#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfe s ASN 2 N 0.00 4.04 0.00 1.08 2.47 -1.26 -0.75 114.94 120.52 1cfe s ASN 2 Ca 0.00 0.20 0.00 0.00 0.42 0.00 0.00 52.86 53.48 1cfe s ASN 2 Cb 0.00 -0.55 0.00 0.00 -1.45 0.00 0.00 41.25 39.25 1cfe s ASN 2 CO 0.00 -2.11 0.00 -1.20 -3.72 0.00 0.00 177.10 170.07 1cfe n SER 3 N -3.24 0.00 0.03 -4.21 7.64 -1.26 -4.27 113.62 108.31 1cfe n SER 3 Ca 0.12 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.88 1cfe n SER 3 Cb 0.60 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.71 1cfe n SER 3 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1cfe h PRO 4 N 0.00 -0.09 -1.08 1.43 0.13 -1.98 -2.97 132.00 127.44 1cfe h PRO 4 Ca 0.00 0.01 0.29 0.00 -0.87 0.00 0.00 66.00 65.43 1cfe h PRO 4 Cb 0.00 0.02 -0.09 0.00 0.13 0.00 0.00 31.00 31.06 1cfe h PRO 4 CO 0.00 0.29 0.71 0.37 -0.23 0.00 0.00 178.00 179.14 1cfe h GLN 5 N -0.49 0.29 -0.08 0.86 5.75 -1.99 -0.59 115.11 118.86 1cfe h GLN 5 Ca -0.01 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1cfe h GLN 5 Cb 0.42 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.89 1cfe h GLN 5 CO 0.02 0.19 0.02 -0.44 -2.65 0.00 0.00 178.83 175.97 1cfe h ASP 6 N 0.30 0.02 -0.01 -0.69 5.19 -1.70 0.34 116.42 119.88 1cfe h ASP 6 Ca 0.61 0.01 0.03 0.00 -0.62 0.00 0.00 57.03 57.06 1cfe h ASP 6 Cb 1.72 0.01 -0.04 0.00 0.18 0.00 0.00 39.33 41.20 1cfe h ASP 6 CO -0.26 0.03 -0.23 1.88 -3.12 0.00 0.00 179.24 177.54 1cfe h TYR 7 N 0.06 -0.61 -0.61 4.55 0.05 -1.21 0.25 116.97 119.46 1cfe h TYR 7 Ca 0.03 0.02 0.11 0.00 0.05 0.00 0.00 58.73 58.94 1cfe h TYR 7 Cb 0.02 0.27 -0.12 0.00 1.01 0.00 0.00 36.73 37.91 1cfe h TYR 7 CO -0.10 -0.32 -0.33 -0.07 -1.05 0.00 0.00 178.16 176.30 1cfe h LEU 8 N -0.35 -1.14 0.39 3.88 3.38 -1.31 -0.41 115.31 119.75 1cfe h LEU 8 Ca 0.06 0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1cfe h LEU 8 Cb 0.44 0.57 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1cfe h LEU 8 CO -0.21 -0.30 -0.25 0.00 0.09 0.00 0.00 178.44 177.77 1cfe h ALA 9 N 1.04 -0.61 -0.77 1.53 0.00 0.92 0.31 119.26 121.67 1cfe h ALA 9 Ca 0.24 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1cfe h ALA 9 Cb 0.55 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1cfe h ALA 9 CO -0.69 -0.86 0.34 0.28 0.00 0.00 0.00 179.25 178.33 1cfe h VAL 10 N -0.62 1.25 -0.21 0.00 2.07 -0.76 0.26 116.25 118.24 1cfe h VAL 10 Ca -0.04 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1cfe h VAL 10 Cb 0.51 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1cfe h VAL 10 CO 0.04 0.31 0.13 0.45 0.02 0.00 0.00 177.57 178.52 1cfe h HIS 11 N 1.11 0.27 -0.25 1.57 -0.00 -0.78 -1.06 115.15 116.00 1cfe h HIS 11 Ca 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.61 1cfe h HIS 11 Cb 0.16 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 1cfe h HIS 11 CO 0.01 0.19 0.03 -0.91 -0.00 0.00 0.00 177.93 177.26 1cfe h ASN 12 N 0.26 0.33 0.61 2.45 2.35 0.37 0.10 115.58 122.06 1cfe h ASN 12 Ca 0.07 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1cfe h ASN 12 Cb 0.00 -0.09 0.01 0.00 0.05 0.00 0.00 38.32 38.29 1cfe h ASN 12 CO -0.01 0.37 -0.30 -0.78 -1.65 0.00 0.00 177.43 175.06 1cfe h ASP 13 N 0.36 -0.72 -0.60 5.81 1.82 -0.11 0.28 116.42 123.26 1cfe h ASP 13 Ca 0.09 0.03 0.12 0.00 -0.39 0.00 0.00 57.03 56.87 1cfe h ASP 13 Cb 0.20 0.19 -0.10 0.00 0.68 0.00 0.00 39.33 40.30 1cfe h ASP 13 CO 0.00 -0.50 0.05 0.00 -1.61 0.00 0.00 179.24 177.18 1cfe h ALA 14 N -1.60 0.64 -0.75 -0.78 0.00 -0.92 0.22 119.26 116.07 1cfe h ALA 14 Ca -0.08 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1cfe h ALA 14 Cb 0.64 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1cfe h ALA 14 CO 0.13 -0.36 0.46 0.00 0.00 0.00 0.00 179.25 179.48 1cfe h ARG 15 N 0.17 0.84 -0.91 0.00 3.08 -0.79 -1.34 114.38 115.42 1cfe h ARG 15 Ca 0.31 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.39 1cfe h ARG 15 Cb 0.50 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 1cfe h ARG 15 CO -0.47 0.55 0.57 0.00 -1.07 0.00 0.00 179.97 179.55 1cfe h ALA 16 N 1.35 1.28 0.00 0.04 0.00 0.27 0.46 119.26 122.66 1cfe h ALA 16 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1cfe h ALA 16 Cb 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1cfe h ALA 16 CO -0.15 0.29 0.00 1.04 0.00 0.00 0.00 179.25 180.43 1cfe n GLN 17 N -4.61 0.41 -0.67 0.00 6.02 -0.19 -1.13 117.38 117.20 1cfe n GLN 17 Ca 0.14 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.16 1cfe n GLN 17 Cb 0.22 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.01 1cfe n GLN 17 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1cfe n VAL 18 N -1.01 0.39 -3.33 5.09 0.24 0.06 -5.02 118.33 114.76 1cfe n VAL 18 Ca 0.10 -0.73 -0.20 0.00 -2.04 0.00 0.00 64.34 61.47 1cfe n VAL 18 Cb 0.05 0.47 -0.02 0.00 -1.47 0.00 0.00 33.84 32.86 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 -0.16 -0.47 3.86 7.63 0.00 0.14 -4.95 105.19 111.24 1cfe n GLY 19 Ca 0.05 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.71 4.66 0.57 1.61 1.01 0.28 -4.95 120.40 120.87 1cfe s VAL 20 Ca 0.36 0.92 -0.16 0.00 0.00 0.00 0.00 61.98 63.10 1cfe s VAL 20 Cb -0.20 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1cfe s VAL 20 CO 0.44 -0.59 1.05 -0.83 0.00 0.00 0.00 175.10 175.17 1cfe s GLY 21 N -3.08 2.15 0.86 4.51 0.00 -1.26 -4.43 107.32 106.08 1cfe s GLY 21 Ca 0.55 0.38 -0.12 0.00 0.00 0.00 0.00 44.72 45.53 1cfe s GLY 21 CO 0.31 0.70 1.21 2.56 0.00 0.00 0.00 173.10 177.88 1cfe s PRO 22 N -4.00 1.35 0.28 2.90 0.04 -1.26 -5.03 135.00 129.28 1cfe s PRO 22 Ca 0.63 -0.27 -0.17 0.00 0.04 0.00 0.00 61.00 61.23 1cfe s PRO 22 Cb -0.15 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1cfe s PRO 22 CO 0.35 -1.93 0.61 0.00 0.04 0.00 0.00 177.00 176.08 1cfe s MET 23 N -5.65 1.72 0.49 4.56 0.23 -1.26 -5.00 119.30 114.39 1cfe s MET 23 Ca 0.68 -1.16 0.04 0.00 -1.03 0.00 0.00 55.69 54.22 1cfe s MET 23 Cb -0.07 0.55 0.04 0.00 -1.53 0.00 0.00 34.83 33.81 1cfe s MET 23 CO 0.50 -0.76 0.33 -1.13 -2.03 0.00 0.00 175.02 171.93 1cfe n SER 24 N -0.52 2.66 -4.78 -1.18 3.41 -1.26 -5.04 113.62 106.92 1cfe n SER 24 Ca -0.03 -2.74 -0.29 0.00 -0.26 0.00 0.00 58.87 55.55 1cfe n SER 24 Cb 0.60 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.68 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 -2.48 2.56 -0.07 7.33 -0.11 -1.26 -3.59 118.94 121.31 1cfe s TRP 25 Ca 0.25 0.98 -0.03 0.00 1.22 0.00 0.00 56.10 58.52 1cfe s TRP 25 Cb -0.02 -3.28 0.04 0.00 -1.50 0.00 0.00 33.47 28.71 1cfe s TRP 25 CO 0.16 -2.24 0.09 0.34 -4.62 0.00 0.00 176.95 170.68 1cfe s ASP 26 N -3.90 1.20 0.27 5.86 -1.08 -0.22 -4.69 116.67 114.12 1cfe s ASP 26 Ca 0.63 0.05 -0.02 0.00 -0.52 0.00 0.00 52.55 52.69 1cfe s ASP 26 Cb -0.15 -0.03 0.36 0.00 -1.46 0.00 0.00 42.92 41.63 1cfe s ASP 26 CO 0.54 -0.26 1.80 0.00 0.52 0.00 0.00 175.17 177.77 1cfe h ALA 27 N 8.42 1.16 -0.08 3.66 0.00 -1.98 -0.39 119.26 130.04 1cfe h ALA 27 Ca -0.13 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 1cfe h ALA 27 Cb 1.12 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1cfe h ALA 27 CO 0.17 0.56 -0.38 -0.91 0.00 0.00 0.00 179.25 178.70 1cfe h ASN 28 N 0.82 0.47 -0.74 0.00 2.35 -1.97 0.14 115.58 116.64 1cfe h ASN 28 Ca 0.17 -0.64 -0.06 0.00 -0.55 0.00 0.00 56.30 55.23 1cfe h ASN 28 Cb 0.34 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.53 1cfe h ASN 28 CO 0.00 1.04 0.24 -0.07 -1.65 0.00 0.00 177.43 176.99 1cfe h LEU 29 N -0.06 1.08 -0.92 1.61 3.38 -1.87 0.34 115.31 118.87 1cfe h LEU 29 Ca -0.02 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1cfe h LEU 29 Cb 1.02 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 1cfe h LEU 29 CO 0.08 0.99 0.61 0.00 0.09 0.00 0.00 178.44 180.21 1cfe h ALA 30 N 1.15 1.17 0.35 1.53 0.00 -0.88 0.18 119.26 122.76 1cfe h ALA 30 Ca 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1cfe h ALA 30 Cb 0.29 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1cfe h ALA 30 CO -0.01 0.55 -0.17 0.66 0.00 0.00 0.00 179.25 180.28 1cfe h SER 31 N 1.23 -0.40 -0.75 0.00 4.64 -0.08 0.43 113.55 118.62 1cfe h SER 31 Ca 0.34 -0.08 0.14 0.00 -0.47 0.00 0.00 61.79 61.72 1cfe h SER 31 Cb -0.12 0.10 -0.14 0.00 -0.31 0.00 0.00 62.40 61.93 1cfe h SER 31 CO -0.08 -0.16 -0.28 -0.09 -0.87 0.00 0.00 176.83 175.35 1cfe h ARG 32 N -0.62 -0.06 -0.16 4.77 9.65 -0.70 0.12 114.38 127.38 1cfe h ARG 32 Ca -0.05 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.82 1cfe h ARG 32 Cb 0.45 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 1cfe h ARG 32 CO 0.08 -0.04 0.03 0.00 2.80 0.00 0.00 179.97 182.84 1cfe h ALA 33 N 1.44 0.21 -0.49 2.80 0.00 -0.37 0.19 119.26 123.05 1cfe h ALA 33 Ca 0.32 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1cfe h ALA 33 Cb 0.57 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1cfe h ALA 33 CO -0.79 -0.12 0.30 0.37 0.00 0.00 0.00 179.25 179.01 1cfe h GLN 34 N 0.05 0.66 0.13 0.00 5.75 -0.45 0.67 115.11 121.93 1cfe h GLN 34 Ca 0.05 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1cfe h GLN 34 Cb 0.30 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1cfe h GLN 34 CO 0.00 0.47 -0.14 -0.91 -2.65 0.00 0.00 178.83 175.61 1cfe h ASN 35 N 0.65 -0.36 -0.04 -0.69 2.35 -0.59 0.46 115.58 117.37 1cfe h ASN 35 Ca 0.18 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1cfe h ASN 35 Cb -0.03 0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1cfe h ASN 35 CO -0.03 -0.21 0.02 0.22 -1.65 0.00 0.00 177.43 175.78 1cfe h TYR 36 N -0.30 0.06 -0.49 1.19 3.20 -0.33 0.13 116.97 120.44 1cfe h TYR 36 Ca 0.01 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.97 1cfe h TYR 36 Cb 0.28 -0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.46 1cfe h TYR 36 CO -0.13 0.12 0.03 0.00 -1.64 0.00 0.00 178.16 176.54 1cfe h ALA 37 N 0.93 0.48 0.66 1.82 0.00 -0.85 -2.69 119.26 119.62 1cfe h ALA 37 Ca 0.02 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1cfe h ALA 37 Cb 0.08 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1cfe h ALA 37 CO -0.00 -0.37 -0.35 -0.91 0.00 0.00 0.00 179.25 177.62 1cfe h ASN 38 N 0.15 -0.86 -0.81 0.00 2.35 0.17 -2.94 115.58 113.64 1cfe h ASN 38 Ca 0.25 0.04 0.06 0.00 -0.55 0.00 0.00 56.30 56.09 1cfe h ASN 38 Cb 0.36 0.23 -0.06 0.00 0.05 0.00 0.00 38.32 38.90 1cfe h ASN 38 CO -0.38 -0.57 0.50 0.28 -1.65 0.00 0.00 177.43 175.60 1cfe h SER 39 N -0.93 0.78 0.27 5.81 0.02 -0.76 -0.41 113.55 118.33 1cfe h SER 39 Ca -0.09 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1cfe h SER 39 Cb 0.73 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1cfe h SER 39 CO 0.13 0.50 0.00 0.54 -1.14 0.00 0.00 176.83 176.86 1cfe n ARG 40 N -4.65 0.58 -0.35 3.45 5.12 -1.02 -4.04 116.66 115.75 1cfe n ARG 40 Ca 0.11 0.02 0.12 0.00 -1.93 0.00 0.00 57.85 56.18 1cfe n ARG 40 Cb 0.16 -1.50 0.31 0.00 -1.16 0.00 0.00 32.46 30.28 1cfe n ARG 40 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cfe h ALA 41 N 3.44 1.65 -0.27 7.54 0.00 -0.88 0.47 119.26 131.21 1cfe h ALA 41 Ca 0.00 0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.06 1cfe h ALA 41 Cb 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1cfe h ALA 41 CO 0.00 -0.02 0.26 0.78 0.00 0.00 0.00 179.25 180.27 1cfe h GLY 42 N 0.79 0.00 0.00 0.00 0.00 -1.79 -3.26 103.07 98.80 1cfe h GLY 42 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 1cfe h GLY 42 CO -0.37 0.00 -0.35 1.34 0.00 0.00 0.00 176.54 177.16 1cfe n ASP 43 N -3.93 0.77 0.00 0.19 2.03 0.13 -5.02 116.55 110.72 1cfe n ASP 43 Ca 0.04 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.47 1cfe n ASP 43 Cb 0.41 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 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 -0.01 5.53 -3.43 0.00 3.02 -1.26 -4.79 115.26 114.32 1cfe n ASN 45 Ca 0.00 -2.62 -0.26 0.00 -0.03 0.00 0.00 54.58 51.67 1cfe n ASN 45 Cb 0.01 -1.32 -0.05 0.00 -0.61 0.00 0.00 39.78 37.81 1cfe n ASN 45 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1cfe n LEU 46 N 1.95 -0.50 -4.79 3.41 4.77 -1.26 -4.94 117.00 115.64 1cfe n LEU 46 Ca 0.36 -0.70 -0.38 0.00 -0.03 0.00 0.00 56.01 55.27 1cfe n LEU 46 Cb 0.77 -1.10 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 1cfe n LEU 46 CO 0.15 0.06 0.49 -0.63 -1.33 0.00 0.00 177.39 176.13 1cfe s ILE 47 N -2.44 4.41 0.00 -0.08 -1.09 -1.26 -4.79 121.20 115.94 1cfe s ILE 47 Ca 0.51 1.58 0.00 0.00 -2.23 0.00 0.00 60.65 60.51 1cfe s ILE 47 Cb -0.30 -4.02 0.00 0.00 -1.58 0.00 0.00 42.46 36.57 1cfe s ILE 47 CO 0.62 0.34 0.00 1.41 -1.23 0.00 0.00 174.94 176.09 1cfe n HIS 48 N 1.09 0.00 -3.17 3.97 8.25 -1.26 -5.07 115.22 119.03 1cfe n HIS 48 Ca -0.03 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.21 1cfe n HIS 48 Cb 0.50 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.56 1cfe n HIS 48 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1cfe n SER 49 N 0.00 1.61 0.00 0.41 3.41 -1.26 -4.54 113.62 113.25 1cfe n SER 49 Ca 0.00 -3.09 0.00 0.00 -0.26 0.00 0.00 58.87 55.52 1cfe n SER 49 Cb 0.00 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 1cfe n SER 49 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cfe n GLY 50 N 0.56 0.76 0.00 5.00 0.00 -1.26 -4.88 105.19 105.36 1cfe n GLY 50 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.54 0.00 -0.57 4.61 0.00 -1.26 -4.74 120.51 118.01 1cfe n ALA 51 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1cfe n ALA 51 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 5.00 2.58 3.40 0.00 0.00 -1.11 -4.47 105.19 110.59 1cfe n GLY 52 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 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 0.10 1.68 -0.01 1.61 8.01 -1.26 -0.61 118.70 128.22 1cfe s GLU 53 Ca 0.09 -1.20 0.00 0.00 0.01 0.00 0.00 54.97 53.87 1cfe s GLU 53 Cb 0.04 -2.00 0.01 0.00 -4.31 0.00 0.00 34.13 27.87 1cfe s GLU 53 CO -0.00 0.49 -0.00 1.21 0.01 0.00 0.00 175.26 176.97 1cfe s ASN 54 N -1.74 0.12 0.16 -0.19 3.84 -0.03 -4.46 114.94 112.64 1cfe s ASN 54 Ca 0.14 -0.01 0.07 0.00 0.21 0.00 0.00 52.86 53.27 1cfe s ASN 54 Cb -0.10 -0.04 -0.04 0.00 -0.55 0.00 0.00 41.25 40.52 1cfe s ASN 54 CO 0.05 -0.03 -0.14 -0.76 -2.79 0.00 0.00 177.10 173.44 1cfe s LEU 55 N 0.28 2.49 0.10 3.21 1.43 -1.26 -0.66 118.68 124.27 1cfe s LEU 55 Ca -0.02 -0.93 -0.19 0.00 -1.03 0.00 0.00 54.13 51.95 1cfe s LEU 55 Cb -0.04 -0.59 0.05 0.00 0.03 0.00 0.00 46.19 45.64 1cfe s LEU 55 CO -0.01 -0.18 0.47 0.00 0.23 0.00 0.00 176.35 176.87 1cfe s ALA 56 N -2.67 -1.17 0.17 4.21 0.00 -0.11 -4.95 121.76 117.24 1cfe s ALA 56 Ca 0.16 0.26 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1cfe s ALA 56 Cb -0.02 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1cfe s ALA 56 CO 0.04 -0.61 -0.17 -1.59 0.00 0.00 0.00 175.76 173.43 1cfe s LYS 57 N -3.30 1.26 -0.21 0.00 0.00 -1.26 -0.97 119.74 115.25 1cfe s LYS 57 Ca -0.00 -1.42 -0.15 0.00 0.00 0.00 0.00 55.97 54.40 1cfe s LYS 57 Cb 0.00 -1.25 0.06 0.00 0.00 0.00 0.00 37.83 36.64 1cfe s LYS 57 CO -0.09 0.25 0.54 0.20 0.00 0.00 0.00 175.35 176.25 1cfe s GLY 58 N -2.74 -0.44 0.26 0.59 0.00 -1.08 -4.98 107.32 98.94 1cfe s GLY 58 Ca 0.16 1.77 -0.22 0.00 0.00 0.00 0.00 44.72 46.43 1cfe s GLY 58 CO 0.06 1.73 0.80 -0.32 0.00 0.00 0.00 173.10 175.37 1cfe s GLY 59 N 1.03 2.66 0.00 0.20 0.00 -1.26 -0.85 107.32 109.10 1cfe s GLY 59 Ca -0.06 0.28 0.00 0.00 0.00 0.00 0.00 44.72 44.94 1cfe s GLY 59 CO -0.09 0.65 0.00 0.61 0.00 0.00 0.00 173.10 174.27 1cfe n GLY 60 N 0.61 -1.96 1.48 0.20 0.00 -1.26 -4.71 105.19 99.54 1cfe n GLY 60 Ca -0.01 -0.44 -0.03 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 -1.05 -4.50 1.61 5.68 -1.26 -4.76 116.55 112.26 1cfe n ASP 61 Ca 0.00 0.14 -0.47 0.00 -0.50 0.00 0.00 54.79 53.97 1cfe n ASP 61 Cb 0.00 -1.28 -0.06 0.00 -1.14 0.00 0.00 41.12 38.64 1cfe n ASP 61 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1cfe n PHE 62 N -1.49 1.65 -2.74 2.11 7.35 -1.26 -4.93 117.46 118.15 1cfe n PHE 62 Ca -0.04 0.14 -0.32 0.00 -0.76 0.00 0.00 57.45 56.48 1cfe n PHE 62 Cb 0.19 -2.60 -0.04 0.00 0.35 0.00 0.00 39.48 37.38 1cfe n PHE 62 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1cfe s THR 63 N 8.16 4.64 0.41 -2.13 -4.23 -1.26 -4.97 115.64 116.26 1cfe s THR 63 Ca 1.07 0.98 0.10 0.00 -1.18 0.00 0.00 61.69 62.66 1cfe s THR 63 Cb -0.65 -3.69 0.21 0.00 1.34 0.00 0.00 72.50 69.70 1cfe s THR 63 CO 0.43 -0.50 1.99 1.23 -0.54 0.00 0.00 174.62 177.23 1cfe h GLY 64 N 1.39 0.32 0.29 3.99 0.00 -1.91 -1.29 103.07 105.87 1cfe h GLY 64 Ca -0.47 -0.16 0.09 0.00 0.00 0.00 0.00 47.33 46.79 1cfe h GLY 64 CO 0.63 0.15 0.09 -0.09 0.00 0.00 0.00 176.54 177.33 1cfe h ARG 65 N 0.30 0.22 -0.96 4.80 2.43 -1.27 0.45 114.38 120.34 1cfe h ARG 65 Ca 0.07 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1cfe h ARG 65 Cb 0.19 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 1cfe h ARG 65 CO 0.00 0.15 0.63 0.00 -1.51 0.00 0.00 179.97 179.24 1cfe h ALA 66 N 1.42 1.26 0.43 2.80 0.00 -1.51 0.16 119.26 123.82 1cfe h ALA 66 Ca 0.27 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1cfe h ALA 66 Cb 0.37 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1cfe h ALA 66 CO -0.35 0.54 -0.20 0.00 0.00 0.00 0.00 179.25 179.23 1cfe h ALA 67 N 1.38 -0.57 -0.55 0.00 0.00 -0.96 0.24 119.26 118.81 1cfe h ALA 67 Ca 0.37 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1cfe h ALA 67 Cb -0.04 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1cfe h ALA 67 CO -0.11 -0.80 0.33 0.28 0.00 0.00 0.00 179.25 178.95 1cfe h VAL 68 N -0.61 1.06 -0.07 0.00 2.07 -0.65 0.83 116.25 118.87 1cfe h VAL 68 Ca -0.06 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.26 1cfe h VAL 68 Cb 0.46 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1cfe h VAL 68 CO 0.10 0.12 0.08 1.56 0.02 0.00 0.00 177.57 179.45 1cfe h GLN 69 N 0.65 0.00 -0.01 1.57 1.08 -0.51 0.16 115.11 118.05 1cfe h GLN 69 Ca 0.22 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.22 1cfe h GLN 69 Cb 0.03 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1cfe h GLN 69 CO -0.10 0.00 -0.78 1.25 -0.95 0.00 0.00 178.83 178.25 1cfe h LEU 70 N 0.00 0.70 -0.78 1.46 7.12 0.19 0.26 115.31 124.27 1cfe h LEU 70 Ca 0.03 -0.74 0.07 0.00 0.13 0.00 0.00 57.88 57.37 1cfe h LEU 70 Cb 0.20 -0.21 -0.06 0.00 -0.53 0.00 0.00 40.66 40.06 1cfe h LEU 70 CO -0.00 1.35 0.46 -0.50 -0.13 0.00 0.00 178.44 179.62 1cfe h TRP 71 N 0.12 0.85 -0.12 1.25 6.55 -0.35 -1.46 115.95 122.79 1cfe h TRP 71 Ca -0.09 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.77 1cfe h TRP 71 Cb 1.46 -0.27 0.00 0.00 -0.86 0.00 0.00 29.16 29.50 1cfe h TRP 71 CO 0.13 0.40 0.00 0.28 -1.05 0.00 0.00 178.44 178.20 1cfe n VAL 72 N -4.71 0.15 -0.32 1.49 0.31 0.41 -3.62 118.33 112.04 1cfe n VAL 72 Ca 0.11 -0.28 0.04 0.00 -0.01 0.00 0.00 64.34 64.20 1cfe n VAL 72 Cb 0.20 0.28 0.19 0.00 -0.91 0.00 0.00 33.84 33.60 1cfe n VAL 72 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1cfe h SER 73 N 1.89 0.76 0.00 4.52 4.64 0.66 0.17 113.55 126.19 1cfe h SER 73 Ca 0.00 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1cfe h SER 73 Cb 0.41 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1cfe h SER 73 CO 0.00 0.43 0.00 -0.62 -0.87 0.00 0.00 176.83 175.77 1cfe n GLU 74 N -4.70 0.56 -0.05 4.77 -0.58 -1.25 -4.44 120.64 114.95 1cfe n GLU 74 Ca 0.15 -0.03 -0.08 0.00 -0.42 0.00 0.00 57.16 56.78 1cfe n GLU 74 Cb 0.30 -1.26 -0.02 0.00 -0.57 0.00 0.00 31.44 29.88 1cfe n GLU 74 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1cfe h ARG 75 N 2.50 -0.03 -3.60 3.49 2.43 -0.95 -2.94 114.38 115.29 1cfe h ARG 75 Ca 0.01 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.57 1cfe h ARG 75 Cb 0.55 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1cfe h ARG 75 CO 0.02 -0.02 3.12 -0.35 -1.51 0.00 0.00 179.97 181.24 1cfe n PRO 76 N -5.23 2.74 0.00 0.20 -0.04 -1.26 -3.29 135.00 128.12 1cfe n PRO 76 Ca -0.02 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.38 1cfe n PRO 76 Cb 0.15 -2.86 0.00 0.00 -0.04 0.00 0.00 33.50 30.75 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 5.00 0.83 -4.63 3.54 3.41 -1.11 -4.96 113.62 115.71 1cfe n SER 77 Ca 0.59 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.78 1cfe n SER 77 Cb 0.27 0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.23 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 -1.19 3.19 -0.38 7.33 1.13 -1.21 0.03 117.35 126.26 1cfe s TYR 78 Ca 0.00 1.02 0.02 0.00 -1.41 0.00 0.00 57.07 56.70 1cfe s TYR 78 Cb 0.00 -3.42 0.11 0.00 -1.10 0.00 0.00 41.96 37.54 1cfe s TYR 78 CO 0.00 -0.65 0.11 1.21 -2.51 0.00 0.00 175.55 173.72 1cfe s ASN 79 N 1.60 4.88 -0.17 -0.18 2.47 -1.19 -4.95 114.94 117.40 1cfe s ASN 79 Ca 0.39 -2.20 -0.29 0.00 0.42 0.00 0.00 52.86 51.17 1cfe s ASN 79 Cb -0.13 -1.69 -0.05 0.00 -1.45 0.00 0.00 41.25 37.93 1cfe s ASN 79 CO 0.13 -0.41 1.88 -0.47 -3.72 0.00 0.00 177.10 174.51 1cfe s TYR 80 N 0.85 1.62 0.00 0.43 6.14 -1.26 -4.19 117.35 120.95 1cfe s TYR 80 Ca 0.11 0.31 0.00 0.00 0.64 0.00 0.00 57.07 58.13 1cfe s TYR 80 Cb -0.20 -4.04 0.00 0.00 0.42 0.00 0.00 41.96 38.14 1cfe s TYR 80 CO -0.06 -3.88 0.00 0.00 0.64 0.00 0.00 175.55 172.24 1cfe n ALA 81 N 9.29 0.00 -0.40 3.97 0.00 -1.26 -4.94 120.51 127.18 1cfe n ALA 81 Ca 0.22 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.68 1cfe n ALA 81 Cb 0.44 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.16 1cfe n ALA 81 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1cfe n THR 82 N -0.57 2.08 -1.78 0.00 5.66 -1.26 -4.88 114.28 113.53 1cfe n THR 82 Ca 0.00 -1.06 -0.18 0.00 -3.05 0.00 0.00 64.05 59.76 1cfe n THR 82 Cb 0.00 -0.38 -0.06 0.00 -1.55 0.00 0.00 70.33 68.34 1cfe n THR 82 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1cfe n ASN 83 N 0.29 -4.95 -4.82 1.09 2.85 -1.26 -4.97 115.26 103.49 1cfe n ASN 83 Ca 0.23 0.34 -0.22 0.00 -0.11 0.00 0.00 54.58 54.82 1cfe n ASN 83 Cb 0.99 -4.35 -0.04 0.00 1.24 0.00 0.00 39.78 37.62 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 -3.97 2.87 0.54 1.20 -1.52 -1.26 -4.90 119.66 112.61 1cfe s GLN 84 Ca 0.00 -1.10 -0.07 0.00 -1.95 0.00 0.00 55.36 52.23 1cfe s GLN 84 Cb 0.00 -2.53 -0.04 0.00 -0.22 0.00 0.00 33.01 30.23 1cfe s GLN 84 CO 0.00 0.37 0.89 0.00 -0.25 0.00 0.00 175.29 176.29 1cfe s VAL 86 N -2.92 3.68 0.00 0.00 1.01 0.10 -4.78 120.40 117.49 1cfe s VAL 86 Ca 0.51 1.57 0.00 0.00 0.00 0.00 0.00 61.98 64.05 1cfe s VAL 86 Cb -0.11 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1cfe s VAL 86 CO 0.48 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.52 1cfe n GLY 87 N 1.63 2.07 2.32 4.51 0.00 -1.26 -2.29 105.19 112.17 1cfe n GLY 87 Ca 0.01 0.42 -0.26 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 2.76 3.94 -0.02 0.00 -1.26 -5.12 105.19 105.50 1cfe n GLY 88 Ca 0.00 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.17 1cfe n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cfe s LYS 89 N -0.80 1.93 -1.15 1.61 3.01 -0.97 -4.97 119.74 118.40 1cfe s LYS 89 Ca 0.34 -0.44 -0.07 0.00 -1.01 0.00 0.00 55.97 54.79 1cfe s LYS 89 Cb 0.11 -2.17 -0.01 0.00 -1.01 0.00 0.00 37.83 34.75 1cfe s LYS 89 CO -0.14 -1.39 2.79 1.17 0.51 0.00 0.00 175.35 178.28 1cfe n LYS 90 N -2.98 3.69 -0.02 1.68 4.81 -1.26 -4.56 118.16 119.52 1cfe n LYS 90 Ca 0.10 -2.59 0.13 0.00 -0.87 0.00 0.00 58.31 55.08 1cfe n LYS 90 Cb 0.60 -2.55 0.38 0.00 0.02 0.00 0.00 35.03 33.49 1cfe n LYS 90 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1cfe n ARG 92 N 0.56 1.19 0.00 0.00 3.00 -1.26 -1.56 116.66 118.59 1cfe n ARG 92 Ca 0.17 -0.75 0.00 0.00 -0.00 0.00 0.00 57.85 57.27 1cfe n ARG 92 Cb 0.43 -1.96 0.00 0.00 0.00 0.00 0.00 32.46 30.93 1cfe n ARG 92 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1cfe n HIS 93 N 3.34 -0.97 -0.21 -0.14 8.25 -1.26 -4.91 115.22 119.32 1cfe n HIS 93 Ca 0.25 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 1cfe n HIS 93 Cb 0.31 0.19 0.08 0.00 1.12 0.00 0.00 29.99 31.69 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 -0.21 -0.78 4.41 3.20 -1.35 0.22 116.97 122.46 1cfe h TYR 94 Ca 0.00 0.05 0.19 0.00 3.14 0.00 0.00 58.73 62.11 1cfe h TYR 94 Cb 0.00 0.19 -0.13 0.00 1.54 0.00 0.00 36.73 38.33 1cfe h TYR 94 CO 0.00 -0.23 0.14 1.79 -1.64 0.00 0.00 178.16 178.21 1cfe h THR 95 N 0.05 0.40 -0.55 1.81 1.35 -1.67 0.29 112.91 114.58 1cfe h THR 95 Ca 0.32 -0.07 -0.04 0.00 -0.55 0.00 0.00 66.41 66.06 1cfe h THR 95 Cb 0.50 0.18 -0.02 0.00 -1.73 0.00 0.00 68.15 67.09 1cfe h THR 95 CO -0.60 0.04 0.17 -0.61 -0.25 0.00 0.00 175.52 174.26 1cfe h GLN 96 N 0.20 0.85 -0.67 4.72 -0.00 -0.93 0.24 115.11 119.53 1cfe h GLN 96 Ca 0.45 -0.19 0.05 0.00 -0.00 0.00 0.00 58.65 58.97 1cfe h GLN 96 Cb 0.83 -0.12 -0.05 0.00 0.00 0.00 0.00 27.48 28.14 1cfe h GLN 96 CO -0.61 0.78 0.39 0.28 0.00 0.00 0.00 178.83 179.68 1cfe h VAL 97 N 0.76 1.01 0.00 2.39 2.07 0.85 -3.04 116.25 120.29 1cfe h VAL 97 Ca 0.18 -0.25 -0.24 0.00 0.82 0.00 0.00 66.70 67.21 1cfe h VAL 97 Cb 0.29 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1cfe h VAL 97 CO -0.00 0.13 -1.25 1.62 0.02 0.00 0.00 177.57 178.09 1cfe h VAL 98 N 0.73 1.39 0.00 2.57 3.04 -0.78 -3.45 116.25 119.75 1cfe h VAL 98 Ca 0.29 -3.15 -0.37 0.00 -1.01 0.00 0.00 66.70 62.46 1cfe h VAL 98 Cb 0.14 2.69 -0.06 0.00 -2.01 0.00 0.00 31.29 32.04 1cfe h VAL 98 CO -0.16 0.79 1.25 1.87 -1.01 0.00 0.00 177.57 180.32 1cfe n TRP 99 N -3.24 0.42 -0.34 3.17 -0.00 0.84 -4.81 117.44 113.48 1cfe n TRP 99 Ca -0.06 0.28 0.07 0.00 -0.00 0.00 0.00 57.50 57.79 1cfe n TRP 99 Cb 0.98 -1.71 0.15 0.00 -0.00 0.00 0.00 31.31 30.73 1cfe n TRP 99 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 177.69 175.56 1cfe n ARG 100 N 6.08 -0.08 -0.10 5.87 3.00 0.10 -0.65 116.66 130.89 1cfe n ARG 100 Ca 0.47 1.45 0.08 0.00 -0.00 0.00 0.00 57.85 59.85 1cfe n ARG 100 Cb 0.02 -2.19 0.42 0.00 0.00 0.00 0.00 32.46 30.72 1cfe n ARG 100 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 1cfe h ASN 101 N 0.00 0.51 -3.43 6.15 -0.00 -1.84 -3.42 115.58 113.55 1cfe h ASN 101 Ca 0.47 0.00 -0.54 0.00 -0.00 0.00 0.00 56.30 56.22 1cfe h ASN 101 Cb 0.75 -0.11 -0.04 0.00 -0.00 0.00 0.00 38.32 38.93 1cfe h ASN 101 CO -0.95 0.33 0.21 -0.44 -0.00 0.00 0.00 177.43 176.58 1cfe s SER 102 N -6.35 7.23 -0.05 1.15 0.01 0.17 -4.22 113.70 111.64 1cfe s SER 102 Ca -0.09 1.48 0.11 0.00 1.31 0.00 0.00 55.95 58.77 1cfe s SER 102 Cb 0.19 -2.49 0.21 0.00 0.21 0.00 0.00 66.02 64.13 1cfe s SER 102 CO 0.75 -0.08 1.10 1.33 0.41 0.00 0.00 173.24 176.75 1cfe n VAL 103 N 3.24 0.68 -3.81 3.43 0.24 -0.36 -4.88 118.33 116.87 1cfe n VAL 103 Ca 0.00 -1.10 -0.12 0.00 -2.04 0.00 0.00 64.34 61.08 1cfe n VAL 103 Cb 0.50 0.36 -0.10 0.00 -1.47 0.00 0.00 33.84 33.13 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 -1.02 0.46 -0.14 7.34 1.81 -0.92 -4.04 118.95 122.45 1cfe s ARG 104 Ca 0.19 -0.06 -0.14 0.00 -1.72 0.00 0.00 55.73 54.00 1cfe s ARG 104 Cb 0.19 0.21 0.04 0.00 -0.45 0.00 0.00 34.95 34.93 1cfe s ARG 104 CO -0.04 -0.10 0.40 -1.17 -0.68 0.00 0.00 175.30 173.70 1cfe s LEU 105 N -0.80 0.49 -0.12 2.53 0.20 -1.24 -2.38 118.68 117.37 1cfe s LEU 105 Ca -0.09 0.74 -0.05 0.00 0.69 0.00 0.00 54.13 55.42 1cfe s LEU 105 Cb -0.05 1.38 0.06 0.00 -0.43 0.00 0.00 46.19 47.15 1cfe s LEU 105 CO 0.02 -0.17 0.25 -0.83 -0.29 0.00 0.00 176.35 175.32 1cfe s GLY 106 N 0.05 -0.10 0.25 7.98 0.00 -0.41 -1.05 107.32 114.03 1cfe s GLY 106 Ca -0.01 0.90 0.05 0.00 0.00 0.00 0.00 44.72 45.66 1cfe s GLY 106 CO 0.01 1.81 0.37 0.00 0.00 0.00 0.00 173.10 175.30 1cfe s GLY 108 N -3.99 2.61 -0.22 0.00 0.00 -0.68 -4.56 107.32 100.48 1cfe s GLY 108 Ca 0.35 -1.40 -0.04 0.00 0.00 0.00 0.00 44.72 43.64 1cfe s GLY 108 CO 0.29 -1.74 0.35 -1.60 0.00 0.00 0.00 173.10 170.40 1cfe s ARG 109 N -3.60 0.30 -0.11 2.90 3.52 -1.26 -3.58 118.95 117.11 1cfe s ARG 109 Ca 0.27 0.58 -0.00 0.00 -0.13 0.00 0.00 55.73 56.44 1cfe s ARG 109 Cb 0.02 -0.44 -0.02 0.00 -1.56 0.00 0.00 34.95 32.95 1cfe s ARG 109 CO 0.18 -0.55 -0.09 0.00 -0.81 0.00 0.00 175.30 174.03 1cfe s ALA 110 N 2.51 2.82 -0.45 6.12 0.00 -0.38 -4.96 121.76 127.43 1cfe s ALA 110 Ca 0.08 -0.88 -0.20 0.00 0.00 0.00 0.00 51.96 50.96 1cfe s ALA 110 Cb -0.15 -1.28 0.03 0.00 0.00 0.00 0.00 23.12 21.72 1cfe s ALA 110 CO -0.14 0.37 0.63 0.50 0.00 0.00 0.00 175.76 177.12 1cfe s ARG 111 N -0.09 3.25 0.86 0.00 3.52 -1.26 -0.28 118.95 124.94 1cfe s ARG 111 Ca -0.00 -0.45 -0.11 0.00 -0.13 0.00 0.00 55.73 55.03 1cfe s ARG 111 Cb -0.13 -3.97 0.11 0.00 -1.56 0.00 0.00 34.95 29.39 1cfe s ARG 111 CO 0.03 -1.03 1.09 0.00 -0.81 0.00 0.00 175.30 174.59 1cfe h ASN 113 N -1.43 0.07 0.14 0.00 7.08 -1.88 0.13 115.58 119.69 1cfe h ASN 113 Ca -0.47 0.11 0.00 0.00 -3.08 0.00 0.00 56.30 52.85 1cfe h ASN 113 Cb 1.27 0.13 0.00 0.00 -2.08 0.00 0.00 38.32 37.64 1cfe h ASN 113 CO 0.53 0.04 0.00 -0.46 -2.08 0.00 0.00 177.43 175.46 1cfe n ASN 114 N -5.09 0.00 0.00 6.14 0.23 -1.26 -4.84 115.26 110.43 1cfe n ASN 114 Ca 0.10 0.22 0.00 0.00 -0.53 0.00 0.00 54.58 54.37 1cfe n ASN 114 Cb 0.33 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.72 1cfe n ASN 114 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1cfe n GLY 115 N -0.72 0.55 3.71 4.83 0.00 0.45 -5.02 105.19 108.99 1cfe n GLY 115 Ca 0.03 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1cfe n GLY 115 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1cfe s TRP 116 N -2.00 2.91 -0.67 1.61 0.23 -1.26 -4.46 118.94 115.30 1cfe s TRP 116 Ca 0.00 0.61 -0.25 0.00 -2.03 0.00 0.00 56.10 54.43 1cfe s TRP 116 Cb 0.00 -3.88 0.04 0.00 0.03 0.00 0.00 33.47 29.67 1cfe s TRP 116 CO 0.00 -3.30 1.12 -1.58 0.96 0.00 0.00 176.95 174.16 1cfe s TRP 117 N 1.61 2.51 -0.40 -1.98 0.23 -0.03 -0.79 118.94 120.10 1cfe s TRP 117 Ca 0.70 -0.14 -0.26 0.00 -2.03 0.00 0.00 56.10 54.36 1cfe s TRP 117 Cb -0.41 -4.43 0.02 0.00 0.03 0.00 0.00 33.47 28.68 1cfe s TRP 117 CO 0.31 -1.78 0.96 0.12 0.96 0.00 0.00 176.95 177.51 1cfe s PHE 118 N 4.88 3.02 -0.13 -1.98 2.19 0.61 -2.62 117.98 123.94 1cfe s PHE 118 Ca 0.31 0.70 -0.05 0.00 0.33 0.00 0.00 56.93 58.22 1cfe s PHE 118 Cb -0.11 -3.81 -0.04 0.00 -1.31 0.00 0.00 43.02 37.75 1cfe s PHE 118 CO 0.15 -0.94 0.05 0.42 1.83 0.00 0.00 175.22 176.74 1cfe s ILE 119 N 3.66 4.75 -0.01 3.12 1.01 -0.14 -1.25 121.20 132.33 1cfe s ILE 119 Ca 0.39 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.99 1cfe s ILE 119 Cb -0.11 -3.06 -0.00 0.00 0.01 0.00 0.00 42.46 39.30 1cfe s ILE 119 CO 0.22 0.56 -0.06 -0.55 0.00 0.00 0.00 174.94 175.10 1cfe s SER 120 N -0.48 0.80 -0.09 3.58 0.15 -1.23 -0.93 113.70 115.50 1cfe s SER 120 Ca 0.10 -0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.67 1cfe s SER 120 Cb -0.12 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.05 1cfe s SER 120 CO 0.02 0.06 -0.21 0.00 1.20 0.00 0.00 173.24 174.31 1cfe s ASN 122 N 0.35 6.40 0.05 0.00 -0.87 -0.20 -0.85 114.94 119.83 1cfe s ASN 122 Ca -0.16 0.38 0.05 0.00 -1.57 0.00 0.00 52.86 51.56 1cfe s ASN 122 Cb -0.17 -2.00 -0.02 0.00 -0.02 0.00 0.00 41.25 39.03 1cfe s ASN 122 CO 0.07 0.11 -0.13 -0.31 -2.57 0.00 0.00 177.10 174.27 1cfe s TYR 123 N -1.60 1.13 -0.03 2.20 1.51 0.22 -1.29 117.35 119.49 1cfe s TYR 123 Ca 0.37 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 1cfe s TYR 123 Cb -0.12 -0.65 0.01 0.00 -0.11 0.00 0.00 41.96 41.08 1cfe s TYR 123 CO 0.27 0.03 -0.05 0.34 -1.11 0.00 0.00 175.55 175.03 1cfe s ASP 124 N -1.44 0.87 1.45 2.29 2.15 -1.00 -4.21 116.67 116.77 1cfe s ASP 124 Ca -0.01 -0.12 -0.22 0.00 0.43 0.00 0.00 52.55 52.62 1cfe s ASP 124 Cb -0.09 -0.30 0.35 0.00 -0.30 0.00 0.00 42.92 42.58 1cfe s ASP 124 CO 0.02 0.00 0.79 -0.81 -0.17 0.00 0.00 175.17 175.00 1cfe n PRO 125 N 3.58 -4.66 -0.64 4.34 -0.04 -1.26 -1.22 135.00 135.10 1cfe n PRO 125 Ca -0.21 -1.34 -0.31 0.00 -0.04 0.00 0.00 63.50 61.61 1cfe n PRO 125 Cb 0.53 -1.73 0.18 0.00 -0.04 0.00 0.00 33.50 32.44 1cfe n PRO 125 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1cfe n VAL 126 N -5.60 0.00 -4.16 0.52 0.24 -1.26 -4.39 118.33 103.68 1cfe n VAL 126 Ca 0.13 -0.24 -0.10 0.00 -2.04 0.00 0.00 64.34 62.08 1cfe n VAL 126 Cb 0.55 -0.82 -0.10 0.00 -1.47 0.00 0.00 33.84 32.00 1cfe n VAL 126 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1cfe s GLY 127 N -2.25 0.73 -1.34 7.63 0.00 -1.26 -4.52 107.32 106.31 1cfe s GLY 127 Ca 0.63 -1.33 -0.12 0.00 0.00 0.00 0.00 44.72 43.90 1cfe s GLY 127 CO 0.64 -1.43 0.54 0.70 0.00 0.00 0.00 173.10 173.55 1cfe n ASN 128 N -0.00 -3.42 -4.88 1.64 3.02 -1.26 -2.77 115.26 107.60 1cfe n ASN 128 Ca -0.12 -0.52 -0.21 0.00 -0.03 0.00 0.00 54.58 53.69 1cfe n ASN 128 Cb 0.61 -2.83 0.09 0.00 -0.61 0.00 0.00 39.78 37.04 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 -2.97 1.19 0.61 3.10 -0.11 -1.26 -4.69 118.94 114.80 1cfe s TRP 129 Ca 0.48 -0.63 -0.10 0.00 1.22 0.00 0.00 56.10 57.06 1cfe s TRP 129 Cb -0.26 -2.50 -0.04 0.00 -1.50 0.00 0.00 33.47 29.18 1cfe s TRP 129 CO 0.59 -1.51 1.01 -1.50 -4.62 0.00 0.00 176.95 170.91 1cfe s ILE 130 N -2.91 4.72 0.00 5.86 2.07 -1.26 -4.53 121.20 125.16 1cfe s ILE 130 Ca 0.65 0.82 0.00 0.00 -1.41 0.00 0.00 60.65 60.71 1cfe s ILE 130 Cb -0.05 -3.87 0.00 0.00 0.13 0.00 0.00 42.46 38.68 1cfe s ILE 130 CO 0.42 -1.12 0.00 0.61 -1.91 0.00 0.00 174.94 172.94 1cfe n GLY 131 N -2.71 1.79 3.71 1.50 0.00 -1.26 -4.92 105.19 103.30 1cfe n GLY 131 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1cfe n GLY 131 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cfe s GLN 132 N 0.00 4.47 0.08 1.61 -0.21 -1.26 -5.00 119.66 119.34 1cfe s GLN 132 Ca 0.00 1.14 -0.31 0.00 0.02 0.00 0.00 55.36 56.21 1cfe s GLN 132 Cb 0.00 -3.47 -0.06 0.00 1.00 0.00 0.00 33.01 30.48 1cfe s GLN 132 CO 0.00 -0.06 1.21 0.50 -2.12 0.00 0.00 175.29 174.82 1cfe s ARG 133 N 1.13 4.43 0.15 2.91 3.52 -1.26 -4.93 118.95 124.91 1cfe s ARG 133 Ca 0.44 1.79 -0.11 0.00 -0.13 0.00 0.00 55.73 57.72 1cfe s ARG 133 Cb -0.19 -3.33 -0.01 0.00 -1.56 0.00 0.00 34.95 29.86 1cfe s ARG 133 CO 0.21 -0.24 1.52 -1.00 -0.81 0.00 0.00 175.30 174.98 1cfe h PRO 134 N 6.63 0.97 0.00 5.12 0.13 -1.93 -3.36 132.00 139.57 1cfe h PRO 134 Ca -0.42 -0.44 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 1cfe h PRO 134 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1cfe h PRO 134 CO 0.81 1.11 0.00 2.48 -0.23 0.00 0.00 178.00 182.17