#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfe n ASN 2 N 0.00 0.00 -4.75 1.08 6.94 -1.26 -0.72 115.26 116.56 1cfe n ASN 2 Ca 0.00 -1.03 -0.29 0.00 -0.02 0.00 0.00 54.58 53.25 1cfe n ASN 2 Cb 0.00 -0.01 0.15 0.00 -2.36 0.00 0.00 39.78 37.56 1cfe n ASN 2 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 1cfe s SER 3 N -0.03 3.24 0.16 0.53 0.01 -1.26 -4.82 113.70 111.53 1cfe s SER 3 Ca 0.00 1.00 -0.26 0.00 1.31 0.00 0.00 55.95 58.00 1cfe s SER 3 Cb 0.00 -1.59 0.02 0.00 0.21 0.00 0.00 66.02 64.66 1cfe s SER 3 CO 0.00 -2.72 1.57 -0.65 0.41 0.00 0.00 173.24 171.85 1cfe h PRO 4 N -1.62 -0.28 -0.88 12.44 0.11 -2.01 -0.90 132.00 138.87 1cfe h PRO 4 Ca -0.52 0.02 0.17 0.00 0.11 0.00 0.00 66.00 65.78 1cfe h PRO 4 Cb 1.33 0.06 -0.10 0.00 0.11 0.00 0.00 31.00 32.40 1cfe h PRO 4 CO 0.61 -0.19 0.45 1.96 -0.21 0.00 0.00 178.00 180.62 1cfe h GLN 5 N -0.29 0.58 0.25 1.05 7.50 -1.97 -0.17 115.11 122.06 1cfe h GLN 5 Ca 0.15 -0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.26 1cfe h GLN 5 Cb 0.57 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 27.98 1cfe h GLN 5 CO -0.60 0.38 -0.12 -0.44 -1.50 0.00 0.00 178.83 176.55 1cfe h ASP 6 N 0.60 -0.29 0.46 1.46 3.32 -1.50 0.28 116.42 120.74 1cfe h ASP 6 Ca 0.50 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.53 1cfe h ASP 6 Cb 0.76 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.39 1cfe h ASP 6 CO -0.40 -0.20 -0.22 1.88 -1.72 0.00 0.00 179.24 178.58 1cfe h TYR 7 N -0.35 -0.57 -0.91 4.55 0.05 -1.23 -3.21 116.97 115.30 1cfe h TYR 7 Ca -0.03 -0.01 0.19 0.00 0.05 0.00 0.00 58.73 58.92 1cfe h TYR 7 Cb 0.26 0.19 -0.11 0.00 1.01 0.00 0.00 36.73 38.08 1cfe h TYR 7 CO -0.06 -0.32 0.47 -0.07 -1.05 0.00 0.00 178.16 177.12 1cfe h LEU 8 N -0.67 0.51 -0.09 3.88 3.38 -0.74 -2.07 115.31 119.50 1cfe h LEU 8 Ca -0.06 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1cfe h LEU 8 Cb 0.50 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1cfe h LEU 8 CO 0.10 0.14 0.06 0.00 0.09 0.00 0.00 178.44 178.83 1cfe h ALA 9 N 1.65 0.12 -0.34 1.53 0.00 -0.46 0.21 119.26 121.97 1cfe h ALA 9 Ca 0.54 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.29 1cfe h ALA 9 Cb 0.90 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1cfe h ALA 9 CO -0.44 -0.39 -0.37 0.28 0.00 0.00 0.00 179.25 178.33 1cfe h VAL 10 N 0.12 1.28 -0.19 0.00 2.07 -1.49 0.59 116.25 118.63 1cfe h VAL 10 Ca 0.03 -1.55 0.04 0.00 0.82 0.00 0.00 66.70 66.05 1cfe h VAL 10 Cb -0.01 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1cfe h VAL 10 CO -0.01 0.51 -0.07 0.45 0.02 0.00 0.00 177.57 178.47 1cfe h HIS 11 N 0.65 -0.16 -0.32 1.57 -0.00 -1.12 -0.11 115.15 115.66 1cfe h HIS 11 Ca 0.05 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.43 1cfe h HIS 11 Cb 0.96 0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 28.46 1cfe h HIS 11 CO 0.07 -0.11 0.17 -0.91 -0.00 0.00 0.00 177.93 177.15 1cfe h ASN 12 N -0.03 0.41 0.06 2.45 2.35 -0.30 0.42 115.58 120.93 1cfe h ASN 12 Ca 0.10 -0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1cfe h ASN 12 Cb 0.18 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 1cfe h ASN 12 CO -0.22 0.39 -0.51 -0.78 -1.65 0.00 0.00 177.43 174.66 1cfe h ASP 13 N 0.40 -1.57 -0.80 5.81 3.58 -0.67 0.24 116.42 123.41 1cfe h ASP 13 Ca 0.11 0.17 0.04 0.00 0.42 0.00 0.00 57.03 57.77 1cfe h ASP 13 Cb 0.08 0.59 -0.05 0.00 1.72 0.00 0.00 39.33 41.67 1cfe h ASP 13 CO -0.02 -0.53 0.51 0.00 -2.88 0.00 0.00 179.24 176.32 1cfe h ALA 14 N -0.40 1.05 -0.55 -0.78 0.00 -0.72 -0.25 119.26 117.61 1cfe h ALA 14 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1cfe h ALA 14 Cb 0.73 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1cfe h ALA 14 CO -0.32 0.31 0.29 0.00 0.00 0.00 0.00 179.25 179.52 1cfe h ARG 15 N 0.97 0.78 -0.89 0.00 3.08 -0.65 -2.68 114.38 114.99 1cfe h ARG 15 Ca 0.32 -0.10 0.09 0.00 0.07 0.00 0.00 59.98 60.36 1cfe h ARG 15 Cb 0.04 -0.15 -0.07 0.00 0.08 0.00 0.00 29.97 29.87 1cfe h ARG 15 CO -0.12 0.62 0.54 0.00 -1.07 0.00 0.00 179.97 179.93 1cfe h ALA 16 N 1.12 1.27 -0.10 0.04 0.00 0.76 0.26 119.26 122.62 1cfe h ALA 16 Ca 0.19 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1cfe h ALA 16 Cb 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1cfe h ALA 16 CO -0.03 0.20 0.18 1.96 0.00 0.00 0.00 179.25 181.56 1cfe h GLN 17 N 0.91 0.00 -0.01 0.00 1.08 -0.74 -0.19 115.11 116.16 1cfe h GLN 17 Ca 0.42 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 1cfe h GLN 17 Cb 0.33 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1cfe h GLN 17 CO -0.23 0.00 0.00 1.33 -0.95 0.00 0.00 178.83 178.98 1cfe n VAL 18 N -3.42 0.90 -3.60 -0.54 0.24 -0.33 -5.02 118.33 106.57 1cfe n VAL 18 Ca -0.00 -0.95 -0.21 0.00 -2.04 0.00 0.00 64.34 61.13 1cfe n VAL 18 Cb 0.27 0.55 0.07 0.00 -1.47 0.00 0.00 33.84 33.26 1cfe n VAL 18 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cfe n GLY 19 N -0.41 -0.40 3.87 7.63 0.00 0.75 -5.01 105.19 111.61 1cfe n GLY 19 Ca 0.00 0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 1cfe n GLY 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cfe s VAL 20 N -3.42 5.18 0.63 1.61 1.01 -0.21 -4.98 120.40 120.22 1cfe s VAL 20 Ca 0.22 0.43 -0.19 0.00 0.00 0.00 0.00 61.98 62.44 1cfe s VAL 20 Cb -0.10 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1cfe s VAL 20 CO 0.76 0.41 1.29 0.61 0.00 0.00 0.00 175.10 178.17 1cfe n GLY 21 N 1.29 0.55 2.95 4.51 0.00 -1.26 -4.38 105.19 108.85 1cfe n GLY 21 Ca -0.12 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1cfe n GLY 21 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cfe n PRO 22 N -1.69 -1.51 -4.27 1.61 -0.04 -1.26 -4.88 135.00 122.97 1cfe n PRO 22 Ca 0.15 -1.54 -0.15 0.00 -0.04 0.00 0.00 63.50 61.92 1cfe n PRO 22 Cb 0.47 -1.14 -0.10 0.00 -0.04 0.00 0.00 33.50 32.69 1cfe n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cfe s MET 23 N -5.18 1.21 0.30 0.54 0.23 -1.26 -4.83 119.30 110.29 1cfe s MET 23 Ca 0.58 -1.60 0.01 0.00 -1.03 0.00 0.00 55.69 53.65 1cfe s MET 23 Cb -0.03 -0.31 -0.00 0.00 -1.53 0.00 0.00 34.83 32.96 1cfe s MET 23 CO 0.42 -0.16 0.05 -1.13 -2.03 0.00 0.00 175.02 172.16 1cfe n SER 24 N -0.31 2.03 -4.59 -1.18 3.41 -1.26 -5.00 113.62 106.71 1cfe n SER 24 Ca -0.05 -2.41 -0.29 0.00 -0.26 0.00 0.00 58.87 55.86 1cfe n SER 24 Cb 0.64 0.44 0.16 0.00 -0.26 0.00 0.00 64.21 65.19 1cfe n SER 24 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1cfe s TRP 25 N -2.35 2.10 -0.12 7.33 -0.00 -1.26 -2.50 118.94 122.15 1cfe s TRP 25 Ca 0.07 0.78 -0.06 0.00 -0.00 0.00 0.00 56.10 56.89 1cfe s TRP 25 Cb 0.00 -3.44 0.05 0.00 -0.00 0.00 0.00 33.47 30.08 1cfe s TRP 25 CO 0.05 -2.69 0.27 0.34 -0.00 0.00 0.00 176.95 174.92 1cfe s ASP 26 N -3.99 -0.19 0.29 5.86 2.15 0.14 -4.51 116.67 116.42 1cfe s ASP 26 Ca 0.66 0.58 -0.01 0.00 0.43 0.00 0.00 52.55 54.21 1cfe s ASP 26 Cb -0.14 0.50 0.43 0.00 -0.30 0.00 0.00 42.92 43.41 1cfe s ASP 26 CO 0.54 -0.18 1.85 0.00 -0.17 0.00 0.00 175.17 177.21 1cfe h ALA 27 N 7.37 1.25 0.38 3.66 0.00 -1.99 -1.39 119.26 128.56 1cfe h ALA 27 Ca -0.36 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 1cfe h ALA 27 Cb 1.15 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1cfe h ALA 27 CO 0.33 0.53 -0.18 -0.91 0.00 0.00 0.00 179.25 179.01 1cfe h ASN 28 N 0.81 -0.44 -0.65 0.00 4.21 -1.96 0.15 115.58 117.70 1cfe h ASN 28 Ca 0.18 -0.09 0.08 0.00 1.21 0.00 0.00 56.30 57.68 1cfe h ASN 28 Cb 0.25 0.11 -0.06 0.00 -1.12 0.00 0.00 38.32 37.49 1cfe h ASN 28 CO -0.01 -0.16 0.31 -0.07 -1.29 0.00 0.00 177.43 176.21 1cfe h LEU 29 N -0.71 0.41 -0.38 1.61 3.38 -1.85 -1.52 115.31 116.24 1cfe h LEU 29 Ca -0.05 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1cfe h LEU 29 Cb 0.50 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1cfe h LEU 29 CO 0.09 0.25 0.23 0.00 0.09 0.00 0.00 178.44 179.10 1cfe h ALA 30 N 1.39 0.49 -0.46 1.53 0.00 -0.88 0.13 119.26 121.45 1cfe h ALA 30 Ca 0.31 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.28 1cfe h ALA 30 Cb 0.30 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 1cfe h ALA 30 CO -0.24 -0.10 0.11 0.66 0.00 0.00 0.00 179.25 179.68 1cfe h SER 31 N 0.48 0.05 0.20 0.00 4.64 -0.14 -0.50 113.55 118.28 1cfe h SER 31 Ca 0.15 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 1cfe h SER 31 Cb -0.01 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1cfe h SER 31 CO -0.06 0.06 -0.09 -0.09 -0.87 0.00 0.00 176.83 175.78 1cfe h ARG 32 N 0.26 -0.25 -0.55 4.77 2.43 -0.82 0.17 114.38 120.38 1cfe h ARG 32 Ca 0.23 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1cfe h ARG 32 Cb 0.28 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 1cfe h ARG 32 CO -0.28 0.06 0.35 0.00 -1.51 0.00 0.00 179.97 178.59 1cfe h ALA 33 N 0.14 0.71 -0.31 2.80 0.00 -0.55 0.21 119.26 122.25 1cfe h ALA 33 Ca -0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1cfe h ALA 33 Cb 0.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1cfe h ALA 33 CO 0.04 0.10 0.03 0.37 0.00 0.00 0.00 179.25 179.79 1cfe h GLN 34 N 0.71 0.53 0.09 0.00 5.75 -1.07 -1.21 115.11 119.90 1cfe h GLN 34 Ca 0.21 -0.16 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1cfe h GLN 34 Cb -0.04 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 1cfe h GLN 34 CO -0.07 0.65 -0.08 -0.91 -2.65 0.00 0.00 178.83 175.77 1cfe h ASN 35 N 0.34 -0.21 -0.16 -0.69 4.21 -0.32 0.10 115.58 118.86 1cfe h ASN 35 Ca 0.09 0.02 0.05 0.00 1.21 0.00 0.00 56.30 57.67 1cfe h ASN 35 Cb 0.39 0.07 -0.07 0.00 -1.12 0.00 0.00 38.32 37.60 1cfe h ASN 35 CO 0.01 -0.13 -0.40 0.22 -1.29 0.00 0.00 177.43 175.84 1cfe h TYR 36 N -0.18 -1.15 -0.42 1.19 3.20 -0.53 0.24 116.97 119.31 1cfe h TYR 36 Ca 0.00 0.05 0.09 0.00 3.14 0.00 0.00 58.73 62.01 1cfe h TYR 36 Cb 0.17 0.53 -0.09 0.00 1.54 0.00 0.00 36.73 38.88 1cfe h TYR 36 CO -0.11 -0.46 -0.17 0.00 -1.64 0.00 0.00 178.16 175.79 1cfe h ALA 37 N 0.21 0.18 -0.05 1.82 0.00 -1.06 -1.69 119.26 118.66 1cfe h ALA 37 Ca 0.09 0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.17 1cfe h ALA 37 Cb 0.61 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1cfe h ALA 37 CO -0.41 -0.52 -0.07 -0.91 0.00 0.00 0.00 179.25 177.35 1cfe h ASN 38 N -0.08 -0.21 0.75 0.00 4.21 0.43 -1.15 115.58 119.54 1cfe h ASN 38 Ca 0.21 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.76 1cfe h ASN 38 Cb 0.39 0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 1cfe h ASN 38 CO -0.48 -0.10 0.00 0.77 -1.29 0.00 0.00 177.43 176.33 1cfe h SER 39 N -0.09 0.00 -0.00 5.81 4.64 -0.27 0.14 113.55 123.78 1cfe h SER 39 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1cfe h SER 39 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1cfe h SER 39 CO -0.11 0.00 -0.03 0.54 -0.87 0.00 0.00 176.83 176.36 1cfe n ARG 40 N -2.44 1.76 -1.72 4.77 1.74 -0.66 -4.80 116.66 115.30 1cfe n ARG 40 Ca 0.02 -1.16 -0.33 0.00 -0.77 0.00 0.00 57.85 55.60 1cfe n ARG 40 Cb 0.24 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.14 1cfe n ARG 40 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1cfe n ALA 41 N 0.39 2.22 0.00 7.54 0.00 0.04 -0.59 120.51 130.11 1cfe n ALA 41 Ca 0.17 -3.08 0.00 0.00 0.00 0.00 0.00 53.44 50.53 1cfe n ALA 41 Cb 0.42 -3.53 0.00 0.00 0.00 0.00 0.00 19.45 16.33 1cfe n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cfe n GLY 42 N 5.38 1.99 2.60 0.00 0.00 -1.26 -4.71 105.19 109.18 1cfe n GLY 42 Ca 0.46 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 46.09 1cfe n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cfe n ASP 43 N 0.00 3.67 -0.03 1.61 2.03 0.25 -4.68 116.55 119.39 1cfe n ASP 43 Ca 0.00 -3.45 -0.15 0.00 0.52 0.00 0.00 54.79 51.71 1cfe n ASP 43 Cb 0.00 -0.51 -0.09 0.00 -0.72 0.00 0.00 41.12 39.80 1cfe n ASP 43 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cfe n ASN 45 N -4.38 -4.83 -4.42 0.00 2.85 -1.26 -4.65 115.26 98.57 1cfe n ASN 45 Ca -0.08 0.48 -0.13 0.00 -0.11 0.00 0.00 54.58 54.74 1cfe n ASN 45 Cb 0.52 -1.05 -0.11 0.00 1.24 0.00 0.00 39.78 40.38 1cfe n ASN 45 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1cfe n LEU 46 N 1.59 -0.18 -3.81 1.20 7.99 -1.26 -4.82 117.00 117.71 1cfe n LEU 46 Ca 0.00 -1.37 -0.25 0.00 -0.01 0.00 0.00 56.01 54.38 1cfe n LEU 46 Cb 0.15 -1.08 -0.17 0.00 -0.11 0.00 0.00 43.42 42.21 1cfe n LEU 46 CO 0.00 -2.24 -0.40 -0.63 -1.51 0.00 0.00 177.39 172.62 1cfe s ILE 47 N 7.37 0.63 -0.08 -0.08 1.01 -1.26 -5.14 121.20 123.65 1cfe s ILE 47 Ca 0.82 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 61.35 1cfe s ILE 47 Cb -0.31 -0.82 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 1cfe s ILE 47 CO 0.24 0.19 -0.23 -1.38 0.00 0.00 0.00 174.94 173.76 1cfe s HIS 48 N 1.85 2.43 0.20 3.97 -3.43 -1.26 -4.99 115.29 114.06 1cfe s HIS 48 Ca 0.04 -0.91 -0.14 0.00 -0.80 0.00 0.00 55.06 53.24 1cfe s HIS 48 Cb -0.13 -1.62 0.20 0.00 -1.43 0.00 0.00 32.58 29.60 1cfe s HIS 48 CO -0.07 -0.35 1.64 0.66 -2.00 0.00 0.00 174.74 174.63 1cfe h SER 49 N 6.54 -0.50 0.00 7.38 4.64 -2.01 -3.48 113.55 126.12 1cfe h SER 49 Ca -0.24 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1cfe h SER 49 Cb 1.22 0.34 0.00 0.00 -0.31 0.00 0.00 62.40 63.65 1cfe h SER 49 CO 0.47 -0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 1cfe n GLY 50 N -1.39 1.17 7.00 -0.77 0.00 -1.26 -5.04 105.19 104.90 1cfe n GLY 50 Ca 0.06 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.18 1cfe n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cfe n ALA 51 N 3.49 0.00 -1.51 4.61 0.00 -1.25 -0.66 120.51 125.19 1cfe n ALA 51 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1cfe n ALA 51 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1cfe n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cfe n GLY 52 N 0.00 4.48 3.18 0.00 0.00 -1.26 -2.81 105.19 108.78 1cfe n GLY 52 Ca 0.00 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 1cfe n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cfe s GLU 53 N -2.00 0.93 -0.09 1.61 0.41 0.17 -0.47 118.70 119.26 1cfe s GLU 53 Ca 0.57 -1.42 -0.23 0.00 -0.41 0.00 0.00 54.97 53.48 1cfe s GLU 53 Cb 0.39 -0.03 0.05 0.00 -1.78 0.00 0.00 34.13 32.75 1cfe s GLU 53 CO -0.23 -0.14 0.54 0.54 -0.49 0.00 0.00 175.26 175.48 1cfe s ASN 54 N -3.07 -0.51 0.13 -0.19 2.20 -1.01 -4.56 114.94 107.92 1cfe s ASN 54 Ca 0.19 0.68 0.09 0.00 -0.94 0.00 0.00 52.86 52.88 1cfe s ASN 54 Cb 0.07 0.67 -0.04 0.00 -2.00 0.00 0.00 41.25 39.95 1cfe s ASN 54 CO -0.00 -0.44 -0.22 -0.76 -2.94 0.00 0.00 177.10 172.74 1cfe s LEU 55 N -0.77 2.34 0.08 3.54 1.43 -1.26 -2.01 118.68 122.03 1cfe s LEU 55 Ca -0.08 -0.75 0.08 0.00 -1.03 0.00 0.00 54.13 52.34 1cfe s LEU 55 Cb -0.03 -0.97 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 1cfe s LEU 55 CO 0.06 0.07 -0.20 0.00 0.23 0.00 0.00 176.35 176.51 1cfe s ALA 56 N -1.35 1.72 0.85 4.21 0.00 -0.44 -4.91 121.76 121.84 1cfe s ALA 56 Ca 0.11 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1cfe s ALA 56 Cb -0.09 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.77 1cfe s ALA 56 CO 0.06 0.35 0.00 0.36 0.00 0.00 0.00 175.76 176.53 1cfe n LYS 57 N 1.35 1.87 0.00 0.00 0.00 -1.26 -1.25 118.16 118.87 1cfe n LYS 57 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.12 1cfe n LYS 57 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.57 1cfe n LYS 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1cfe n GLY 58 N 5.00 3.26 0.00 2.58 0.00 -0.09 -4.58 105.19 111.36 1cfe n GLY 58 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1cfe n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cfe n GLY 59 N 0.00 1.11 0.13 -0.02 0.00 -1.26 -4.35 105.19 100.80 1cfe n GLY 59 Ca 0.00 0.35 -0.21 0.00 0.00 0.00 0.00 46.02 46.17 1cfe n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cfe n GLY 60 N 0.00 -0.52 0.88 -0.02 0.00 -1.26 -3.89 105.19 100.37 1cfe n GLY 60 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.81 1cfe n GLY 60 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cfe n ASP 61 N -3.53 0.22 -4.71 1.61 5.75 -1.26 -5.00 116.55 109.62 1cfe n ASP 61 Ca -0.37 -1.86 -0.40 0.00 -0.01 0.00 0.00 54.79 52.15 1cfe n ASP 61 Cb 1.00 -0.15 0.02 0.00 -1.03 0.00 0.00 41.12 40.96 1cfe n ASP 61 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1cfe n PHE 62 N 0.16 2.13 -3.89 2.11 -0.00 -1.26 -4.98 117.46 111.72 1cfe n PHE 62 Ca -0.01 0.48 -0.22 0.00 -0.00 0.00 0.00 57.45 57.70 1cfe n PHE 62 Cb 0.82 -2.37 -0.04 0.00 -0.00 0.00 0.00 39.48 37.89 1cfe n PHE 62 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1cfe s THR 63 N -1.23 3.46 0.16 -2.13 -4.23 -1.26 -4.95 115.64 105.46 1cfe s THR 63 Ca 0.64 -1.45 -0.08 0.00 -1.18 0.00 0.00 61.69 59.62 1cfe s THR 63 Cb -0.48 -3.15 -0.07 0.00 1.34 0.00 0.00 72.50 70.15 1cfe s THR 63 CO 0.56 -0.19 1.46 1.23 -0.54 0.00 0.00 174.62 177.14 1cfe h GLY 64 N 1.33 0.82 0.39 3.99 0.00 -1.51 -0.13 103.07 107.96 1cfe h GLY 64 Ca -0.45 -0.94 0.03 0.00 0.00 0.00 0.00 47.33 45.97 1cfe h GLY 64 CO 0.60 0.85 -0.27 -0.09 0.00 0.00 0.00 176.54 177.62 1cfe h ARG 65 N 0.58 -0.40 -0.82 4.80 9.65 -1.22 0.29 114.38 127.27 1cfe h ARG 65 Ca 0.02 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.00 1cfe h ARG 65 Cb 1.11 0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 29.72 1cfe h ARG 65 CO 0.11 -0.26 0.54 0.00 2.80 0.00 0.00 179.97 183.15 1cfe h ALA 66 N 0.40 1.66 0.51 2.80 0.00 -1.80 -0.19 119.26 122.63 1cfe h ALA 66 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1cfe h ALA 66 Cb 0.50 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1cfe h ALA 66 CO -0.24 0.20 -0.28 0.00 0.00 0.00 0.00 179.25 178.93 1cfe h ALA 67 N 1.57 -0.74 -0.84 0.00 0.00 0.42 0.41 119.26 120.08 1cfe h ALA 67 Ca 0.37 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1cfe h ALA 67 Cb 0.32 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.39 1cfe h ALA 67 CO -0.14 -0.92 0.53 0.28 0.00 0.00 0.00 179.25 178.99 1cfe h VAL 68 N -0.74 1.08 -0.66 0.00 2.07 -0.62 0.34 116.25 117.73 1cfe h VAL 68 Ca -0.06 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.13 1cfe h VAL 68 Cb 0.59 -0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1cfe h VAL 68 CO 0.08 0.18 0.43 1.56 0.02 0.00 0.00 177.57 179.85 1cfe h GLN 69 N 0.99 0.82 -0.19 1.57 1.08 -0.70 0.11 115.11 118.79 1cfe h GLN 69 Ca 0.35 -0.05 -0.14 0.00 -1.45 0.00 0.00 58.65 57.36 1cfe h GLN 69 Cb 0.10 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 1cfe h GLN 69 CO -0.15 0.54 -0.48 1.25 -0.95 0.00 0.00 178.83 179.05 1cfe h LEU 70 N 0.84 0.55 0.26 1.46 7.12 0.18 -0.94 115.31 124.78 1cfe h LEU 70 Ca 0.25 -0.27 -0.01 0.00 0.13 0.00 0.00 57.88 57.98 1cfe h LEU 70 Cb -0.03 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 39.95 1cfe h LEU 70 CO -0.06 0.94 -0.12 -0.50 -0.13 0.00 0.00 178.44 178.57 1cfe h TRP 71 N 0.40 -0.32 0.00 1.25 6.55 -0.23 -2.86 115.95 120.74 1cfe h TRP 71 Ca 0.02 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.85 1cfe h TRP 71 Cb 0.99 0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.39 1cfe h TRP 71 CO 0.04 -0.09 0.00 0.28 -1.05 0.00 0.00 178.44 177.62 1cfe n VAL 72 N -5.17 1.38 0.24 1.49 0.31 0.28 -2.84 118.33 114.02 1cfe n VAL 72 Ca -0.10 0.41 0.13 0.00 -0.01 0.00 0.00 64.34 64.78 1cfe n VAL 72 Cb 0.20 -1.31 0.70 0.00 -0.91 0.00 0.00 33.84 32.53 1cfe n VAL 72 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1cfe h SER 73 N 0.00 0.00 0.00 4.52 0.02 -0.93 -1.44 113.55 115.72 1cfe h SER 73 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1cfe h SER 73 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1cfe h SER 73 CO 0.00 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 173.85 1cfe n GLU 74 N -2.51 0.64 -0.27 3.45 0.28 -1.13 -4.36 120.64 116.73 1cfe n GLU 74 Ca -0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 56.97 1cfe n GLU 74 Cb 0.20 -1.02 0.03 0.00 1.43 0.00 0.00 31.44 32.08 1cfe n GLU 74 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1cfe n ARG 75 N -0.46 -0.17 0.00 3.44 1.74 -0.54 -0.58 116.66 120.09 1cfe n ARG 75 Ca 0.00 1.08 0.09 0.00 -0.77 0.00 0.00 57.85 58.25 1cfe n ARG 75 Cb 0.01 -1.60 0.56 0.00 -1.02 0.00 0.00 32.46 30.41 1cfe n ARG 75 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1cfe n PRO 76 N -5.03 0.75 0.00 5.56 -0.04 -1.26 -3.27 135.00 131.71 1cfe n PRO 76 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1cfe n PRO 76 Cb 0.28 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1cfe n PRO 76 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1cfe n SER 77 N -0.89 4.52 -4.72 3.54 3.41 0.25 -4.92 113.62 114.81 1cfe n SER 77 Ca 0.14 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.35 1cfe n SER 77 Cb 0.06 0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 1cfe n SER 77 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1cfe s TYR 78 N -1.98 3.68 -0.08 7.33 -0.85 -0.26 -2.35 117.35 122.83 1cfe s TYR 78 Ca 0.00 1.53 -0.16 0.00 -0.52 0.00 0.00 57.07 57.92 1cfe s TYR 78 Cb 0.00 -2.94 0.04 0.00 0.38 0.00 0.00 41.96 39.43 1cfe s TYR 78 CO 0.00 0.13 0.39 1.21 -1.52 0.00 0.00 175.55 175.76 1cfe s ASN 79 N 0.50 -0.34 0.12 -0.18 3.84 -1.15 -4.77 114.94 112.95 1cfe s ASN 79 Ca 0.44 0.49 0.00 0.00 0.21 0.00 0.00 52.86 54.00 1cfe s ASN 79 Cb -0.20 0.58 0.00 0.00 -0.55 0.00 0.00 41.25 41.08 1cfe s ASN 79 CO 0.24 -0.32 0.00 0.00 -2.79 0.00 0.00 177.10 174.24 1cfe n TYR 80 N 1.99 -0.57 0.00 0.43 9.36 -1.26 -3.73 117.16 123.39 1cfe n TYR 80 Ca -0.17 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.05 1cfe n TYR 80 Cb 0.57 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.28 1cfe n TYR 80 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cfe n ALA 81 N -3.00 0.00 0.02 2.98 0.00 -1.26 -4.12 120.51 115.12 1cfe n ALA 81 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1cfe n ALA 81 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1cfe n ALA 81 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1cfe n THR 82 N 0.00 0.88 -2.48 0.00 -2.24 -1.26 -4.98 114.28 104.19 1cfe n THR 82 Ca 0.00 -0.65 -0.16 0.00 -2.27 0.00 0.00 64.05 60.96 1cfe n THR 82 Cb 0.00 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 1cfe n THR 82 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1cfe n ASN 83 N -2.71 -4.89 -3.71 3.42 2.85 -1.26 -4.99 115.26 103.98 1cfe n ASN 83 Ca -0.10 -0.08 -0.16 0.00 -0.11 0.00 0.00 54.58 54.12 1cfe n ASN 83 Cb 0.78 -3.92 -0.09 0.00 1.24 0.00 0.00 39.78 37.79 1cfe n ASN 83 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1cfe s GLN 84 N -5.01 1.53 -0.33 1.20 -1.52 -1.24 -5.00 119.66 109.29 1cfe s GLN 84 Ca 0.08 -1.86 0.09 0.00 -1.95 0.00 0.00 55.36 51.72 1cfe s GLN 84 Cb -0.03 0.29 0.66 0.00 -0.22 0.00 0.00 33.01 33.71 1cfe s GLN 84 CO 0.10 -0.54 1.72 0.00 -0.25 0.00 0.00 175.29 176.32 1cfe n VAL 86 N -0.60 0.00 -1.84 0.00 0.31 -0.99 -2.62 118.33 112.58 1cfe n VAL 86 Ca 0.41 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.33 1cfe n VAL 86 Cb 1.33 -0.03 -0.00 0.00 -0.91 0.00 0.00 33.84 34.22 1cfe n VAL 86 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1cfe n GLY 87 N -0.31 4.54 0.00 2.92 0.00 -1.26 -4.91 105.19 106.17 1cfe n GLY 87 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1cfe n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cfe n GLY 88 N 3.51 1.38 0.00 -0.02 0.00 -1.08 -5.06 105.19 103.92 1cfe n GLY 88 Ca 0.54 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1cfe n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cfe n LYS 89 N 0.00 2.28 -1.81 1.61 4.76 -1.26 -5.02 118.16 118.72 1cfe n LYS 89 Ca 0.00 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.01 1cfe n LYS 89 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 1cfe n LYS 89 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1cfe s LYS 90 N -0.70 3.30 0.00 1.97 2.20 -1.26 -4.86 119.74 120.39 1cfe s LYS 90 Ca 0.00 1.77 0.00 0.00 -0.36 0.00 0.00 55.97 57.38 1cfe s LYS 90 Cb 0.00 -4.27 0.00 0.00 -1.51 0.00 0.00 37.83 32.05 1cfe s LYS 90 CO 0.00 -1.90 0.00 0.00 -0.36 0.00 0.00 175.35 173.09 1cfe n ARG 92 N -0.05 -1.48 0.00 0.00 5.12 -1.26 -4.72 116.66 114.26 1cfe n ARG 92 Ca 0.00 0.18 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 1cfe n ARG 92 Cb 0.00 -4.23 0.00 0.00 -1.16 0.00 0.00 32.46 27.07 1cfe n ARG 92 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1cfe n HIS 93 N -4.38 -0.96 -0.30 -1.55 8.25 -1.26 -4.86 115.22 110.16 1cfe n HIS 93 Ca -0.15 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.35 1cfe n HIS 93 Cb 0.60 0.42 0.19 0.00 1.12 0.00 0.00 29.99 32.32 1cfe n HIS 93 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1cfe h TYR 94 N 0.00 0.90 -0.70 4.41 5.03 -1.83 0.33 116.97 125.11 1cfe h TYR 94 Ca 0.00 0.03 0.07 0.00 2.58 0.00 0.00 58.73 61.41 1cfe h TYR 94 Cb 0.00 -0.27 -0.09 0.00 1.55 0.00 0.00 36.73 37.92 1cfe h TYR 94 CO 0.00 0.35 -0.41 0.25 -1.32 0.00 0.00 178.16 177.03 1cfe n THR 95 N -4.73 -0.47 -0.02 1.81 -2.24 -1.26 -0.03 114.28 107.33 1cfe n THR 95 Ca 0.15 1.69 -0.16 0.00 -2.27 0.00 0.00 64.05 63.46 1cfe n THR 95 Cb 0.31 -2.10 -0.05 0.00 -2.10 0.00 0.00 70.33 66.39 1cfe n THR 95 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1cfe h GLN 96 N 0.00 0.76 -0.22 -0.78 5.75 -1.31 -1.79 115.11 117.52 1cfe h GLN 96 Ca 0.12 -0.59 0.03 0.00 -0.15 0.00 0.00 58.65 58.06 1cfe h GLN 96 Cb 0.29 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.95 1cfe h GLN 96 CO -0.66 1.21 0.15 0.28 -2.65 0.00 0.00 178.83 177.15 1cfe h VAL 97 N 0.53 0.98 0.00 2.39 2.07 -0.14 -1.69 116.25 120.39 1cfe h VAL 97 Ca -0.04 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1cfe h VAL 97 Cb 1.35 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1cfe h VAL 97 CO 0.15 0.03 -0.39 0.55 0.02 0.00 0.00 177.57 177.93 1cfe n VAL 98 N -4.50 0.29 -1.54 2.57 3.14 0.96 -4.69 118.33 114.56 1cfe n VAL 98 Ca 0.01 -0.19 -0.39 0.00 -2.96 0.00 0.00 64.34 60.81 1cfe n VAL 98 Cb 0.18 -0.20 -0.05 0.00 -1.06 0.00 0.00 33.84 32.71 1cfe n VAL 98 CO 0.00 0.00 0.00 1.87 -6.46 0.00 0.00 176.83 172.24 1cfe n TRP 99 N -1.94 1.37 -0.22 1.45 -0.00 -0.64 -4.74 117.44 112.72 1cfe n TRP 99 Ca 0.05 0.15 0.03 0.00 -0.00 0.00 0.00 57.50 57.72 1cfe n TRP 99 Cb 0.40 -2.60 0.13 0.00 -0.00 0.00 0.00 31.31 29.25 1cfe n TRP 99 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 177.69 177.60 1cfe h ARG 100 N 17.11 0.15 -0.07 5.87 2.43 -0.97 -1.18 114.38 137.72 1cfe h ARG 100 Ca -0.23 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 1cfe h ARG 100 Cb 1.28 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 1cfe h ARG 100 CO 1.16 0.10 -0.07 -0.91 -1.51 0.00 0.00 179.97 178.74 1cfe h ASN 101 N 0.15 0.09 -1.60 -3.80 2.35 -1.81 -3.36 115.58 107.60 1cfe h ASN 101 Ca 0.36 -0.01 -0.64 0.00 -0.55 0.00 0.00 56.30 55.46 1cfe h ASN 101 Cb 0.60 -0.02 -0.13 0.00 0.05 0.00 0.00 38.32 38.82 1cfe h ASN 101 CO -0.55 0.18 1.26 -0.94 -1.65 0.00 0.00 177.43 175.73 1cfe s SER 102 N -6.97 6.56 -0.28 5.81 1.04 -0.45 -4.40 113.70 115.01 1cfe s SER 102 Ca -0.05 -1.69 0.04 0.00 0.48 0.00 0.00 55.95 54.73 1cfe s SER 102 Cb 0.16 -2.51 0.49 0.00 0.10 0.00 0.00 66.02 64.27 1cfe s SER 102 CO 0.70 -1.33 1.58 1.33 0.98 0.00 0.00 173.24 176.49 1cfe n VAL 103 N 6.35 2.39 -4.10 5.02 0.24 -1.25 -4.79 118.33 122.20 1cfe n VAL 103 Ca 0.30 -1.25 -0.13 0.00 -2.04 0.00 0.00 64.34 61.22 1cfe n VAL 103 Cb 0.50 -0.57 -0.11 0.00 -1.47 0.00 0.00 33.84 32.19 1cfe n VAL 103 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1cfe s ARG 104 N -2.27 0.64 0.05 7.34 3.00 -1.24 -4.40 118.95 122.06 1cfe s ARG 104 Ca 0.39 -0.93 -0.18 0.00 0.00 0.00 0.00 55.73 55.01 1cfe s ARG 104 Cb 0.32 -0.32 0.04 0.00 0.00 0.00 0.00 34.95 34.98 1cfe s ARG 104 CO 0.08 0.05 0.41 -1.17 0.00 0.00 0.00 175.30 174.67 1cfe s LEU 105 N -1.98 0.43 -0.30 2.53 1.98 -1.04 -4.28 118.68 116.02 1cfe s LEU 105 Ca -0.03 -0.02 -0.16 0.00 -2.89 0.00 0.00 54.13 51.03 1cfe s LEU 105 Cb -0.06 1.72 0.18 0.00 0.66 0.00 0.00 46.19 48.69 1cfe s LEU 105 CO -0.01 -0.66 1.17 -0.83 -1.89 0.00 0.00 176.35 174.13 1cfe s GLY 106 N -2.02 -0.46 -0.06 7.98 0.00 -1.21 0.23 107.32 111.78 1cfe s GLY 106 Ca -0.05 2.74 0.04 0.00 0.00 0.00 0.00 44.72 47.45 1cfe s GLY 106 CO -0.03 4.07 -0.20 0.00 0.00 0.00 0.00 173.10 176.94 1cfe n GLY 108 N 3.26 2.70 3.46 0.00 0.00 -0.52 -4.79 105.19 109.30 1cfe n GLY 108 Ca -0.19 -2.16 0.01 0.00 0.00 0.00 0.00 46.02 43.69 1cfe n GLY 108 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cfe s ARG 109 N -1.95 0.42 0.21 1.61 3.52 -1.26 -4.43 118.95 117.07 1cfe s ARG 109 Ca 0.00 1.01 0.06 0.00 -0.13 0.00 0.00 55.73 56.67 1cfe s ARG 109 Cb 0.00 0.61 -0.05 0.00 -1.56 0.00 0.00 34.95 33.95 1cfe s ARG 109 CO 0.00 -0.19 -0.09 0.00 -0.81 0.00 0.00 175.30 174.21 1cfe s ALA 110 N 2.69 1.87 0.20 6.12 0.00 -0.07 -4.90 121.76 127.66 1cfe s ALA 110 Ca -0.02 -1.67 -0.04 0.00 0.00 0.00 0.00 51.96 50.24 1cfe s ALA 110 Cb -0.09 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.08 1cfe s ALA 110 CO -0.18 -0.06 0.42 0.50 0.00 0.00 0.00 175.76 176.44 1cfe s ARG 111 N -3.73 3.59 -0.18 0.00 3.00 -1.26 -0.53 118.95 119.84 1cfe s ARG 111 Ca 0.23 -0.14 -0.09 0.00 -1.00 0.00 0.00 55.73 54.73 1cfe s ARG 111 Cb 0.02 -2.80 -0.05 0.00 0.00 0.00 0.00 34.95 32.13 1cfe s ARG 111 CO 0.06 0.39 0.13 0.00 0.00 0.00 0.00 175.30 175.88 1cfe h ASN 113 N 6.23 0.00 0.17 0.00 4.21 -1.83 0.77 115.58 125.13 1cfe h ASN 113 Ca -0.45 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.06 1cfe h ASN 113 Cb 1.17 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.37 1cfe h ASN 113 CO 0.71 0.00 0.00 -0.46 -1.29 0.00 0.00 177.43 176.39 1cfe n ASN 114 N -3.60 0.03 0.00 5.81 6.94 -1.26 -4.83 115.26 118.35 1cfe n ASN 114 Ca -0.01 0.51 0.00 0.00 -0.02 0.00 0.00 54.58 55.06 1cfe n ASN 114 Cb 0.20 -0.52 0.00 0.00 -2.36 0.00 0.00 39.78 37.10 1cfe n ASN 114 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cfe n GLY 115 N -0.98 3.15 0.00 4.83 0.00 0.26 -5.07 105.19 107.37 1cfe n GLY 115 Ca 0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1cfe n GLY 115 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1cfe n TRP 116 N 0.00 -1.04 -4.55 1.61 8.01 -1.23 -4.62 117.44 115.62 1cfe n TRP 116 Ca 0.00 0.00 -0.26 0.00 -1.31 0.00 0.00 57.50 55.93 1cfe n TRP 116 Cb 0.00 0.00 -0.11 0.00 -2.01 0.00 0.00 31.31 29.19 1cfe n TRP 116 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 1cfe s TRP 117 N -0.24 2.39 -0.18 -5.99 0.52 -1.26 -0.61 118.94 113.58 1cfe s TRP 117 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 56.10 55.59 1cfe s TRP 117 Cb 0.00 -1.41 0.04 0.00 -1.15 0.00 0.00 33.47 30.94 1cfe s TRP 117 CO 0.00 0.55 -0.10 0.12 0.02 0.00 0.00 176.95 177.53 1cfe s PHE 118 N -2.65 2.20 -0.24 -1.98 5.36 0.31 -0.92 117.98 120.05 1cfe s PHE 118 Ca 0.33 -1.38 -0.07 0.00 -0.96 0.00 0.00 56.93 54.85 1cfe s PHE 118 Cb 0.04 -1.56 -0.03 0.00 -0.34 0.00 0.00 43.02 41.13 1cfe s PHE 118 CO 0.16 -0.69 0.07 0.42 -1.46 0.00 0.00 175.22 173.72 1cfe s ILE 119 N 1.47 4.37 0.23 3.12 1.09 -0.38 -0.89 121.20 130.21 1cfe s ILE 119 Ca 0.01 -0.15 0.04 0.00 -1.10 0.00 0.00 60.65 59.44 1cfe s ILE 119 Cb -0.15 -3.04 -0.03 0.00 -1.06 0.00 0.00 42.46 38.18 1cfe s ILE 119 CO -0.09 0.35 0.37 -0.94 -0.10 0.00 0.00 174.94 174.53 1cfe s SER 120 N 1.51 6.33 -0.22 3.58 1.04 -1.26 -1.33 113.70 123.35 1cfe s SER 120 Ca 0.06 0.15 -0.06 0.00 0.48 0.00 0.00 55.95 56.58 1cfe s SER 120 Cb -0.15 -1.90 0.11 0.00 0.10 0.00 0.00 66.02 64.18 1cfe s SER 120 CO 0.04 -0.07 0.42 0.00 0.98 0.00 0.00 173.24 174.61 1cfe s ASN 122 N 2.61 6.46 -0.03 0.00 3.84 -0.63 -2.42 114.94 124.79 1cfe s ASN 122 Ca 0.03 0.58 0.01 0.00 0.21 0.00 0.00 52.86 53.69 1cfe s ASN 122 Cb -0.13 -2.09 0.01 0.00 -0.55 0.00 0.00 41.25 38.50 1cfe s ASN 122 CO -0.14 -0.02 -0.04 -0.31 -2.79 0.00 0.00 177.10 173.80 1cfe s TYR 123 N -1.79 0.55 -0.03 0.43 1.51 0.38 -3.29 117.35 115.11 1cfe s TYR 123 Ca 0.41 -0.11 0.07 0.00 -1.01 0.00 0.00 57.07 56.43 1cfe s TYR 123 Cb -0.12 -0.48 -0.02 0.00 -0.11 0.00 0.00 41.96 41.24 1cfe s TYR 123 CO 0.26 -0.11 -0.24 0.34 -1.11 0.00 0.00 175.55 174.69 1cfe s ASP 124 N 0.56 3.19 1.22 2.29 -1.08 -1.26 -4.27 116.67 117.31 1cfe s ASP 124 Ca -0.07 -0.44 -0.17 0.00 -0.52 0.00 0.00 52.55 51.36 1cfe s ASP 124 Cb -0.10 -0.49 0.25 0.00 -1.46 0.00 0.00 42.92 41.11 1cfe s ASP 124 CO -0.00 0.31 0.85 -0.81 0.52 0.00 0.00 175.17 176.04 1cfe n PRO 125 N 2.51 -2.87 -1.31 4.34 -0.04 -1.26 -3.68 135.00 132.69 1cfe n PRO 125 Ca -0.16 -1.37 -0.34 0.00 -0.04 0.00 0.00 63.50 61.59 1cfe n PRO 125 Cb 0.51 -1.32 0.11 0.00 -0.04 0.00 0.00 33.50 32.76 1cfe n PRO 125 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1cfe s VAL 126 N -2.50 2.13 0.41 0.52 -7.23 -1.26 -4.71 120.40 107.76 1cfe s VAL 126 Ca 0.56 0.06 0.07 0.00 -1.81 0.00 0.00 61.98 60.87 1cfe s VAL 126 Cb -0.06 -2.61 -0.06 0.00 0.56 0.00 0.00 36.38 34.22 1cfe s VAL 126 CO 0.43 -0.04 0.14 -0.83 -0.31 0.00 0.00 175.10 174.50 1cfe s GLY 127 N -2.01 2.35 0.00 2.32 0.00 -1.12 -4.68 107.32 104.17 1cfe s GLY 127 Ca 0.75 -2.14 0.00 0.00 0.00 0.00 0.00 44.72 43.33 1cfe s GLY 127 CO 0.47 -1.94 0.00 0.70 0.00 0.00 0.00 173.10 172.33 1cfe n ASN 128 N -1.17 -1.59 -4.92 1.64 3.02 -1.24 -3.95 115.26 107.05 1cfe n ASN 128 Ca -0.02 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.24 1cfe n ASN 128 Cb 0.65 -2.66 -0.04 0.00 -0.61 0.00 0.00 39.78 37.12 1cfe n ASN 128 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1cfe s TRP 129 N -1.10 3.48 1.02 3.10 -0.11 -1.26 -4.99 118.94 119.08 1cfe s TRP 129 Ca 0.00 0.40 -0.11 0.00 1.22 0.00 0.00 56.10 57.61 1cfe s TRP 129 Cb 0.00 -1.89 0.19 0.00 -1.50 0.00 0.00 33.47 30.27 1cfe s TRP 129 CO 0.00 0.41 1.01 1.51 -4.62 0.00 0.00 176.95 175.26 1cfe n ILE 130 N -0.37 0.00 0.00 5.86 0.13 -1.26 -3.30 119.36 120.42 1cfe n ILE 130 Ca -0.04 -0.18 0.00 0.00 -1.10 0.00 0.00 62.75 61.43 1cfe n ILE 130 Cb 0.53 -0.96 0.00 0.00 -0.84 0.00 0.00 39.64 38.37 1cfe n ILE 130 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1cfe n GLY 131 N 0.67 1.37 0.07 4.50 0.00 -1.26 -4.55 105.19 105.99 1cfe n GLY 131 Ca 0.08 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1cfe n GLY 131 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1cfe h GLN 132 N 0.00 0.00 -0.35 1.61 4.20 -1.96 -3.51 115.11 115.10 1cfe h GLN 132 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1cfe h GLN 132 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1cfe h GLN 132 CO 0.00 0.75 -0.08 0.54 -0.67 0.00 0.00 178.83 179.36 1cfe n ARG 133 N -4.60 -0.43 0.07 1.46 1.74 -1.21 -4.88 116.66 108.82 1cfe n ARG 133 Ca -0.13 0.32 -0.12 0.00 -0.77 0.00 0.00 57.85 57.14 1cfe n ARG 133 Cb 0.43 -0.36 -0.08 0.00 -1.02 0.00 0.00 32.46 31.43 1cfe n ARG 133 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1cfe h PRO 134 N 0.17 -0.21 0.00 5.56 0.13 -1.88 -3.40 132.00 132.36 1cfe h PRO 134 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1cfe h PRO 134 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1cfe h PRO 134 CO 0.00 0.20 0.00 2.48 -0.23 0.00 0.00 178.00 180.45