO 6 Ca 0.31 -0.05 -0.18 0.00 0.11 0.00 0.00 66.00 66.18 1faz h PRO 6 Cb 0.33 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 1faz h PRO 6 CO -0.27 0.60 -0.62 1.96 -0.21 0.00 0.00 178.00 179.46 1faz h GLN 7 N 0.94 0.68 -0.51 1.05 7.50 -1.71 -1.94 115.11 121.12 1faz h GLN 7 Ca 0.28 -0.47 -0.08 0.00 0.50 0.00 0.00 58.65 58.88 1faz h GLN 7 Cb -0.03 0.07 -0.02 0.00 0.05 0.00 0.00 27.48 27.55 1faz h GLN 7 CO -0.07 1.09 -0.01 0.28 -1.50 0.00 0.00 178.83 178.62 1faz h VAL 8 N 0.50 1.26 -0.67 -0.54 2.07 -0.59 -0.92 116.25 117.36 1faz h VAL 8 Ca -0.01 -1.10 -0.06 0.00 0.82 0.00 0.00 66.70 66.36 1faz h VAL 8 Cb 1.21 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 1faz h VAL 8 CO 0.12 0.39 0.19 0.25 0.02 0.00 0.00 177.57 178.55 1faz h LEU 9 N 0.77 0.97 -0.47 2.57 5.85 -0.89 -1.87 115.31 122.25 1faz h LEU 9 Ca 0.14 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1faz h LEU 9 Cb 0.53 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1faz h LEU 9 CO 0.03 0.92 0.07 0.00 -0.34 0.00 0.00 178.44 179.12 1faz h ALA 10 N 1.21 0.62 0.00 1.25 0.00 -1.15 -2.90 119.26 118.29 1faz h ALA 10 Ca 0.22 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1faz h ALA 10 Cb 0.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1faz h ALA 10 CO -0.01 0.35 -0.10 0.77 0.00 0.00 0.00 179.25 180.27 1faz h SER 11 N 0.64 0.00 0.48 0.00 0.02 -0.68 -1.89 113.55 112.12 1faz h SER 11 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1faz h SER 11 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1faz h SER 11 CO 0.01 0.10 -0.27 0.49 -1.14 0.00 0.00 176.83 176.02 1faz n PHE 12 N -4.23 0.00 -1.94 3.45 0.99 -0.75 -4.29 117.46 110.70 1faz n PHE 12 Ca -0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.38 1faz n PHE 12 Cb 0.18 -0.24 0.11 0.00 -1.00 0.00 0.00 39.48 38.53 1faz n PHE 12 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1faz n THR 13 N -1.16 1.97 -3.25 4.37 -2.24 -0.71 -4.75 114.28 108.50 1faz n THR 13 Ca 0.10 -3.25 -0.22 0.00 -2.27 0.00 0.00 64.05 58.40 1faz n THR 13 Cb 0.32 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 1faz n THR 13 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1faz s GLN 14 N -3.00 3.20 0.20 -0.78 -1.52 -1.22 -4.62 119.66 111.92 1faz s GLN 14 Ca 0.41 -0.57 0.26 0.00 -1.95 0.00 0.00 55.36 53.50 1faz s GLN 14 Cb 0.38 -2.66 0.87 0.00 -0.22 0.00 0.00 33.01 31.38 1faz s GLN 14 CO -0.05 -0.05 1.77 0.25 -0.25 0.00 0.00 175.29 176.96 1faz n THR 15 N -1.87 0.61 -1.56 -0.19 -2.24 -1.26 -4.58 114.28 103.19 1faz n THR 15 Ca -0.01 -0.16 -0.33 0.00 -2.27 0.00 0.00 64.05 61.28 1faz n THR 15 Cb 0.57 -0.70 0.07 0.00 -2.10 0.00 0.00 70.33 68.17 1faz n THR 15 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1faz s SER 16 N -4.36 4.66 0.32 3.42 1.04 -1.26 -4.81 113.70 112.71 1faz s SER 16 Ca 0.10 2.10 0.03 0.00 0.48 0.00 0.00 55.95 58.65 1faz s SER 16 Cb 0.12 -2.56 0.54 0.00 0.10 0.00 0.00 66.02 64.22 1faz s SER 16 CO 0.55 -1.93 1.84 0.00 0.98 0.00 0.00 173.24 174.67 1faz h ALA 17 N -0.28 1.30 -0.31 5.32 0.00 -1.99 -2.44 119.26 120.86 1faz h ALA 17 Ca -0.46 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.15 1faz h ALA 17 Cb 1.26 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1faz h ALA 17 CO 0.52 0.47 -0.10 0.66 0.00 0.00 0.00 179.25 180.80 1faz h SER 18 N 0.54 0.51 -0.30 0.00 4.64 -1.96 0.13 113.55 117.11 1faz h SER 18 Ca 0.11 -0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 1faz h SER 18 Cb 0.38 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1faz h SER 18 CO 0.01 0.65 -0.28 -1.28 -0.87 0.00 0.00 176.83 175.06 1faz h SER 19 N 0.49 0.76 -0.65 4.97 0.87 -1.72 -1.29 113.55 116.98 1faz h SER 19 Ca 0.09 -0.47 -0.05 0.00 -1.23 0.00 0.00 61.79 60.14 1faz h SER 19 Cb 0.47 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 1faz h SER 19 CO 0.03 1.06 0.20 -0.61 -0.53 0.00 0.00 176.83 176.99 1faz h GLN 20 N 0.46 1.01 -0.58 2.24 4.15 -1.13 -1.12 115.11 120.13 1faz h GLN 20 Ca 0.05 -0.22 -0.06 0.00 0.77 0.00 0.00 58.65 59.19 1faz h GLN 20 Cb 0.84 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.36 1faz h GLN 20 CO 0.07 0.88 0.12 -0.91 -1.93 0.00 0.00 178.83 177.06 1faz h ASN 21 N 0.94 0.87 -0.38 -0.69 2.35 -0.88 0.74 115.58 118.52 1faz h ASN 21 Ca 0.21 -0.17 -0.08 0.00 -0.55 0.00 0.00 56.30 55.71 1faz h ASN 21 Cb 0.29 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1faz h ASN 21 CO -0.01 0.86 -0.06 0.00 -1.65 0.00 0.00 177.43 176.57 1faz h ALA 22 N 1.25 0.52 -0.58 -0.83 0.00 -1.02 -2.48 119.26 116.12 1faz h ALA 22 Ca 0.19 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1faz h ALA 22 Cb 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1faz h ALA 22 CO 0.00 0.36 -0.05 2.35 0.00 0.00 0.00 179.25 181.91 1faz h TRP 23 N 0.53 1.16 -0.92 0.00 7.01 -0.78 -2.27 115.95 120.68 1faz h TRP 23 Ca 0.10 -0.22 -0.01 0.00 2.11 0.00 0.00 58.89 60.87 1faz h TRP 23 Cb 0.57 -0.29 -0.04 0.00 -2.10 0.00 0.00 29.16 27.29 1faz h TRP 23 CO 0.05 1.04 0.53 -0.07 -2.79 0.00 0.00 178.44 177.20 1faz h LEU 24 N 0.95 1.13 -0.57 0.65 3.38 -0.78 0.21 115.31 120.27 1faz h LEU 24 Ca 0.16 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 1faz h LEU 24 Cb 0.61 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1faz h LEU 24 CO 0.04 0.88 -0.07 0.00 0.09 0.00 0.00 178.44 179.38 1faz h ALA 25 N 1.31 0.78 -0.55 1.53 0.00 -1.26 -2.34 119.26 118.73 1faz h ALA 25 Ca 0.33 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1faz h ALA 25 Cb -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1faz h ALA 25 CO -0.06 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 179.84 1faz h ALA 26 N 0.95 0.74 -0.56 0.00 0.00 -0.80 -2.20 119.26 117.39 1faz h ALA 26 Ca 0.15 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.78 1faz h ALA 26 Cb 0.64 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1faz h ALA 26 CO 0.04 0.59 0.37 -0.97 0.00 0.00 0.00 179.25 179.28 1faz h ASN 27 N 0.87 0.55 1.44 0.00 -1.24 -0.42 0.91 115.58 117.70 1faz h ASN 27 Ca 0.15 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.15 1faz h ASN 27 Cb 0.58 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.50 1faz h ASN 27 CO 0.03 0.38 -0.07 0.03 -1.29 0.00 0.00 177.43 176.52 1faz h ARG 28 N 0.65 0.00 -1.11 6.67 3.08 -1.12 -3.32 114.38 119.23 1faz h ARG 28 Ca 0.22 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.83 1faz h ARG 28 Cb 0.09 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.73 1faz h ARG 28 CO -0.06 0.00 -1.00 0.09 -1.07 0.00 0.00 179.97 177.94 1faz n ASN 29 N -2.30 2.88 -0.35 7.04 3.02 -0.22 -4.93 115.26 120.39 1faz n ASN 29 Ca 0.05 -3.08 0.11 0.00 -0.03 0.00 0.00 54.58 51.63 1faz n ASN 29 Cb 0.44 -0.49 0.30 0.00 -0.61 0.00 0.00 39.78 39.42 1faz n ASN 29 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1faz h GLN 30 N 2.75 0.83 -0.05 3.52 4.20 -1.00 -1.27 115.11 124.08 1faz h GLN 30 Ca 0.07 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.74 1faz h GLN 30 Cb 1.12 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.71 1faz h GLN 30 CO 0.61 0.55 0.04 0.66 -0.67 0.00 0.00 178.83 180.02 1faz h SER 31 N 0.85 0.03 0.69 1.46 4.64 -1.92 0.29 113.55 119.60 1faz h SER 31 Ca 0.53 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1faz h SER 31 Cb 0.71 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1faz h SER 31 CO -0.31 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.67 1faz h ALA 32 N 1.97 1.00 -0.39 5.18 0.00 -1.59 -2.46 119.26 122.97 1faz h ALA 32 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1faz h ALA 32 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1faz h ALA 32 CO -0.00 0.00 0.00 0.91 0.00 0.00 0.00 179.25 180.16 1faz n TRP 33 N -2.45 0.81 -0.26 0.00 7.02 0.08 -4.69 117.44 117.95 1faz n TRP 33 Ca 0.01 -0.64 0.17 0.00 -1.02 0.00 0.00 57.50 56.03 1faz n TRP 33 Cb 0.22 -0.15 0.47 0.00 -2.42 0.00 0.00 31.31 29.43 1faz n TRP 33 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1faz h ALA 34 N 2.40 2.09 -0.44 6.99 0.00 -1.33 -1.28 119.26 127.69 1faz h ALA 34 Ca 0.00 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.04 1faz h ALA 34 Cb 1.09 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1faz h ALA 34 CO 0.11 -0.38 0.31 0.00 0.00 0.00 0.00 179.25 179.29 1faz h ALA 35 N 1.61 2.25 0.00 0.00 0.00 -1.85 -2.04 119.26 119.23 1faz h ALA 35 Ca 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1faz h ALA 35 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1faz h ALA 35 CO -0.20 -0.36 -0.00 0.66 0.00 0.00 0.00 179.25 179.34 1faz n TYR 36 N -4.44 0.97 -3.91 0.00 4.02 -0.48 -4.27 117.16 109.05 1faz n TYR 36 Ca 0.07 0.28 -0.25 0.00 -0.01 0.00 0.00 57.90 57.99 1faz n TYR 36 Cb 0.43 -0.96 -0.01 0.00 -0.02 0.00 0.00 39.34 38.78 1faz n TYR 36 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1faz n GLU 37 N -2.29 -3.68 -2.17 -0.72 1.02 -0.77 -4.93 120.64 107.10 1faz n GLU 37 Ca 0.06 0.45 -0.32 0.00 -0.02 0.00 0.00 57.16 57.33 1faz n GLU 37 Cb 0.43 -4.71 -0.01 0.00 -0.02 0.00 0.00 31.44 27.14 1faz n GLU 37 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1faz s PHE 38 N -3.86 3.25 -0.44 -0.32 0.08 -1.26 -5.00 117.98 110.44 1faz s PHE 38 Ca 0.05 1.47 -0.23 0.00 0.12 0.00 0.00 56.93 58.33 1faz s PHE 38 Cb -0.03 -2.88 0.02 0.00 -0.57 0.00 0.00 43.02 39.57 1faz s PHE 38 CO 0.87 -0.75 0.80 0.34 -0.10 0.00 0.00 175.22 176.39 1faz s ASP 39 N -3.08 6.44 -0.07 1.36 -1.08 -1.26 -4.90 116.67 114.08 1faz s ASP 39 Ca 0.60 -0.03 0.20 0.00 -0.52 0.00 0.00 52.55 52.80 1faz s ASP 39 Cb -0.13 -2.39 0.69 0.00 -1.46 0.00 0.00 42.92 39.62 1faz s ASP 39 CO 0.37 -0.91 1.59 0.79 0.52 0.00 0.00 175.17 177.52 1faz n TRP 40 N 6.75 1.30 -2.65 -5.34 7.02 -1.26 -4.77 117.44 118.48 1faz n TRP 40 Ca 0.03 -0.55 -0.38 0.00 -1.02 0.00 0.00 57.50 55.58 1faz n TRP 40 Cb 0.48 -0.16 -0.05 0.00 -2.42 0.00 0.00 31.31 29.16 1faz n TRP 40 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 1faz s SER 41 N -0.92 7.18 -0.07 -0.99 1.04 -1.26 -5.04 113.70 113.63 1faz s SER 41 Ca 0.50 1.99 -0.22 0.00 0.48 0.00 0.00 55.95 58.70 1faz s SER 41 Cb 0.30 -2.59 0.05 0.00 0.10 0.00 0.00 66.02 63.87 1faz s SER 41 CO 0.27 -0.19 0.51 0.28 0.98 0.00 0.00 173.24 175.09 1faz s THR 42 N -1.50 0.02 -2.27 2.02 -1.32 -1.26 -4.61 115.64 106.73 1faz s THR 42 Ca 0.50 -0.18 0.22 0.00 -1.21 0.00 0.00 61.69 61.03 1faz s THR 42 Cb -0.23 -0.80 0.45 0.00 -1.51 0.00 0.00 72.50 70.42 1faz s THR 42 CO 0.29 -0.10 1.40 0.47 -2.21 0.00 0.00 174.62 174.48 1faz n ASP 43 N 1.50 3.50 0.00 8.08 10.43 -1.26 -5.05 116.55 133.75 1faz n ASP 43 Ca -0.19 -1.98 0.00 0.00 2.57 0.00 0.00 54.79 55.19 1faz n ASP 43 Cb 0.56 -0.29 0.00 0.00 1.84 0.00 0.00 41.12 43.24 1faz n ASP 43 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1faz n LEU 44 N 1.46 0.00 -1.94 0.64 4.77 -1.26 -2.05 117.00 118.62 1faz n LEU 44 Ca 0.20 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.19 1faz n LEU 44 Cb 0.59 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 42.05 1faz n LEU 44 CO 0.15 0.00 0.94 0.00 -1.33 0.00 0.00 177.39 177.15 1faz h THR 46 N 3.43 0.32 -0.49 0.00 1.35 -1.84 -2.05 112.91 113.63 1faz h THR 46 Ca 0.11 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 1faz h THR 46 Cb 2.12 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 1faz h THR 46 CO 0.59 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.92 1faz n GLN 47 N -3.41 3.54 -2.95 4.72 1.13 -1.26 -4.97 117.38 114.18 1faz n GLN 47 Ca -0.02 -2.78 -0.18 0.00 -1.94 0.00 0.00 57.00 52.08 1faz n GLN 47 Cb 0.21 -1.82 0.02 0.00 0.11 0.00 0.00 30.24 28.75 1faz n GLN 47 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1faz s ALA 48 N -2.06 4.30 1.21 -1.58 0.00 -0.77 -5.11 121.76 117.75 1faz s ALA 48 Ca 0.45 -1.53 -0.18 0.00 0.00 0.00 0.00 51.96 50.69 1faz s ALA 48 Cb 0.31 -1.77 0.29 0.00 0.00 0.00 0.00 23.12 21.94 1faz s ALA 48 CO 0.18 -0.39 1.07 -2.14 0.00 0.00 0.00 175.76 174.48 1faz s PRO 49 N -4.45 -1.30 0.76 0.00 0.02 -1.26 -4.97 135.00 123.80 1faz s PRO 49 Ca 0.54 0.13 -0.15 0.00 0.02 0.00 0.00 61.00 61.55 1faz s PRO 49 Cb -0.10 -1.57 0.05 0.00 0.02 0.00 0.00 34.50 32.90 1faz s PRO 49 CO 0.34 -3.80 1.21 -0.25 -0.33 0.00 0.00 177.00 174.17 1faz n ASP 50 N -4.86 1.26 -3.32 2.53 9.92 -1.26 -4.99 116.55 115.84 1faz n ASP 50 Ca 0.11 0.65 -0.26 0.00 -0.53 0.00 0.00 54.79 54.77 1faz n ASP 50 Cb 0.59 -1.51 -0.08 0.00 -0.64 0.00 0.00 41.12 39.47 1faz n ASP 50 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1faz n ASN 51 N -2.82 0.39 0.10 -2.24 2.85 -1.26 -5.01 115.26 107.28 1faz n ASN 51 Ca 0.14 -2.67 0.15 0.00 -0.11 0.00 0.00 54.58 52.10 1faz n ASN 51 Cb 0.50 -0.62 0.67 0.00 1.24 0.00 0.00 39.78 41.57 1faz n ASN 51 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1faz h PRO 52 N 4.67 0.01 -0.02 1.20 0.13 -2.00 -2.04 132.00 133.94 1faz h PRO 52 Ca 0.16 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1faz h PRO 52 Cb 0.87 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1faz h PRO 52 CO 0.47 0.01 -0.14 1.19 -0.23 0.00 0.00 178.00 179.30 1faz n PHE 53 N -4.44 0.00 -3.28 1.56 3.01 -1.26 -4.99 117.46 108.06 1faz n PHE 53 Ca 0.05 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.34 1faz n PHE 53 Cb 0.40 -0.02 0.06 0.00 -0.01 0.00 0.00 39.48 39.91 1faz n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1faz n GLY 54 N 1.31 -0.14 3.76 1.37 0.00 -0.77 -4.99 105.19 105.74 1faz n GLY 54 Ca 0.14 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1faz n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1faz s PHE 55 N -3.24 3.25 -1.14 1.61 0.08 -1.26 -4.90 117.98 112.38 1faz s PHE 55 Ca 0.39 1.51 -0.22 0.00 0.12 0.00 0.00 56.93 58.73 1faz s PHE 55 Cb -0.17 -3.54 -0.02 0.00 -0.57 0.00 0.00 43.02 38.72 1faz s PHE 55 CO 0.53 -1.39 1.82 -1.25 -0.10 0.00 0.00 175.22 174.83 1faz s PRO 56 N -1.60 3.03 0.00 0.24 0.04 -1.26 -4.71 135.00 130.75 1faz s PRO 56 Ca 0.48 -1.21 0.21 0.00 0.04 0.00 0.00 61.00 60.52 1faz s PRO 56 Cb -0.37 -5.30 0.16 0.00 0.04 0.00 0.00 34.50 29.03 1faz s PRO 56 CO 0.48 -3.19 1.17 1.19 0.04 0.00 0.00 177.00 176.69 1faz n PHE 57 N 12.05 0.00 -0.24 0.56 3.72 -1.26 -4.66 117.46 127.63 1faz n PHE 57 Ca 0.43 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.88 1faz n PHE 57 Cb 0.47 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.17 1faz n PHE 57 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1faz h ASN 58 N 4.11 -0.07 0.53 4.37 2.35 -1.97 -0.05 115.58 124.85 1faz h ASN 58 Ca 0.00 0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 1faz h ASN 58 Cb 0.88 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.46 1faz h ASN 58 CO 0.00 -0.06 -0.33 0.71 -1.65 0.00 0.00 177.43 176.10 1faz h THR 59 N 0.23 1.00 -0.16 2.81 1.35 -1.99 0.28 112.91 116.42 1faz h THR 59 Ca 0.39 -1.22 -0.04 0.00 -0.55 0.00 0.00 66.41 64.98 1faz h THR 59 Cb 0.66 1.71 -0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1faz h THR 59 CO -0.52 0.32 -0.08 0.00 -0.25 0.00 0.00 175.52 175.00 1faz h ALA 60 N 1.67 0.22 -0.80 6.62 0.00 -1.40 -2.23 119.26 123.34 1faz h ALA 60 Ca -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1faz h ALA 60 Cb 0.68 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1faz h ALA 60 CO 0.04 0.03 0.44 0.00 0.00 0.00 0.00 179.25 179.76 1faz h ALA 62 N 1.23 0.75 -0.08 0.00 0.00 -0.84 -0.39 119.26 119.93 1faz h ALA 62 Ca 0.28 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1faz h ALA 62 Cb 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1faz h ALA 62 CO -0.05 0.27 -0.40 -0.09 0.00 0.00 0.00 179.25 178.98 1faz h ARG 63 N 0.80 0.17 -0.45 0.00 2.43 -1.27 -1.29 114.38 114.78 1faz h ARG 63 Ca 0.21 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.18 1faz h ARG 63 Cb 0.04 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1faz h ARG 63 CO -0.03 0.55 -0.19 1.25 -1.51 0.00 0.00 179.97 180.03 1faz h HIS 64 N 0.15 1.06 -0.63 2.20 2.76 -0.91 -1.13 115.15 118.64 1faz h HIS 64 Ca 0.01 -0.26 -0.02 0.00 -2.20 0.00 0.00 60.37 57.91 1faz h HIS 64 Cb 0.77 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 1faz h HIS 64 CO 0.01 1.05 0.32 -0.44 -1.30 0.00 0.00 177.93 177.58 1faz h ASP 65 N 0.76 0.81 -0.21 3.26 3.45 -0.81 -0.92 116.42 122.76 1faz h ASP 65 Ca 0.10 -0.12 0.02 0.00 0.43 0.00 0.00 57.03 57.46 1faz h ASP 65 Cb 0.76 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 39.30 1faz h ASP 65 CO 0.06 0.69 0.09 0.15 -1.57 0.00 0.00 179.24 178.67 1faz h PHE 66 N 0.86 0.16 0.01 4.55 3.04 -1.01 -0.23 116.94 124.32 1faz h PHE 66 Ca 0.22 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.18 1faz h PHE 66 Cb 0.08 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 1faz h PHE 66 CO -0.00 0.09 -0.02 0.78 -2.02 0.00 0.00 178.31 177.13 1faz h GLY 67 N 0.20 -0.03 0.99 2.40 0.00 -0.87 -1.78 103.07 103.98 1faz h GLY 67 Ca 0.09 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 1faz h GLY 67 CO -0.08 -0.03 -0.29 -0.97 0.00 0.00 0.00 176.54 175.18 1faz h TYR 68 N -0.05 -0.76 -0.70 5.60 0.99 -0.97 -1.99 116.97 119.10 1faz h TYR 68 Ca 0.01 -0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.76 1faz h TYR 68 Cb 0.06 0.25 -0.05 0.00 1.00 0.00 0.00 36.73 37.99 1faz h TYR 68 CO -0.10 -0.47 0.43 0.00 -0.00 0.00 0.00 178.16 178.03 1faz h ARG 69 N -0.80 0.81 0.00 4.88 3.08 -1.06 -0.86 114.38 120.43 1faz h ARG 69 Ca -0.08 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.76 1faz h ARG 69 Cb 0.62 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1faz h ARG 69 CO 0.12 0.53 -0.76 -0.91 -1.07 0.00 0.00 179.97 177.89 1faz h ASN 70 N 0.83 0.00 1.04 7.04 2.35 -1.35 -1.47 115.58 124.03 1faz h ASN 70 Ca 0.28 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.86 1faz h ASN 70 Cb 0.04 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 1faz h ASN 70 CO -0.12 0.76 -0.84 1.88 -1.65 0.00 0.00 177.43 177.46 1faz h TYR 71 N 0.00 0.00 -0.22 1.19 0.05 -1.18 -2.02 116.97 114.79 1faz h TYR 71 Ca -0.01 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.63 1faz h TYR 71 Cb 1.41 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.14 1faz h TYR 71 CO 0.00 0.84 -0.46 0.87 -1.05 0.00 0.00 178.16 178.36 1faz h LYS 72 N 0.00 0.56 0.00 4.88 1.57 -1.09 -1.72 116.57 120.77 1faz h LYS 72 Ca -0.01 -0.31 -0.08 0.00 -1.87 0.00 0.00 60.65 58.38 1faz h LYS 72 Cb 1.59 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.91 1faz h LYS 72 CO 0.11 0.90 -0.38 0.00 -0.57 0.00 0.00 179.45 179.51 1faz h ALA 73 N 1.05 1.34 -0.00 3.86 0.00 -1.12 -2.17 119.26 122.22 1faz h ALA 73 Ca 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1faz h ALA 73 Cb 0.98 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1faz h ALA 73 CO 0.09 0.47 -0.19 0.00 0.00 0.00 0.00 179.25 179.62 1faz n ALA 74 N -2.45 2.89 -1.91 0.00 0.00 -0.77 -4.94 120.51 113.32 1faz n ALA 74 Ca -0.02 -0.27 -0.09 0.00 0.00 0.00 0.00 53.44 53.07 1faz n ALA 74 Cb 0.42 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 1faz n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1faz n GLY 75 N 1.37 0.30 2.62 0.00 0.00 -0.80 -4.93 105.19 103.75 1faz n GLY 75 Ca 0.11 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 1faz n GLY 75 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1faz n SER 76 N 0.42 2.41 -0.01 1.61 3.41 -0.72 -4.94 113.62 115.81 1faz n SER 76 Ca -0.10 -2.56 -0.13 0.00 -0.26 0.00 0.00 58.87 55.82 1faz n SER 76 Cb 0.50 -0.46 -0.10 0.00 -0.26 0.00 0.00 64.21 63.89 1faz n SER 76 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1faz h PHE 77 N 2.57 -0.02 -0.83 7.33 3.57 -1.87 -3.32 116.94 124.38 1faz h PHE 77 Ca -0.01 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.68 1faz h PHE 77 Cb 1.30 0.01 -0.12 0.00 2.79 0.00 0.00 35.95 39.93 1faz h PHE 77 CO 0.59 0.45 0.30 -0.44 -2.23 0.00 0.00 178.31 176.98 1faz h ASP 78 N -0.50 0.20 1.18 0.41 3.32 -1.92 -0.54 116.42 118.57 1faz h ASP 78 Ca -0.00 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1faz h ASP 78 Cb 0.48 0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1faz h ASP 78 CO 0.00 -0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1faz n ALA 79 N -2.57 2.10 0.38 3.45 0.00 -1.26 -3.59 120.51 119.03 1faz n ALA 79 Ca 0.18 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.65 1faz n ALA 79 Cb 0.56 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.53 1faz n ALA 79 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1faz n ASN 80 N -2.11 0.47 -0.20 0.00 3.02 -0.61 -4.71 115.26 111.11 1faz n ASN 80 Ca 0.05 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 1faz n ASN 80 Cb 0.36 0.94 0.11 0.00 -0.61 0.00 0.00 39.78 40.57 1faz n ASN 80 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1faz h LYS 81 N 0.11 0.39 -0.23 3.52 3.64 -1.20 -2.29 116.57 120.52 1faz h LYS 81 Ca 0.00 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1faz h LYS 81 Cb 0.20 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1faz h LYS 81 CO 0.00 0.26 0.02 1.03 -2.27 0.00 0.00 179.45 178.49 1faz h SER 82 N 0.40 -0.05 -0.63 4.20 0.87 -1.84 -0.48 113.55 116.02 1faz h SER 82 Ca 0.31 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.85 1faz h SER 82 Cb 0.39 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 1faz h SER 82 CO -0.31 0.00 0.13 -0.09 -0.53 0.00 0.00 176.83 176.03 1faz h ARG 83 N 0.09 1.03 -0.58 2.24 2.43 -1.82 -0.24 114.38 117.54 1faz h ARG 83 Ca 0.11 -0.26 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 1faz h ARG 83 Cb 0.12 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1faz h ARG 83 CO -0.16 0.95 0.27 0.82 -1.51 0.00 0.00 179.97 180.34 1faz h ILE 84 N 0.95 1.21 -0.60 1.20 1.08 -1.13 0.22 117.51 120.44 1faz h ILE 84 Ca 0.20 -0.60 -0.05 0.00 -0.39 0.00 0.00 64.86 64.02 1faz h ILE 84 Cb 0.40 0.54 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 1faz h ILE 84 CO 0.01 0.24 0.17 0.44 -0.69 0.00 0.00 178.15 178.32 1faz h ASP 85 N 0.78 0.89 -0.68 1.72 3.45 -0.89 -1.90 116.42 119.80 1faz h ASP 85 Ca 0.20 -0.22 -0.08 0.00 0.43 0.00 0.00 57.03 57.36 1faz h ASP 85 Cb 0.13 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.64 1faz h ASP 85 CO -0.02 0.87 0.13 0.28 -1.57 0.00 0.00 179.24 178.93 1faz h SER 86 N 0.86 1.06 -0.29 6.45 0.02 -0.57 -2.11 113.55 118.97 1faz h SER 86 Ca 0.19 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.84 1faz h SER 86 Cb 0.31 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1faz h SER 86 CO -0.00 1.04 0.01 0.00 -1.14 0.00 0.00 176.83 176.74 1faz h ALA 87 N 1.09 1.30 -0.28 3.77 0.00 -0.37 -0.71 119.26 124.06 1faz h ALA 87 Ca 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1faz h ALA 87 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1faz h ALA 87 CO 0.01 0.48 0.11 0.35 0.00 0.00 0.00 179.25 180.19 1faz h PHE 88 N 0.58 0.44 -0.54 0.00 3.57 -1.04 0.15 116.94 120.10 1faz h PHE 88 Ca 0.12 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 1faz h PHE 88 Cb 0.35 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 1faz h PHE 88 CO 0.01 0.44 0.25 -0.92 -2.23 0.00 0.00 178.31 175.87 1faz h TYR 89 N 0.30 0.78 -0.60 0.41 3.20 -0.88 -1.76 116.97 118.42 1faz h TYR 89 Ca 0.09 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 1faz h TYR 89 Cb 0.20 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1faz h TYR 89 CO -0.00 0.61 0.09 0.93 -1.64 0.00 0.00 178.16 178.15 1faz h GLU 90 N 0.72 0.98 -0.70 1.82 4.39 -0.95 -0.47 114.58 120.38 1faz h GLU 90 Ca 0.18 -0.25 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 1faz h GLU 90 Cb 0.13 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1faz h GLU 90 CO -0.02 0.91 0.25 -0.44 -1.16 0.00 0.00 179.01 178.55 1faz h ASP 91 N 0.92 0.99 -0.42 1.42 3.32 -0.65 -1.63 116.42 120.37 1faz h ASP 91 Ca 0.19 -0.19 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1faz h ASP 91 Cb 0.41 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1faz h ASP 91 CO 0.01 0.91 -0.22 0.24 -1.72 0.00 0.00 179.24 178.46 1faz h MET 92 N 1.01 0.93 -0.10 3.56 2.86 -1.01 -2.85 114.93 119.32 1faz h MET 92 Ca 0.23 -0.39 -0.06 0.00 -2.06 0.00 0.00 59.70 57.42 1faz h MET 92 Cb 0.25 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1faz h MET 92 CO -0.01 1.05 -0.19 0.87 1.06 0.00 0.00 176.91 179.69 1faz h LYS 93 N 0.80 0.17 -0.53 1.72 1.57 -0.81 -1.73 116.57 117.77 1faz h LYS 93 Ca 0.11 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1faz h LYS 93 Cb 0.78 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.04 1faz h LYS 93 CO 0.06 0.36 0.17 0.00 -0.57 0.00 0.00 179.45 179.48 1faz h ARG 94 N 0.16 0.78 -0.15 3.15 3.08 -1.07 -2.19 114.38 118.13 1faz h ARG 94 Ca 0.03 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1faz h ARG 94 Cb 0.44 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1faz h ARG 94 CO 0.03 0.67 0.06 0.28 -1.07 0.00 0.00 179.97 179.94 1faz h VAL 95 N 0.76 1.15 -0.03 2.04 2.07 -1.21 -3.06 116.25 117.97 1faz h VAL 95 Ca 0.18 -0.45 0.01 0.00 0.82 0.00 0.00 66.70 67.25 1faz h VAL 95 Cb 0.21 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1faz h VAL 95 CO -0.01 0.14 0.03 0.00 0.02 0.00 0.00 177.57 177.75 1faz n THR 97 N -4.08 1.21 1.78 0.00 -2.24 -0.93 -1.64 114.28 108.39 1faz n THR 97 Ca -0.02 0.36 0.14 0.00 -2.27 0.00 0.00 64.05 62.26 1faz n THR 97 Cb 0.12 -1.24 0.71 0.00 -2.10 0.00 0.00 70.33 67.82 1faz n THR 97 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1faz n GLY 98 N -0.51 -0.59 3.39 3.38 0.00 -0.88 -4.84 105.19 105.13 1faz n GLY 98 Ca 0.02 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 1faz n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1faz s TYR 99 N -1.98 2.13 0.34 1.61 2.02 -0.65 -5.09 117.35 115.73 1faz s TYR 99 Ca 0.40 -0.39 0.06 0.00 -0.37 0.00 0.00 57.07 56.77 1faz s TYR 99 Cb 0.20 -1.07 -0.07 0.00 -0.40 0.00 0.00 41.96 40.62 1faz s TYR 99 CO 0.33 0.42 -0.00 0.95 -1.57 0.00 0.00 175.55 175.68 1faz s THR 100 N -1.70 1.64 0.00 -0.71 -4.23 -1.26 -4.37 115.64 105.00 1faz s THR 100 Ca 0.18 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1faz s THR 100 Cb -0.08 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 71.02 1faz s THR 100 CO 0.08 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 1faz n GLY 101 N -0.75 1.88 0.31 3.99 0.00 -1.26 -2.88 105.19 106.48 1faz n GLY 101 Ca -0.04 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.63 1faz n GLY 101 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1faz h GLU 102 N 0.00 0.44 -0.66 1.61 4.81 -1.99 -0.61 114.58 118.18 1faz h GLU 102 Ca 0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1faz h GLU 102 Cb 0.00 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1faz h GLU 102 CO 0.00 0.29 0.26 0.87 -0.73 0.00 0.00 179.01 179.71 1faz h LYS 103 N 0.45 0.96 -0.48 1.92 1.57 -1.91 0.19 116.57 119.27 1faz h LYS 103 Ca 0.53 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 59.13 1faz h LYS 103 Cb 0.95 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 1faz h LYS 103 CO -0.48 0.78 0.18 -0.97 -0.57 0.00 0.00 179.45 178.39 1faz h ASN 104 N 0.94 0.68 -0.49 0.86 -0.73 -1.01 0.14 115.58 115.97 1faz h ASN 104 Ca 0.22 -0.18 -0.11 0.00 1.87 0.00 0.00 56.30 58.10 1faz h ASN 104 Cb 0.18 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 38.58 1faz h ASN 104 CO -0.02 0.67 -0.13 0.74 -0.37 0.00 0.00 177.43 178.32 1faz h THR 105 N 0.64 1.27 -0.46 -3.57 2.02 -0.91 -1.04 112.91 110.86 1faz h THR 105 Ca 0.16 -1.28 -0.11 0.00 0.77 0.00 0.00 66.41 65.95 1faz h THR 105 Cb 0.21 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 1faz h THR 105 CO -0.01 0.45 -0.17 0.00 0.37 0.00 0.00 175.52 176.16 1faz h ALA 106 N 0.97 0.84 -0.27 6.16 0.00 -0.46 -1.15 119.26 125.35 1faz h ALA 106 Ca 0.13 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1faz h ALA 106 Cb 0.69 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1faz h ALA 106 CO 0.05 0.65 0.03 0.00 0.00 0.00 0.00 179.25 179.98 1faz h ASN 108 N 0.25 0.26 -0.54 0.00 2.35 -1.09 -0.83 115.58 115.98 1faz h ASN 108 Ca 0.08 -0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 55.64 1faz h ASN 108 Cb 0.35 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1faz h ASN 108 CO 0.01 0.48 -0.13 -1.28 -1.65 0.00 0.00 177.43 174.86 1faz h SER 109 N 0.25 1.05 -0.33 5.81 0.87 -0.98 -0.97 113.55 119.25 1faz h SER 109 Ca 0.04 -0.36 -0.11 0.00 -1.23 0.00 0.00 61.79 60.13 1faz h SER 109 Cb 0.51 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1faz h SER 109 CO 0.03 1.17 -0.23 0.74 -0.53 0.00 0.00 176.83 178.01 1faz h THR 110 N 0.92 1.29 -0.76 2.23 2.02 -0.94 -1.46 112.91 116.21 1faz h THR 110 Ca 0.14 -1.38 0.05 0.00 0.77 0.00 0.00 66.41 65.98 1faz h THR 110 Cb 0.71 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 68.53 1faz h THR 110 CO 0.05 0.45 0.47 0.00 0.37 0.00 0.00 175.52 176.86 1faz h ALA 111 N 0.75 1.02 -0.64 6.16 0.00 -1.04 -0.29 119.26 125.22 1faz h ALA 111 Ca 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1faz h ALA 111 Cb 0.79 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1faz h ALA 111 CO 0.06 0.22 0.15 2.35 0.00 0.00 0.00 179.25 182.04 1faz h TRP 112 N 0.89 1.08 -0.72 0.00 7.01 -0.99 -0.95 115.95 122.27 1faz h TRP 112 Ca 0.32 -0.13 -0.07 0.00 2.11 0.00 0.00 58.89 61.12 1faz h TRP 112 Cb 0.10 -0.30 -0.03 0.00 -2.10 0.00 0.00 29.16 26.82 1faz h TRP 112 CO -0.04 0.90 0.18 1.15 -2.79 0.00 0.00 178.44 177.84 1faz h THR 113 N 0.95 1.26 -0.29 2.65 2.02 -0.52 0.78 112.91 119.76 1faz h THR 113 Ca 0.20 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 1faz h THR 113 Cb 0.37 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1faz h THR 113 CO 0.00 0.38 0.08 1.88 0.37 0.00 0.00 175.52 178.23 1faz h TYR 114 N 1.09 0.48 -0.25 3.16 -1.99 -0.83 -1.84 116.97 116.80 1faz h TYR 114 Ca 0.23 -0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.90 1faz h TYR 114 Cb 0.37 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.95 1faz h TYR 114 CO 0.03 0.52 0.15 -0.92 -0.00 0.00 0.00 178.16 177.94 1faz h TYR 115 N 0.31 0.32 -0.20 4.88 5.03 -0.86 -2.64 116.97 123.81 1faz h TYR 115 Ca 0.09 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.39 1faz h TYR 115 Cb 0.27 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 1faz h TYR 115 CO 0.01 0.23 0.03 1.96 -1.32 0.00 0.00 178.16 179.06 1faz h GLN 116 N 0.32 0.28 0.00 1.82 1.08 -0.75 -0.36 115.11 117.51 1faz h GLN 116 Ca 0.09 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1faz h GLN 116 Cb -0.01 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.37 1faz h GLN 116 CO -0.02 0.29 0.00 0.00 -0.95 0.00 0.00 178.83 178.15 1faz h ALA 117 N 1.76 1.00 0.00 3.87 0.00 -0.96 -2.00 119.26 122.92 1faz h ALA 117 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 1faz h ALA 117 Cb 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1faz h ALA 117 CO -0.00 0.00 -2.16 1.33 0.00 0.00 0.00 179.25 178.42 1faz n VAL 118 N -2.74 1.00 0.24 0.00 0.24 -0.81 -4.32 118.33 111.94 1faz n VAL 118 Ca 0.01 -0.70 0.10 0.00 -2.04 0.00 0.00 64.34 61.71 1faz n VAL 118 Cb 0.29 -0.42 0.60 0.00 -1.47 0.00 0.00 33.84 32.83 1faz n VAL 118 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1faz h LYS 119 N 0.00 0.00 0.00 7.34 1.63 -0.88 -2.64 116.57 122.02 1faz h LYS 119 Ca -0.39 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.40 1faz h LYS 119 Cb 1.87 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.50 1faz h LYS 119 CO 0.02 0.19 -0.03 0.97 -3.45 0.00 0.00 179.45 177.15 1faz h ILE 120 N 0.00 0.29 0.00 2.00 6.09 -1.56 -1.96 117.51 122.37 1faz h ILE 120 Ca -0.00 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 1faz h ILE 120 Cb 0.45 1.15 0.00 0.00 0.47 0.00 0.00 36.82 38.89 1faz h ILE 120 CO 0.02 0.03 0.00 0.49 -3.07 0.00 0.00 178.15 175.63 1faz n PHE 121 N -3.43 0.74 0.00 2.19 3.01 -0.99 -5.15 117.46 113.82 1faz n PHE 121 Ca -0.02 0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.66 1faz n PHE 121 Cb 0.14 -0.86 0.00 0.00 -0.01 0.00 0.00 39.48 38.75 1faz n PHE 121 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18