#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 -4.79 1.08 0.23 -1.26 -0.61 115.26 109.91 1cfe n ASN 2 Ca 0.00 -0.85 -0.30 0.00 -0.53 0.00 0.00 54.58 52.90 1cfe n ASN 2 Cb 0.00 0.00 0.09 0.00 -2.08 0.00 0.00 39.78 37.79 1cfe n ASN 2 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 1cfe s SER 3 N 0.00 4.47 0.14 0.53 0.01 -1.26 -4.86 113.70 112.73 1cfe s SER 3 Ca 0.00 1.41 -0.27 0.00 1.31 0.00 0.00 55.95 58.40 1cfe s SER 3 Cb 0.00 -2.15 -0.03 0.00 0.21 0.00 0.00 66.02 64.05 1cfe s SER 3 CO 0.00 -2.00 1.59 1.55 0.41 0.00 0.00 173.24 174.79 1cfe h PRO 4 N -1.11 -0.40 -0.52 12.44 0.13 -1.99 0.52 132.00 141.07 1cfe h PRO 4 Ca -0.47 0.03 0.15 0.00 -0.87 0.00 0.00 66.00 64.84 1cfe h PRO 4 Cb 1.26 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 1cfe h PRO 4 CO 0.58 -0.27 0.44 -0.56 -0.23 0.00 0.00 178.00 177.96 1cfe h GLN 5 N -0.42 0.00 0.07 0.86 3.07 -1.97 -0.66 115.11 116.06 1cfe h GLN 5 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.84 1cfe h GLN 5 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.15 1cfe h GLN 5 CO -0.43 0.00 -0.03 -0.44 0.09 0.00 0.00 178.83 178.01 1cfe h ASP 6 N 0.00 -0.08 0.55 0.06 3.32 -1.23 0.12 116.42 119.15 1cfe h ASP 6 Ca 0.25 -0.33 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 1cfe h ASP 6 Cb 1.12 0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.70 1cfe h ASP 6 CO -0.00 0.29 -0.26 1.88 -1.72 0.00 0.00 179.24 179.43 1cfe h TYR 7 N -0.47 -0.68 -0.60 4.55 0.05 -1.31 -3.22 116.97 115.30 1cfe h TYR 7 Ca -0.01 -0.02 0.11 0.00 0.05 0.00 0.00 58.73 58.87 1cfe h TYR 7 Cb 0.41 0.23 -0.09 0.00 1.01 0.00 0.00 36.73 38.29 1cfe h TYR 7 CO 0.05 -0.40 0.12 -0.07 -1.05 0.00 0.00 178.16 176.82 1cfe h LEU 8 N -0.80 -0.00 -0.29 3.88 3.38 -1.13 -2.28 115.31 118.06 1cfe h LEU 8 Ca -0.08 0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1cfe h LEU 8 Cb 0.59 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.42 1cfe h LEU 8 CO 0.12 0.01 -0.22 0.00 0.09 0.00 0.00 178.44 178.45 1cfe h ALA 9 N 1.48 -0.04 -0.34 1.53 0.00 -0.77 0.15 119.26 121.27 1cfe h ALA 9 Ca 0.31 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1cfe h ALA 9 Cb 0.46 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1cfe h ALA 9 CO -0.40 -0.62 0.05 0.28 0.00 0.00 0.00 179.25 178.56 1cfe h VAL 10 N -0.19 1.24 0.03 0.00 2.07 -1.45 0.14 116.25 118.08 1cfe h VAL 10 Ca 0.16 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.87 1cfe h VAL 10 Cb 0.43 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1cfe h VAL 10 CO -0.41 0.28 -0.19 0.45 0.02 0.00 0.00 177.57 177.72 1cfe h HIS 11 N 0.39 -0.50 -0.98 1.57 -0.00 -0.94 -0.86 115.15 113.83 1cfe h HIS 11 Ca 0.10 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 1cfe h HIS 11 Cb 0.35 0.22 -0.05 0.00 -0.00 0.00 0.00 27.41 27.94 1cfe h HIS 11 CO 0.02 -0.27 0.62 -0.91 -0.00 0.00 0.00 177.93 177.39 1cfe h ASN 12 N -0.32 1.15 0.34 2.45 2.35 -0.51 0.30 115.58 121.34 1cfe h ASN 12 Ca 0.05 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1cfe h ASN 12 Cb 0.38 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 1cfe h ASN 12 CO -0.16 0.86 -0.46 -0.78 -1.65 0.00 0.00 177.43 175.23 1cfe h ASP 13 N 1.34 -1.30 -0.45 5.81 1.82 -0.39 0.16 116.42 123.40 1cfe h ASP 13 Ca 0.35 0.12 0.07 0.00 -0.39 0.00 0.00 57.03 57.18 1cfe h ASP 13 Cb -0.11 0.45 -0.06 0.00 0.68 0.00 0.00 39.33 40.29 1cfe h ASP 13 CO -0.07 -0.57 0.09 0.00 -1.61 0.00 0.00 179.24 177.08 1cfe h ALA 14 N -0.89 0.50 -0.13 -0.78 0.00 -0.59 0.14 119.26 117.50 1cfe h ALA 14 Ca -0.04 0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1cfe h ALA 14 Cb 0.75 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 1cfe h ALA 14 CO -0.12 -0.32 -0.05 0.00 0.00 0.00 0.00 179.25 178.76 1cfe h ARG 15 N 0.22 -0.03 -0.74 0.00 3.08 -0.92 -2.38 114.38 113.61 1cfe h ARG 15 Ca 0.22 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.37 1cfe h ARG 15 Cb 0.29 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.27 1cfe h ARG 15 CO -0.30 -0.02 0.39 0.00 -1.07 0.00 0.00 179.97 178.97 1cfe h ALA 16 N 1.09 1.03 0.00 0.04 0.00 0.64 0.81 119.26 122.88 1cfe h ALA 16 Ca 0.07 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1cfe h ALA 16 Cb 0.14 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1cfe h ALA 16 CO -0.16 -0.01 -0.00 1.96 0.00 0.00 0.00 179.25 181.04 1cfe h GLN 17 N 0.65 0.00 -0.06 0.00 4.20 -0.24 -0.48 115.11 119.17 1cfe h GLN 17 Ca 0.36 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.07 1cfe h GLN 17 Cb 0.36 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 1cfe h GLN 17 CO -0.26 0.00 -0.01 1.33 -0.67 0.00 0.00 178.83 179.22 1cfe n VAL 18 N -3.49 1.99 -3.97 -0.54 0.24 -0.52 -5.00 118.33 107.04 1cfe n VAL 18 Ca -0.03 -2.19 -0.29 0.00 -2.04 0.00 0.00 64.34 59.79 1cfe n VAL 18 Cb 0.08 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 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 -1.21 -0.37 3.87 7.63 0.00 -0.19 -4.99 105.19 109.93 1cfe n GLY 19 Ca 0.17 0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.55 5.32 1.09 1.61 1.01 0.12 -4.98 120.40 121.01 1cfe s VAL 20 Ca 0.39 0.31 -0.15 0.00 0.00 0.00 0.00 61.98 62.53 1cfe s VAL 20 Cb -0.20 -3.54 0.16 0.00 0.00 0.00 0.00 36.38 32.79 1cfe s VAL 20 CO 0.87 0.49 0.52 0.61 0.00 0.00 0.00 175.10 177.59 1cfe n GLY 21 N 1.54 -2.03 0.00 4.51 0.00 -1.26 -4.05 105.19 103.90 1cfe n GLY 21 Ca -0.15 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -3.16 1.63 -3.99 1.61 -0.04 -1.26 -4.89 135.00 124.89 1cfe n PRO 22 Ca 0.04 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.41 1cfe n PRO 22 Cb 0.57 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.98 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 0.25 1.58 0.33 0.54 0.23 -1.26 -4.76 119.30 116.20 1cfe s MET 23 Ca 0.00 -1.26 0.06 0.00 -1.03 0.00 0.00 55.69 53.46 1cfe s MET 23 Cb 0.00 0.48 -0.06 0.00 -1.53 0.00 0.00 34.83 33.72 1cfe s MET 23 CO 0.00 -0.66 -0.01 0.45 -2.03 0.00 0.00 175.02 172.77 1cfe s SER 24 N -3.02 2.93 -0.27 -1.18 0.15 -0.83 -4.99 113.70 106.48 1cfe s SER 24 Ca 0.22 -1.29 -0.17 0.00 0.70 0.00 0.00 55.95 55.41 1cfe s SER 24 Cb -0.01 -0.20 -0.03 0.00 -1.71 0.00 0.00 66.02 64.07 1cfe s SER 24 CO 0.09 -0.44 0.48 0.86 1.20 0.00 0.00 173.24 175.43 1cfe s TRP 25 N -3.02 3.25 -1.04 3.44 -0.11 -1.26 -1.04 118.94 119.17 1cfe s TRP 25 Ca 0.33 0.52 0.28 0.00 1.22 0.00 0.00 56.10 58.45 1cfe s TRP 25 Cb 0.07 -2.71 0.98 0.00 -1.50 0.00 0.00 33.47 30.31 1cfe s TRP 25 CO 0.15 -0.30 1.74 -3.47 -4.62 0.00 0.00 176.95 170.45 1cfe n ASP 26 N 5.52 0.20 0.00 5.86 2.03 -0.29 -4.94 116.55 124.92 1cfe n ASP 26 Ca -0.05 0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1cfe n ASP 26 Cb 0.50 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 1cfe n ASP 26 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cfe n ALA 27 N -1.47 0.00 -0.17 -1.67 0.00 -1.26 -4.28 120.51 111.66 1cfe n ALA 27 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 1cfe n ALA 27 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1cfe n ALA 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1cfe h ASN 28 N 0.00 0.74 -0.89 0.00 4.21 -1.94 -0.67 115.58 117.03 1cfe h ASN 28 Ca 0.00 -0.24 0.14 0.00 1.21 0.00 0.00 56.30 57.41 1cfe h ASN 28 Cb 0.00 -0.20 -0.07 0.00 -1.12 0.00 0.00 38.32 36.93 1cfe h ASN 28 CO 0.00 0.79 0.57 -0.07 -1.29 0.00 0.00 177.43 177.44 1cfe h LEU 29 N 0.66 0.65 -0.37 1.61 3.38 -1.88 0.12 115.31 119.48 1cfe h LEU 29 Ca 0.15 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.06 1cfe h LEU 29 Cb 0.35 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1cfe h LEU 29 CO 0.00 0.32 -0.15 0.00 0.09 0.00 0.00 178.44 178.71 1cfe h ALA 30 N 1.60 0.52 0.45 1.53 0.00 -1.52 0.17 119.26 122.00 1cfe h ALA 30 Ca 0.45 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1cfe h ALA 30 Cb 0.73 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1cfe h ALA 30 CO -0.21 0.42 -0.34 0.66 0.00 0.00 0.00 179.25 179.79 1cfe h SER 31 N 0.55 -0.88 -0.49 0.00 4.64 -0.01 -0.04 113.55 117.32 1cfe h SER 31 Ca 0.09 0.06 0.09 0.00 -0.47 0.00 0.00 61.79 61.56 1cfe h SER 31 Cb 0.68 0.28 -0.10 0.00 -0.31 0.00 0.00 62.40 62.95 1cfe h SER 31 CO 0.05 -0.50 -0.32 -0.09 -0.87 0.00 0.00 176.83 175.09 1cfe h ARG 32 N -0.77 -0.20 -0.05 4.77 9.65 -0.72 0.36 114.38 127.42 1cfe h ARG 32 Ca -0.04 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 1cfe h ARG 32 Cb 0.66 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.27 1cfe h ARG 32 CO 0.00 -0.13 -0.06 0.00 2.80 0.00 0.00 179.97 182.58 1cfe h ALA 33 N 0.89 -0.02 -0.25 2.80 0.00 -0.49 0.21 119.26 122.41 1cfe h ALA 33 Ca 0.20 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1cfe h ALA 33 Cb 0.54 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1cfe h ALA 33 CO -0.60 -0.54 -0.16 0.37 0.00 0.00 0.00 179.25 178.32 1cfe h GLN 34 N -0.08 0.43 -0.07 0.00 4.15 -0.20 0.10 115.11 119.44 1cfe h GLN 34 Ca 0.04 -0.13 -0.12 0.00 0.77 0.00 0.00 58.65 59.21 1cfe h GLN 34 Cb 0.14 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.80 1cfe h GLN 34 CO -0.10 0.58 -0.44 -0.91 -1.93 0.00 0.00 178.83 176.03 1cfe h ASN 35 N 0.39 0.51 -0.02 -0.69 -0.26 0.34 0.43 115.58 116.27 1cfe h ASN 35 Ca 0.07 -0.67 0.02 0.00 -0.56 0.00 0.00 56.30 55.16 1cfe h ASN 35 Cb 0.51 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.60 1cfe h ASN 35 CO 0.03 1.10 -0.11 0.22 -1.06 0.00 0.00 177.43 177.61 1cfe h TYR 36 N -0.05 -0.27 -0.70 1.19 5.03 -0.57 -0.20 116.97 121.40 1cfe h TYR 36 Ca -0.04 0.01 0.05 0.00 2.58 0.00 0.00 58.73 61.34 1cfe h TYR 36 Cb 1.11 0.12 -0.05 0.00 1.55 0.00 0.00 36.73 39.45 1cfe h TYR 36 CO 0.13 -0.16 0.41 0.00 -1.32 0.00 0.00 178.16 177.22 1cfe h ALA 37 N 0.82 0.94 -0.12 1.82 0.00 -0.83 0.74 119.26 122.64 1cfe h ALA 37 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1cfe h ALA 37 Cb 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1cfe h ALA 37 CO -0.12 0.12 0.06 -0.91 0.00 0.00 0.00 179.25 178.40 1cfe h ASN 38 N 0.76 0.15 0.09 0.00 2.35 0.33 0.35 115.58 119.61 1cfe h ASN 38 Ca 0.31 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1cfe h ASN 38 Cb 0.15 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1cfe h ASN 38 CO -0.16 0.19 -0.04 0.77 -1.65 0.00 0.00 177.43 176.53 1cfe h SER 39 N 0.09 -0.10 1.31 5.81 4.64 -0.86 -3.26 113.55 121.19 1cfe h SER 39 Ca 0.04 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.14 1cfe h SER 39 Cb 0.07 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1cfe h SER 39 CO -0.01 0.16 -0.03 -0.09 -0.87 0.00 0.00 176.83 175.99 1cfe h ARG 40 N -0.36 0.00 -0.32 4.77 9.65 -0.62 -1.87 114.38 125.63 1cfe h ARG 40 Ca -0.01 0.00 0.09 0.00 -1.10 0.00 0.00 59.98 58.96 1cfe h ARG 40 Cb 0.31 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.87 1cfe h ARG 40 CO 0.02 0.03 0.34 0.00 2.80 0.00 0.00 179.97 183.16 1cfe h ALA 41 N 1.97 2.00 0.00 2.80 0.00 -0.33 0.23 119.26 125.92 1cfe h ALA 41 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1cfe h ALA 41 Cb 0.70 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1cfe h ALA 41 CO 0.00 -0.51 0.00 0.78 0.00 0.00 0.00 179.25 179.53 1cfe h GLY 42 N 0.00 0.00 0.00 0.00 0.00 -1.49 -0.38 103.07 101.20 1cfe h GLY 42 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1cfe h GLY 42 CO -0.00 0.00 -0.71 1.34 0.00 0.00 0.00 176.54 177.17 1cfe n ASP 43 N -3.05 1.56 0.00 0.19 2.03 0.52 -4.70 116.55 113.11 1cfe n ASP 43 Ca -0.03 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.54 1cfe n ASP 43 Cb 0.09 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.85 1cfe n ASP 43 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cfe s ASN 45 N -1.74 6.10 -0.93 0.00 0.01 -1.26 -4.85 114.94 112.27 1cfe s ASN 45 Ca 0.00 2.77 -0.22 0.00 -0.71 0.00 0.00 52.86 54.70 1cfe s ASN 45 Cb 0.00 -2.64 -0.13 0.00 0.41 0.00 0.00 41.25 38.88 1cfe s ASN 45 CO 0.00 -1.00 1.92 0.18 -1.51 0.00 0.00 177.10 176.68 1cfe n LEU 46 N -0.03 3.60 -3.68 0.60 4.77 -1.26 -4.79 117.00 116.21 1cfe n LEU 46 Ca 0.04 -2.99 -0.28 0.00 -0.03 0.00 0.00 56.01 52.75 1cfe n LEU 46 Cb 0.43 -1.36 -0.16 0.00 -2.33 0.00 0.00 43.42 40.00 1cfe n LEU 46 CO 0.57 -1.01 -0.34 -0.63 -1.33 0.00 0.00 177.39 174.65 1cfe s ILE 47 N 7.55 0.44 -0.27 -0.08 -1.09 -1.26 -5.08 121.20 121.41 1cfe s ILE 47 Ca 0.62 -0.80 -0.11 0.00 -2.23 0.00 0.00 60.65 58.13 1cfe s ILE 47 Cb 0.08 -1.16 0.11 0.00 -1.58 0.00 0.00 42.46 39.91 1cfe s ILE 47 CO 0.13 -0.46 0.60 -2.28 -1.23 0.00 0.00 174.94 171.71 1cfe s HIS 48 N 1.87 -1.15 0.00 3.97 2.46 -1.26 -5.07 115.29 116.11 1cfe s HIS 48 Ca 0.04 2.09 0.00 0.00 0.47 0.00 0.00 55.06 57.66 1cfe s HIS 48 Cb -0.17 0.65 0.00 0.00 -0.13 0.00 0.00 32.58 32.93 1cfe s HIS 48 CO -0.19 -0.59 0.00 -1.13 -2.47 0.00 0.00 174.74 170.36 1cfe n SER 49 N 5.12 0.00 0.00 9.88 3.41 -1.26 -4.74 113.62 126.03 1cfe n SER 49 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1cfe n SER 49 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.00 2.05 3.18 5.00 0.00 -1.26 -5.05 105.19 109.11 1cfe n GLY 50 Ca 0.00 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 1cfe n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cfe s ALA 51 N 0.00 3.30 0.00 4.61 0.00 -1.26 -4.44 121.76 123.97 1cfe s ALA 51 Ca 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 51.96 49.44 1cfe s ALA 51 Cb 0.00 -2.67 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1cfe s ALA 51 CO 0.00 -1.85 0.00 0.41 0.00 0.00 0.00 175.76 174.32 1cfe n GLY 52 N 4.80 0.90 3.32 0.00 0.00 -0.71 -3.90 105.19 109.59 1cfe n GLY 52 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 1.14 -0.17 1.61 0.41 -1.26 -1.36 118.70 119.07 1cfe s GLU 53 Ca 0.00 -1.22 -0.05 0.00 -0.41 0.00 0.00 54.97 53.29 1cfe s GLU 53 Cb 0.00 0.36 0.06 0.00 -1.78 0.00 0.00 34.13 32.77 1cfe s GLU 53 CO 0.00 -0.41 0.11 -0.80 -0.49 0.00 0.00 175.26 173.67 1cfe s ASN 54 N -2.98 2.16 0.10 -0.19 0.02 -0.24 -4.97 114.94 108.85 1cfe s ASN 54 Ca 0.19 -0.53 0.02 0.00 -1.02 0.00 0.00 52.86 51.52 1cfe s ASN 54 Cb 0.04 -0.15 -0.04 0.00 0.02 0.00 0.00 41.25 41.12 1cfe s ASN 54 CO 0.01 -0.34 0.18 -0.76 0.02 0.00 0.00 177.10 176.20 1cfe s LEU 55 N 2.17 4.09 -0.11 0.60 1.43 -1.26 -2.24 118.68 123.35 1cfe s LEU 55 Ca 0.03 0.09 -0.11 0.00 -1.03 0.00 0.00 54.13 53.11 1cfe s LEU 55 Cb -0.16 -2.71 0.03 0.00 0.03 0.00 0.00 46.19 43.38 1cfe s LEU 55 CO -0.09 0.13 0.31 0.00 0.23 0.00 0.00 176.35 176.92 1cfe s ALA 56 N -1.57 -0.76 0.01 4.21 0.00 -0.16 -5.00 121.76 118.49 1cfe s ALA 56 Ca 0.32 0.86 0.06 0.00 0.00 0.00 0.00 51.96 53.21 1cfe s ALA 56 Cb -0.12 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 1cfe s ALA 56 CO 0.26 -0.15 -0.19 -1.59 0.00 0.00 0.00 175.76 174.09 1cfe s LYS 57 N 0.15 1.40 0.00 0.00 0.00 -1.26 -0.02 119.74 120.00 1cfe s LYS 57 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 55.97 55.21 1cfe s LYS 57 Cb -0.02 -1.41 0.00 0.00 0.00 0.00 0.00 37.83 36.40 1cfe s LYS 57 CO 0.00 0.37 0.00 0.41 0.00 0.00 0.00 175.35 176.14 1cfe n GLY 58 N 2.30 4.35 1.70 0.59 0.00 -0.76 -5.01 105.19 108.36 1cfe n GLY 58 Ca -0.16 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.73 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 4.78 -0.04 0.00 -0.02 0.00 -1.26 -4.50 105.19 104.15 1cfe n GLY 59 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.98 -0.15 1.54 -0.02 0.00 -1.26 -4.13 105.19 103.14 1cfe n GLY 60 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.19 4.28 -4.55 1.61 5.75 -1.26 -4.78 116.55 117.41 1cfe n ASP 61 Ca 0.00 -2.13 -0.43 0.00 -0.01 0.00 0.00 54.79 52.22 1cfe n ASP 61 Cb 0.00 -0.90 -0.04 0.00 -1.03 0.00 0.00 41.12 39.16 1cfe n ASP 61 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1cfe s PHE 62 N 0.33 2.80 0.38 2.11 5.36 -1.26 -5.00 117.98 122.70 1cfe s PHE 62 Ca 0.00 0.21 0.05 0.00 -0.96 0.00 0.00 56.93 56.23 1cfe s PHE 62 Cb 0.00 -4.13 -0.00 0.00 -0.34 0.00 0.00 43.02 38.55 1cfe s PHE 62 CO 0.00 -1.31 0.55 0.95 -1.46 0.00 0.00 175.22 173.95 1cfe s THR 63 N 4.07 3.90 0.17 0.12 -4.23 -1.26 -4.91 115.64 113.51 1cfe s THR 63 Ca 0.35 -0.85 -0.13 0.00 -1.18 0.00 0.00 61.69 59.89 1cfe s THR 63 Cb -0.11 -3.38 0.07 0.00 1.34 0.00 0.00 72.50 70.43 1cfe s THR 63 CO 0.23 -0.18 1.76 1.23 -0.54 0.00 0.00 174.62 177.12 1cfe h GLY 64 N 0.70 0.87 0.55 3.99 0.00 -1.52 0.07 103.07 107.73 1cfe h GLY 64 Ca -0.45 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 46.49 1cfe h GLY 64 CO 0.53 0.40 -0.17 -0.09 0.00 0.00 0.00 176.54 177.21 1cfe h ARG 65 N 0.77 -0.26 -0.76 4.80 2.43 -1.13 -0.11 114.38 120.12 1cfe h ARG 65 Ca 0.20 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.49 1cfe h ARG 65 Cb 0.09 0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.63 1cfe h ARG 65 CO -0.03 -0.17 0.39 0.00 -1.51 0.00 0.00 179.97 178.65 1cfe h ALA 66 N 0.67 1.08 0.22 2.80 0.00 -1.76 0.25 119.26 122.53 1cfe h ALA 66 Ca 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1cfe h ALA 66 Cb 0.36 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1cfe h ALA 66 CO -0.18 -0.02 -0.12 0.00 0.00 0.00 0.00 179.25 178.93 1cfe h ALA 67 N 1.46 -0.31 -0.68 0.00 0.00 0.09 0.38 119.26 120.19 1cfe h ALA 67 Ca 0.38 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.28 1cfe h ALA 67 Cb 0.41 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1cfe h ALA 67 CO -0.28 -0.68 0.39 0.28 0.00 0.00 0.00 179.25 178.96 1cfe h VAL 68 N -0.32 0.99 -0.86 0.00 2.07 -0.55 -0.70 116.25 116.88 1cfe h VAL 68 Ca -0.03 -0.25 0.09 0.00 0.82 0.00 0.00 66.70 67.33 1cfe h VAL 68 Cb 0.25 0.20 -0.07 0.00 -1.52 0.00 0.00 31.29 30.15 1cfe h VAL 68 CO 0.04 0.13 0.52 1.56 0.02 0.00 0.00 177.57 179.84 1cfe h GLN 69 N 0.73 0.86 -0.52 1.57 1.08 -0.55 0.70 115.11 118.97 1cfe h GLN 69 Ca 0.30 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.45 1cfe h GLN 69 Cb 0.16 -0.19 -0.03 0.00 -0.05 0.00 0.00 27.48 27.37 1cfe h GLN 69 CO -0.17 0.57 0.31 1.25 -0.95 0.00 0.00 178.83 179.84 1cfe h LEU 70 N 0.88 0.62 -0.16 1.46 5.85 0.12 0.31 115.31 124.39 1cfe h LEU 70 Ca 0.41 -0.03 -0.23 0.00 0.84 0.00 0.00 57.88 58.87 1cfe h LEU 70 Cb 0.32 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.21 1cfe h LEU 70 CO -0.23 0.48 -0.78 -0.50 -0.34 0.00 0.00 178.44 177.07 1cfe h TRP 71 N 0.72 1.08 0.00 1.25 6.55 -0.17 -2.75 115.95 122.64 1cfe h TRP 71 Ca 0.19 -0.48 0.00 0.00 0.95 0.00 0.00 58.89 59.55 1cfe h TRP 71 Cb -0.03 -0.17 0.00 0.00 -0.86 0.00 0.00 29.16 28.11 1cfe h TRP 71 CO 0.00 1.32 0.00 0.28 -1.05 0.00 0.00 178.44 178.99 1cfe n VAL 72 N -3.94 0.68 0.04 1.49 0.31 0.07 -2.78 118.33 114.21 1cfe n VAL 72 Ca -0.07 0.17 0.20 0.00 -0.01 0.00 0.00 64.34 64.62 1cfe n VAL 72 Cb 0.75 -0.84 0.72 0.00 -0.91 0.00 0.00 33.84 33.55 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 -0.09 0.33 113.55 118.33 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 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1cfe h SER 73 CO 0.00 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.07 1cfe n GLU 74 N -4.19 0.60 0.17 3.45 4.71 -1.12 -4.53 120.64 119.74 1cfe n GLU 74 Ca 0.08 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.16 1cfe n GLU 74 Cb 0.58 -1.22 -0.04 0.00 -1.01 0.00 0.00 31.44 29.74 1cfe n GLU 74 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1cfe h ARG 75 N 0.71 -0.46 0.00 3.49 2.43 -0.61 -2.77 114.38 117.17 1cfe h ARG 75 Ca 0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1cfe h ARG 75 Cb 0.53 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1cfe h ARG 75 CO 0.00 -0.30 0.00 -0.35 -1.51 0.00 0.00 179.97 177.81 1cfe n PRO 76 N -3.44 0.56 0.15 0.20 -0.04 -1.26 -0.76 135.00 130.41 1cfe n PRO 76 Ca -0.06 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.51 1cfe n PRO 76 Cb 0.20 -1.46 0.07 0.00 -0.04 0.00 0.00 33.50 32.27 1cfe n PRO 76 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1cfe h SER 77 N 0.00 0.00 -3.90 3.54 4.64 -1.82 -3.44 113.55 112.57 1cfe h SER 77 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1cfe h SER 77 Cb 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1cfe h SER 77 CO 0.00 0.03 0.23 -0.72 -0.87 0.00 0.00 176.83 175.50 1cfe s TYR 78 N -3.28 3.52 -0.35 4.77 -0.85 0.06 -0.73 117.35 120.49 1cfe s TYR 78 Ca 0.03 1.13 0.05 0.00 -0.52 0.00 0.00 57.07 57.76 1cfe s TYR 78 Cb 0.07 -2.54 0.18 0.00 0.38 0.00 0.00 41.96 40.05 1cfe s TYR 78 CO 0.74 -0.31 0.53 1.21 -1.52 0.00 0.00 175.55 176.19 1cfe s ASN 79 N -3.54 -0.64 0.54 -0.18 2.47 -1.15 -4.78 114.94 107.65 1cfe s ASN 79 Ca 0.53 -0.66 0.20 0.00 0.42 0.00 0.00 52.86 53.34 1cfe s ASN 79 Cb -0.10 1.53 1.40 0.00 -1.45 0.00 0.00 41.25 42.63 1cfe s ASN 79 CO 0.39 -0.25 2.15 0.22 -3.72 0.00 0.00 177.10 175.89 1cfe h TYR 80 N 7.45 0.00 -0.43 0.43 3.20 -1.96 0.47 116.97 126.13 1cfe h TYR 80 Ca 0.01 0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.01 1cfe h TYR 80 Cb 1.15 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.40 1cfe h TYR 80 CO 0.23 0.00 0.41 0.00 -1.64 0.00 0.00 178.16 177.17 1cfe h ALA 81 N 1.97 2.20 -0.01 1.82 0.00 -1.95 0.47 119.26 123.75 1cfe h ALA 81 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1cfe h ALA 81 Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1cfe h ALA 81 CO -0.00 -0.64 -0.12 0.25 0.00 0.00 0.00 179.25 178.74 1cfe n THR 82 N -3.89 0.00 -4.29 0.00 -2.24 0.02 -5.03 114.28 98.87 1cfe n THR 82 Ca 0.08 -0.44 -0.32 0.00 -2.27 0.00 0.00 64.05 61.09 1cfe n THR 82 Cb 0.60 1.13 -0.08 0.00 -2.10 0.00 0.00 70.33 69.89 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 -0.01 -0.01 -2.94 3.42 4.05 0.15 -4.94 115.26 114.99 1cfe n ASN 83 Ca 0.04 -1.21 -0.11 0.00 0.45 0.00 0.00 54.58 53.75 1cfe n ASN 83 Cb 0.20 -1.93 0.01 0.00 1.23 0.00 0.00 39.78 39.28 1cfe n ASN 83 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1cfe s GLN 84 N -7.19 2.18 0.39 1.20 -2.07 -1.24 -4.98 119.66 107.95 1cfe s GLN 84 Ca 0.19 -1.59 -0.25 0.00 -1.82 0.00 0.00 55.36 51.89 1cfe s GLN 84 Cb -0.11 0.57 -0.09 0.00 -1.09 0.00 0.00 33.01 32.30 1cfe s GLN 84 CO 0.98 -0.99 1.15 0.00 -1.32 0.00 0.00 175.29 175.11 1cfe s VAL 86 N -1.44 2.58 -0.73 0.00 1.01 0.09 -4.87 120.40 117.04 1cfe s VAL 86 Ca 0.57 0.19 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 1cfe s VAL 86 Cb -0.29 -2.40 -0.17 0.00 0.00 0.00 0.00 36.38 33.51 1cfe s VAL 86 CO 0.37 -0.25 1.91 0.61 0.00 0.00 0.00 175.10 177.74 1cfe n GLY 87 N -0.38 2.47 3.36 4.51 0.00 -1.26 -4.74 105.19 109.15 1cfe n GLY 87 Ca 0.11 -1.26 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 1cfe n GLY 87 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cfe s GLY 88 N 5.10 -0.36 0.96 -0.02 0.00 -1.26 -5.17 107.32 106.57 1cfe s GLY 88 Ca 0.58 1.40 -0.13 0.00 0.00 0.00 0.00 44.72 46.57 1cfe s GLY 88 CO 0.13 1.27 1.14 0.54 0.00 0.00 0.00 173.10 176.17 1cfe s LYS 89 N 0.46 0.75 -0.39 2.90 1.02 -1.26 -4.54 119.74 118.67 1cfe s LYS 89 Ca -0.02 0.27 -0.25 0.00 0.02 0.00 0.00 55.97 55.99 1cfe s LYS 89 Cb -0.04 -1.80 0.04 0.00 -0.52 0.00 0.00 37.83 35.51 1cfe s LYS 89 CO -0.02 -2.46 0.54 1.63 -0.92 0.00 0.00 175.35 174.12 1cfe n LYS 90 N -3.94 -2.08 -1.64 1.68 5.02 -1.26 -4.98 118.16 110.96 1cfe n LYS 90 Ca 0.07 1.74 -0.04 0.00 -2.02 0.00 0.00 58.31 58.06 1cfe n LYS 90 Cb 0.59 -3.57 0.08 0.00 -0.02 0.00 0.00 35.03 32.11 1cfe n LYS 90 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cfe n ARG 92 N -0.54 4.67 0.00 0.00 5.12 -1.26 -4.29 116.66 120.36 1cfe n ARG 92 Ca 0.20 -4.71 0.00 0.00 -1.93 0.00 0.00 57.85 51.41 1cfe n ARG 92 Cb 0.89 -2.40 0.00 0.00 -1.16 0.00 0.00 32.46 29.79 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 0.05 -1.69 -0.35 -1.55 8.25 -1.26 -4.94 115.22 113.73 1cfe n HIS 93 Ca 0.40 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.91 1cfe n HIS 93 Cb 0.31 0.34 0.11 0.00 1.12 0.00 0.00 29.99 31.87 1cfe n HIS 93 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1cfe n TYR 94 N -2.15 0.28 -0.32 4.41 9.36 -1.18 -0.34 117.16 127.22 1cfe n TYR 94 Ca 0.00 1.17 0.11 0.00 3.32 0.00 0.00 57.90 62.50 1cfe n TYR 94 Cb 0.00 -1.02 0.23 0.00 -0.63 0.00 0.00 39.34 37.92 1cfe n TYR 94 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1cfe n THR 95 N -5.53 -0.39 -0.03 2.97 -2.24 -1.26 -0.53 114.28 107.27 1cfe n THR 95 Ca 0.14 2.06 -0.14 0.00 -2.27 0.00 0.00 64.05 63.85 1cfe n THR 95 Cb 0.46 -2.96 -0.09 0.00 -2.10 0.00 0.00 70.33 65.63 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 0.22 -0.69 -0.78 5.75 -1.04 -0.94 115.11 117.63 1cfe h GLN 96 Ca 0.53 -0.17 0.12 0.00 -0.15 0.00 0.00 58.65 58.98 1cfe h GLN 96 Cb 1.01 0.03 -0.09 0.00 1.07 0.00 0.00 27.48 29.50 1cfe h GLN 96 CO -0.90 0.79 0.26 0.28 -2.65 0.00 0.00 178.83 176.61 1cfe h VAL 97 N -0.30 0.70 0.00 2.39 2.07 -0.75 -0.79 116.25 119.57 1cfe h VAL 97 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1cfe h VAL 97 Cb 0.81 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1cfe h VAL 97 CO 0.04 0.08 -0.21 0.55 0.02 0.00 0.00 177.57 178.05 1cfe n VAL 98 N -5.01 0.18 -1.45 2.57 3.14 0.31 -4.83 118.33 113.25 1cfe n VAL 98 Ca 0.12 -0.10 -0.46 0.00 -2.96 0.00 0.00 64.34 60.94 1cfe n VAL 98 Cb 0.35 -0.29 -0.12 0.00 -1.06 0.00 0.00 33.84 32.72 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 -1.75 0.95 -0.29 1.45 -0.00 -0.31 -4.74 117.44 112.75 1cfe n TRP 99 Ca 0.06 0.41 0.07 0.00 -0.00 0.00 0.00 57.50 58.04 1cfe n TRP 99 Cb 0.37 -2.42 0.23 0.00 -0.00 0.00 0.00 31.31 29.49 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 12.50 0.58 -0.35 5.87 9.65 -1.23 -2.62 114.38 138.78 1cfe h ARG 100 Ca -0.12 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.72 1cfe h ARG 100 Cb 1.33 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 29.76 1cfe h ARG 100 CO 1.24 0.38 0.18 -0.97 2.80 0.00 0.00 179.97 183.61 1cfe h ASN 101 N 0.60 0.42 -3.38 -3.80 -0.00 -1.83 -3.42 115.58 104.16 1cfe h ASN 101 Ca 0.46 -0.02 -0.55 0.00 -0.00 0.00 0.00 56.30 56.19 1cfe h ASN 101 Cb 0.68 -0.10 -0.04 0.00 -0.00 0.00 0.00 38.32 38.85 1cfe h ASN 101 CO -0.37 0.34 0.21 -0.94 -0.00 0.00 0.00 177.43 176.67 1cfe s SER 102 N -6.74 7.15 -0.02 1.15 1.04 -0.99 -4.39 113.70 110.90 1cfe s SER 102 Ca -0.08 1.39 0.06 0.00 0.48 0.00 0.00 55.95 57.80 1cfe s SER 102 Cb 0.17 -2.48 -0.09 0.00 0.10 0.00 0.00 66.02 63.72 1cfe s SER 102 CO 0.73 -0.18 0.12 1.33 0.98 0.00 0.00 173.24 176.22 1cfe n VAL 103 N 3.84 0.06 -2.75 5.02 0.24 -1.21 -4.80 118.33 118.73 1cfe n VAL 103 Ca 0.02 -0.16 -0.31 0.00 -2.04 0.00 0.00 64.34 61.85 1cfe n VAL 103 Cb 0.51 0.17 -0.04 0.00 -1.47 0.00 0.00 33.84 33.01 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 -2.39 3.89 -0.08 7.34 0.52 -1.24 -1.97 118.95 125.01 1cfe s ARG 104 Ca -0.02 0.68 -0.17 0.00 -0.52 0.00 0.00 55.73 55.70 1cfe s ARG 104 Cb 0.04 -2.31 0.04 0.00 0.52 0.00 0.00 34.95 33.24 1cfe s ARG 104 CO 0.26 -0.08 0.40 -1.17 0.02 0.00 0.00 175.30 174.73 1cfe s LEU 105 N -3.76 0.49 -0.24 2.53 0.20 -0.21 -4.35 118.68 113.34 1cfe s LEU 105 Ca 0.55 0.47 -0.26 0.00 0.69 0.00 0.00 54.13 55.57 1cfe s LEU 105 Cb -0.10 1.49 0.11 0.00 -0.43 0.00 0.00 46.19 47.26 1cfe s LEU 105 CO 0.28 -0.34 0.97 -0.83 -0.29 0.00 0.00 176.35 176.14 1cfe s GLY 106 N -0.67 -0.25 0.14 7.98 0.00 -1.15 -1.14 107.32 112.24 1cfe s GLY 106 Ca -0.08 2.39 -0.01 0.00 0.00 0.00 0.00 44.72 47.02 1cfe s GLY 106 CO 0.03 1.60 0.06 0.00 0.00 0.00 0.00 173.10 174.80 1cfe s GLY 108 N -3.07 -0.37 -0.08 0.00 0.00 -0.32 -4.44 107.32 99.04 1cfe s GLY 108 Ca 0.26 0.98 0.02 0.00 0.00 0.00 0.00 44.72 45.98 1cfe s GLY 108 CO 0.03 0.72 -0.13 -1.60 0.00 0.00 0.00 173.10 172.12 1cfe s ARG 109 N -0.88 2.85 0.01 2.90 3.52 -1.26 -1.09 118.95 125.00 1cfe s ARG 109 Ca -0.09 -0.67 -0.02 0.00 -0.13 0.00 0.00 55.73 54.82 1cfe s ARG 109 Cb -0.03 -2.50 -0.01 0.00 -1.56 0.00 0.00 34.95 30.85 1cfe s ARG 109 CO 0.06 0.49 0.01 0.00 -0.81 0.00 0.00 175.30 175.05 1cfe s ALA 110 N -0.37 -0.00 -0.17 6.12 0.00 -0.03 -4.90 121.76 122.41 1cfe s ALA 110 Ca 0.04 -0.37 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 1cfe s ALA 110 Cb -0.12 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 1cfe s ALA 110 CO 0.02 -0.14 0.60 0.50 0.00 0.00 0.00 175.76 176.75 1cfe s ARG 111 N -1.13 4.26 0.61 0.00 3.52 -1.26 -0.08 118.95 124.87 1cfe s ARG 111 Ca -0.12 0.60 -0.18 0.00 -0.13 0.00 0.00 55.73 55.90 1cfe s ARG 111 Cb -0.08 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.75 1cfe s ARG 111 CO -0.00 -0.13 1.24 0.00 -0.81 0.00 0.00 175.30 175.60 1cfe n ASN 113 N -1.72 3.47 -0.81 0.00 2.85 -0.15 -2.24 115.26 116.66 1cfe n ASN 113 Ca 0.14 -2.13 -0.04 0.00 -0.11 0.00 0.00 54.58 52.44 1cfe n ASN 113 Cb 0.49 -0.90 -0.04 0.00 1.24 0.00 0.00 39.78 40.57 1cfe n ASN 113 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 1cfe n ASN 114 N 2.91 -0.63 0.00 1.20 6.94 -1.26 -4.96 115.26 119.46 1cfe n ASN 114 Ca 0.29 -1.27 0.00 0.00 -0.02 0.00 0.00 54.58 53.58 1cfe n ASN 114 Cb 0.49 0.19 0.00 0.00 -2.36 0.00 0.00 39.78 38.10 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 0.00 1.74 3.78 4.83 0.00 -0.95 -4.97 105.19 109.61 1cfe n GLY 115 Ca -0.18 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.19 1.58 -0.15 1.61 0.51 -1.26 -4.72 118.94 116.32 1cfe s TRP 116 Ca 0.00 0.56 -0.01 0.00 -2.12 0.00 0.00 56.10 54.53 1cfe s TRP 116 Cb 0.00 -3.66 -0.02 0.00 -0.81 0.00 0.00 33.47 28.99 1cfe s TRP 116 CO 0.00 -2.93 -0.10 -1.58 -0.51 0.00 0.00 176.95 171.83 1cfe s TRP 117 N -3.40 2.88 0.22 -1.98 0.52 -1.26 0.04 118.94 115.95 1cfe s TRP 117 Ca 0.69 -0.58 -0.22 0.00 0.02 0.00 0.00 56.10 56.01 1cfe s TRP 117 Cb -0.09 -1.90 -0.08 0.00 -1.15 0.00 0.00 33.47 30.24 1cfe s TRP 117 CO 0.54 -0.20 0.76 0.12 0.02 0.00 0.00 176.95 178.19 1cfe s PHE 118 N 0.46 3.72 0.00 -1.98 2.19 0.88 -1.83 117.98 121.43 1cfe s PHE 118 Ca -0.07 1.50 0.02 0.00 0.33 0.00 0.00 56.93 58.70 1cfe s PHE 118 Cb -0.15 -2.69 -0.01 0.00 -1.31 0.00 0.00 43.02 38.86 1cfe s PHE 118 CO 0.04 0.37 -0.07 0.42 1.83 0.00 0.00 175.22 177.81 1cfe s ILE 119 N -1.43 0.57 0.17 3.12 1.01 0.98 -0.85 121.20 124.76 1cfe s ILE 119 Ca 0.42 -0.43 0.08 0.00 0.00 0.00 0.00 60.65 60.71 1cfe s ILE 119 Cb -0.19 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 1cfe s ILE 119 CO 0.23 0.07 -0.17 -0.55 0.00 0.00 0.00 174.94 174.52 1cfe s SER 120 N -0.40 2.60 -0.25 3.58 0.15 -0.25 -0.99 113.70 118.14 1cfe s SER 120 Ca 0.01 -0.89 -0.02 0.00 0.70 0.00 0.00 55.95 55.75 1cfe s SER 120 Cb -0.04 -0.15 0.13 0.00 -1.71 0.00 0.00 66.02 64.25 1cfe s SER 120 CO -0.00 -0.07 0.32 0.00 1.20 0.00 0.00 173.24 174.69 1cfe s ASN 122 N 2.45 6.70 -0.07 0.00 3.84 0.39 -1.07 114.94 127.17 1cfe s ASN 122 Ca 0.10 1.19 -0.07 0.00 0.21 0.00 0.00 52.86 54.28 1cfe s ASN 122 Cb -0.15 -2.34 0.02 0.00 -0.55 0.00 0.00 41.25 38.23 1cfe s ASN 122 CO -0.20 -0.22 0.21 -0.31 -2.79 0.00 0.00 177.10 173.78 1cfe s TYR 123 N -2.04 -0.21 0.15 0.43 2.02 -0.46 -2.91 117.35 114.33 1cfe s TYR 123 Ca 0.52 0.51 0.05 0.00 -0.37 0.00 0.00 57.07 57.79 1cfe s TYR 123 Cb -0.10 0.07 -0.04 0.00 -0.40 0.00 0.00 41.96 41.48 1cfe s TYR 123 CO 0.21 -0.12 -0.11 0.34 -1.57 0.00 0.00 175.55 174.29 1cfe s ASP 124 N 0.00 1.92 1.06 2.29 2.15 -1.26 -4.51 116.67 118.31 1cfe s ASP 124 Ca -0.01 -0.97 -0.17 0.00 0.43 0.00 0.00 52.55 51.83 1cfe s ASP 124 Cb -0.02 -0.04 0.05 0.00 -0.30 0.00 0.00 42.92 42.62 1cfe s ASP 124 CO 0.00 -0.27 -0.00 -0.81 -0.17 0.00 0.00 175.17 173.92 1cfe n PRO 125 N -0.05 -1.03 -1.44 4.34 -0.04 -1.26 -3.31 135.00 132.20 1cfe n PRO 125 Ca -0.11 -0.28 -0.37 0.00 -0.04 0.00 0.00 63.50 62.70 1cfe n PRO 125 Cb 0.60 -1.68 0.06 0.00 -0.04 0.00 0.00 33.50 32.45 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 -4.03 2.86 -4.13 0.52 0.24 -1.26 -4.50 118.33 108.02 1cfe n VAL 126 Ca 0.02 -0.44 -0.10 0.00 -2.04 0.00 0.00 64.34 61.78 1cfe n VAL 126 Cb 0.60 -0.97 -0.09 0.00 -1.47 0.00 0.00 33.84 31.90 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 -1.41 1.00 -1.52 7.63 0.00 -1.25 -4.71 107.32 107.06 1cfe s GLY 127 Ca 0.72 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 44.03 1cfe s GLY 127 CO 0.51 -1.26 0.00 -2.01 0.00 0.00 0.00 173.10 170.34 1cfe n ASN 128 N -0.17 -4.67 -4.78 1.64 2.85 -1.26 -1.75 115.26 107.13 1cfe n ASN 128 Ca -0.04 0.20 -0.37 0.00 -0.11 0.00 0.00 54.58 54.27 1cfe n ASN 128 Cb 0.64 -4.02 -0.07 0.00 1.24 0.00 0.00 39.78 37.57 1cfe n ASN 128 CO 0.00 0.00 0.00 0.86 -2.11 0.00 0.00 177.26 176.01 1cfe s TRP 129 N -2.67 3.54 0.26 1.20 -0.11 -1.26 -4.93 118.94 114.98 1cfe s TRP 129 Ca 0.00 0.66 -0.29 0.00 1.22 0.00 0.00 56.10 57.69 1cfe s TRP 129 Cb 0.00 -2.25 -0.09 0.00 -1.50 0.00 0.00 33.47 29.63 1cfe s TRP 129 CO 0.00 0.43 1.28 0.42 -4.62 0.00 0.00 176.95 174.45 1cfe s ILE 130 N -0.16 3.05 0.00 5.86 1.01 -1.26 -4.26 121.20 125.44 1cfe s ILE 130 Ca 0.17 0.96 0.00 0.00 0.00 0.00 0.00 60.65 61.79 1cfe s ILE 130 Cb -0.14 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.72 1cfe s ILE 130 CO 0.06 0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.80 1cfe n GLY 131 N 1.58 1.25 3.79 6.18 0.00 -1.26 -5.12 105.19 111.62 1cfe n GLY 131 Ca 0.03 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 1cfe n GLY 131 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cfe s GLN 132 N 0.00 2.23 0.01 1.61 0.00 -1.26 -5.14 119.66 117.11 1cfe s GLN 132 Ca 0.00 -2.42 -0.18 0.00 -0.00 0.00 0.00 55.36 52.76 1cfe s GLN 132 Cb 0.00 -1.55 -0.06 0.00 0.00 0.00 0.00 33.01 31.40 1cfe s GLN 132 CO 0.00 -0.43 0.51 0.50 0.00 0.00 0.00 175.29 175.87 1cfe s ARG 133 N -3.93 4.14 0.01 9.60 3.52 -1.26 -4.92 118.95 126.11 1cfe s ARG 133 Ca 0.03 0.59 -0.25 0.00 -0.13 0.00 0.00 55.73 55.97 1cfe s ARG 133 Cb 0.00 -3.27 -0.18 0.00 -1.56 0.00 0.00 34.95 29.94 1cfe s ARG 133 CO 0.02 0.55 1.37 -1.00 -0.81 0.00 0.00 175.30 175.44 1cfe h PRO 134 N 5.04 -0.11 0.00 5.12 0.13 -1.90 -3.42 132.00 136.86 1cfe h PRO 134 Ca -0.49 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1cfe h PRO 134 Cb 1.21 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1cfe h PRO 134 CO 0.65 0.21 0.00 2.48 -0.23 0.00 0.00 178.00 181.11