#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 0.09 0.34 1.08 -0.87 -1.26 -4.13 114.94 110.18 1cfe s ASN 2 Ca 0.00 -1.04 0.00 0.00 -1.57 0.00 0.00 52.86 50.25 1cfe s ASN 2 Cb 0.00 0.74 0.00 0.00 -0.02 0.00 0.00 41.25 41.97 1cfe s ASN 2 CO 0.00 -1.45 0.00 -1.54 -2.57 0.00 0.00 177.10 171.54 1cfe n SER 3 N -1.01 -6.88 -0.08 -1.22 3.41 -1.26 -3.80 113.62 102.78 1cfe n SER 3 Ca -0.04 0.67 -0.10 0.00 -0.26 0.00 0.00 58.87 59.13 1cfe n SER 3 Cb 0.60 -3.62 -0.02 0.00 -0.26 0.00 0.00 64.21 60.91 1cfe n SER 3 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1cfe h PRO 4 N -1.09 0.39 -0.81 4.33 0.13 -2.01 -2.42 132.00 130.53 1cfe h PRO 4 Ca -0.03 -0.04 0.30 0.00 -0.87 0.00 0.00 66.00 65.36 1cfe h PRO 4 Cb 1.07 -0.08 -0.15 0.00 0.13 0.00 0.00 31.00 31.97 1cfe h PRO 4 CO 0.03 0.34 0.30 0.00 -0.23 0.00 0.00 178.00 178.43 1cfe n GLN 5 N -4.83 -0.05 0.11 0.86 10.64 -1.26 -1.01 117.38 121.83 1cfe n GLN 5 Ca -0.02 1.15 -0.24 0.00 -1.83 0.00 0.00 57.00 56.07 1cfe n GLN 5 Cb 0.07 -1.99 -0.15 0.00 -0.86 0.00 0.00 30.24 27.31 1cfe n GLN 5 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1cfe h ASP 6 N 0.00 0.73 0.18 2.61 3.32 -1.53 0.56 116.42 122.29 1cfe h ASP 6 Ca 0.62 -0.93 -0.01 0.00 0.02 0.00 0.00 57.03 56.74 1cfe h ASP 6 Cb 1.55 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1cfe h ASP 6 CO -0.67 1.67 -0.09 1.88 -1.72 0.00 0.00 179.24 180.31 1cfe h TYR 7 N 0.03 -0.24 -0.93 4.55 -1.99 -1.51 -2.71 116.97 114.17 1cfe h TYR 7 Ca -0.26 -0.00 0.19 0.00 2.00 0.00 0.00 58.73 60.66 1cfe h TYR 7 Cb 2.06 0.08 -0.11 0.00 2.00 0.00 0.00 36.73 40.76 1cfe h TYR 7 CO 0.14 -0.15 0.50 -0.07 -0.00 0.00 0.00 178.16 178.58 1cfe h LEU 8 N -0.25 0.59 0.60 3.88 3.38 -0.99 -1.00 115.31 121.51 1cfe h LEU 8 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1cfe h LEU 8 Cb 0.20 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1cfe h LEU 8 CO 0.03 0.18 -0.33 0.00 0.09 0.00 0.00 178.44 178.41 1cfe h ALA 9 N 1.64 -0.87 -0.56 1.53 0.00 0.42 0.15 119.26 121.56 1cfe h ALA 9 Ca 0.54 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 1cfe h ALA 9 Cb 0.88 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1cfe h ALA 9 CO -0.42 -1.00 0.02 0.28 0.00 0.00 0.00 179.25 178.13 1cfe h VAL 10 N -0.86 1.26 0.23 0.00 2.07 -1.17 0.19 116.25 117.97 1cfe h VAL 10 Ca -0.08 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.37 1cfe h VAL 10 Cb 0.68 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1cfe h VAL 10 CO 0.10 0.39 -0.27 0.45 0.02 0.00 0.00 177.57 178.26 1cfe h HIS 11 N 0.88 -0.72 -0.14 1.57 -0.00 -1.03 -0.42 115.15 115.29 1cfe h HIS 11 Ca 0.17 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.54 1cfe h HIS 11 Cb 0.50 0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 28.19 1cfe h HIS 11 CO 0.03 -0.39 0.07 -0.91 -0.00 0.00 0.00 177.93 176.73 1cfe h ASN 12 N -0.55 0.17 0.65 2.45 2.35 -0.18 0.13 115.58 120.60 1cfe h ASN 12 Ca 0.00 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1cfe h ASN 12 Cb 0.52 -0.04 0.01 0.00 0.05 0.00 0.00 38.32 38.86 1cfe h ASN 12 CO -0.09 0.15 -0.31 -0.78 -1.65 0.00 0.00 177.43 174.75 1cfe h ASP 13 N 0.19 -0.74 -0.65 5.81 1.82 -0.23 0.14 116.42 122.77 1cfe h ASP 13 Ca 0.05 0.03 0.14 0.00 -0.39 0.00 0.00 57.03 56.85 1cfe h ASP 13 Cb 0.02 0.19 -0.11 0.00 0.68 0.00 0.00 39.33 40.12 1cfe h ASP 13 CO -0.01 -0.47 0.05 0.00 -1.61 0.00 0.00 179.24 177.20 1cfe h ALA 14 N -1.49 0.70 -0.67 -0.78 0.00 -0.62 0.63 119.26 117.02 1cfe h ALA 14 Ca -0.09 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1cfe h ALA 14 Cb 0.67 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1cfe h ALA 14 CO 0.15 -0.38 0.36 0.00 0.00 0.00 0.00 179.25 179.38 1cfe h ARG 15 N 0.16 0.93 -0.53 0.00 3.08 -0.77 -1.23 114.38 116.03 1cfe h ARG 15 Ca 0.35 -0.11 0.10 0.00 0.07 0.00 0.00 59.98 60.38 1cfe h ARG 15 Cb 0.57 -0.18 -0.08 0.00 0.08 0.00 0.00 29.97 30.36 1cfe h ARG 15 CO -0.52 0.71 0.06 0.00 -1.07 0.00 0.00 179.97 179.14 1cfe h ALA 16 N 1.18 0.56 -0.15 0.04 0.00 0.14 0.15 119.26 121.17 1cfe h ALA 16 Ca 0.23 0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.32 1cfe h ALA 16 Cb 0.05 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1cfe h ALA 16 CO -0.04 -0.35 0.14 1.96 0.00 0.00 0.00 179.25 180.97 1cfe h GLN 17 N 0.19 0.00 -0.21 0.00 7.50 0.20 -0.30 115.11 122.48 1cfe h GLN 17 Ca 0.27 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.42 1cfe h GLN 17 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.92 1cfe h GLN 17 CO -0.39 0.00 0.00 1.33 -1.50 0.00 0.00 178.83 178.27 1cfe n VAL 18 N -4.02 1.82 -3.94 -0.54 0.24 -0.80 -4.99 118.33 106.10 1cfe n VAL 18 Ca 0.01 -1.67 -0.30 0.00 -2.04 0.00 0.00 64.34 60.34 1cfe n VAL 18 Cb 0.26 -0.02 0.02 0.00 -1.47 0.00 0.00 33.84 32.63 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 -0.43 -0.45 3.88 7.63 0.00 0.11 -4.99 105.19 110.94 1cfe n GLY 19 Ca 0.16 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.38 5.17 0.88 1.61 1.01 0.28 -4.99 120.40 120.97 1cfe s VAL 20 Ca 0.56 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 1cfe s VAL 20 Cb -0.28 -3.62 0.12 0.00 0.00 0.00 0.00 36.38 32.59 1cfe s VAL 20 CO 0.85 0.21 1.09 -0.83 0.00 0.00 0.00 175.10 176.42 1cfe s GLY 21 N -1.99 1.61 0.00 4.51 0.00 -1.26 -4.15 107.32 106.04 1cfe s GLY 21 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.94 1cfe s GLY 21 CO 0.20 0.36 0.00 -1.55 0.00 0.00 0.00 173.10 172.11 1cfe n PRO 22 N -3.80 0.88 -3.92 2.90 -0.04 -1.26 -4.96 135.00 124.81 1cfe n PRO 22 Ca 0.07 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.44 1cfe n PRO 22 Cb 0.56 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.94 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 -0.90 0.94 0.53 0.54 0.23 -1.26 -4.82 119.30 114.55 1cfe s MET 23 Ca 0.00 -1.07 0.02 0.00 -1.03 0.00 0.00 55.69 53.61 1cfe s MET 23 Cb 0.00 0.34 0.03 0.00 -1.53 0.00 0.00 34.83 33.67 1cfe s MET 23 CO 0.00 -0.31 0.74 -1.54 -2.03 0.00 0.00 175.02 171.88 1cfe s SER 24 N -2.91 5.36 -0.08 -1.18 1.04 -0.25 -4.99 113.70 110.69 1cfe s SER 24 Ca 0.10 -0.06 -0.23 0.00 0.48 0.00 0.00 55.95 56.24 1cfe s SER 24 Cb 0.05 -0.87 -0.03 0.00 0.10 0.00 0.00 66.02 65.26 1cfe s SER 24 CO -0.07 -1.07 0.70 0.86 0.98 0.00 0.00 173.24 174.65 1cfe s TRP 25 N -2.69 3.56 -0.32 5.02 -0.11 -1.26 -2.06 118.94 121.08 1cfe s TRP 25 Ca 0.57 1.23 -0.10 0.00 1.22 0.00 0.00 56.10 59.01 1cfe s TRP 25 Cb -0.10 -2.81 -0.01 0.00 -1.50 0.00 0.00 33.47 29.05 1cfe s TRP 25 CO 0.38 0.06 0.17 0.34 -4.62 0.00 0.00 176.95 173.28 1cfe s ASP 26 N 0.83 5.67 0.46 5.86 -1.08 0.48 -4.86 116.67 124.04 1cfe s ASP 26 Ca 0.37 -0.54 0.18 0.00 -0.52 0.00 0.00 52.55 52.04 1cfe s ASP 26 Cb -0.18 -2.03 1.10 0.00 -1.46 0.00 0.00 42.92 40.35 1cfe s ASP 26 CO 0.17 -0.22 2.00 0.00 0.52 0.00 0.00 175.17 177.65 1cfe h ALA 27 N 8.39 1.57 -0.02 3.66 0.00 -1.97 -1.72 119.26 129.16 1cfe h ALA 27 Ca -0.31 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 1cfe h ALA 27 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1cfe h ALA 27 CO 0.62 0.23 -0.26 -0.91 0.00 0.00 0.00 179.25 178.93 1cfe h ASN 28 N 0.00 0.27 -0.55 0.00 2.35 -1.96 0.10 115.58 115.80 1cfe h ASN 28 Ca -0.00 -0.71 0.06 0.00 -0.55 0.00 0.00 56.30 55.09 1cfe h ASN 28 Cb 0.35 -0.08 -0.05 0.00 0.05 0.00 0.00 38.32 38.59 1cfe h ASN 28 CO 0.02 0.95 0.25 -0.07 -1.65 0.00 0.00 177.43 176.93 1cfe h LEU 29 N -0.38 0.33 -0.54 1.61 3.38 -1.85 -0.67 115.31 117.20 1cfe h LEU 29 Ca -0.03 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1cfe h LEU 29 Cb 0.96 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1cfe h LEU 29 CO 0.05 0.22 0.34 0.00 0.09 0.00 0.00 178.44 179.15 1cfe h ALA 30 N 1.32 0.68 -0.04 1.53 0.00 -1.15 0.17 119.26 121.76 1cfe h ALA 30 Ca 0.25 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1cfe h ALA 30 Cb 0.21 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1cfe h ALA 30 CO -0.20 0.14 0.00 0.66 0.00 0.00 0.00 179.25 179.85 1cfe h SER 31 N 0.72 -0.01 -0.39 0.00 4.64 -0.33 -0.92 113.55 117.26 1cfe h SER 31 Ca 0.19 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1cfe h SER 31 Cb -0.05 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1cfe h SER 31 CO -0.04 0.00 0.21 -0.09 -0.87 0.00 0.00 176.83 176.04 1cfe h ARG 32 N 0.02 0.54 0.04 4.77 2.43 -0.88 -0.54 114.38 120.76 1cfe h ARG 32 Ca 0.02 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1cfe h ARG 32 Cb 0.02 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1cfe h ARG 32 CO -0.03 0.44 -0.04 0.00 -1.51 0.00 0.00 179.97 178.82 1cfe h ALA 33 N 1.07 -0.08 -0.03 2.80 0.00 -0.38 0.36 119.26 122.99 1cfe h ALA 33 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1cfe h ALA 33 Cb 0.06 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1cfe h ALA 33 CO -0.02 -0.55 -0.09 0.37 0.00 0.00 0.00 179.25 178.95 1cfe h GLN 34 N -0.10 -0.14 -0.68 0.00 5.75 -1.09 -0.44 115.11 118.41 1cfe h GLN 34 Ca 0.00 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1cfe h GLN 34 Cb 0.09 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 1cfe h GLN 34 CO -0.01 -0.09 0.45 -0.91 -2.65 0.00 0.00 178.83 175.62 1cfe h ASN 35 N -0.14 0.77 0.29 -0.69 4.21 -0.39 0.23 115.58 119.86 1cfe h ASN 35 Ca 0.05 -0.02 -0.01 0.00 1.21 0.00 0.00 56.30 57.52 1cfe h ASN 35 Cb 0.21 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 37.22 1cfe h ASN 35 CO -0.12 0.55 -0.14 0.22 -1.29 0.00 0.00 177.43 176.65 1cfe h TYR 36 N 0.90 -0.37 0.25 1.19 5.03 -0.07 -0.60 116.97 123.31 1cfe h TYR 36 Ca 0.26 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.56 1cfe h TYR 36 Cb -0.07 0.12 -0.04 0.00 1.55 0.00 0.00 36.73 38.30 1cfe h TYR 36 CO -0.00 -0.17 -0.49 0.00 -1.32 0.00 0.00 178.16 176.19 1cfe h ALA 37 N 0.20 -0.97 -0.76 1.82 0.00 0.20 0.12 119.26 119.87 1cfe h ALA 37 Ca -0.04 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1cfe h ALA 37 Cb 0.36 0.78 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 1cfe h ALA 37 CO 0.07 -1.10 -0.54 -0.91 0.00 0.00 0.00 179.25 176.76 1cfe h ASN 38 N -0.81 -1.94 -0.34 0.00 2.35 -0.62 -0.19 115.58 114.03 1cfe h ASN 38 Ca -0.02 0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.95 1cfe h ASN 38 Cb 0.78 0.84 -0.01 0.00 0.05 0.00 0.00 38.32 39.97 1cfe h ASN 38 CO -0.20 -0.27 -0.03 -1.28 -1.65 0.00 0.00 177.43 174.01 1cfe h SER 39 N -0.12 0.62 1.23 5.81 0.87 -0.81 -3.01 113.55 118.14 1cfe h SER 39 Ca 0.12 -0.33 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 1cfe h SER 39 Cb 0.44 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 1cfe h SER 39 CO -0.78 0.80 -0.09 -0.09 -0.53 0.00 0.00 176.83 176.14 1cfe h ARG 40 N 0.42 0.00 -0.24 2.24 9.65 -0.35 -2.99 114.38 123.11 1cfe h ARG 40 Ca 0.09 0.00 0.07 0.00 -1.10 0.00 0.00 59.98 59.04 1cfe h ARG 40 Cb 0.50 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.08 1cfe h ARG 40 CO 0.02 0.09 0.74 0.00 2.80 0.00 0.00 179.97 183.63 1cfe h ALA 41 N 1.91 1.97 -0.63 2.80 0.00 -0.89 0.57 119.26 124.97 1cfe h ALA 41 Ca -0.00 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.03 1cfe h ALA 41 Cb 0.73 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 1cfe h ALA 41 CO 0.01 -0.86 0.05 0.78 0.00 0.00 0.00 179.25 179.23 1cfe h GLY 42 N 0.00 0.73 0.00 0.00 0.00 -1.73 -3.35 103.07 98.72 1cfe h GLY 42 Ca 0.11 0.05 -0.23 0.00 0.00 0.00 0.00 47.33 47.26 1cfe h GLY 42 CO -0.00 -0.19 -1.79 1.34 0.00 0.00 0.00 176.54 175.90 1cfe n ASP 43 N -5.24 1.35 -0.93 0.19 2.03 -0.08 -4.99 116.55 108.88 1cfe n ASP 43 Ca 0.10 0.13 -0.01 0.00 0.52 0.00 0.00 54.79 55.53 1cfe n ASP 43 Cb 0.37 -0.38 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 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 -3.04 7.08 -1.33 0.00 3.84 -1.26 -4.08 114.94 116.15 1cfe s ASN 45 Ca 0.01 1.29 -0.12 0.00 0.21 0.00 0.00 52.86 54.25 1cfe s ASN 45 Cb -0.00 -2.41 -0.05 0.00 -0.55 0.00 0.00 41.25 38.23 1cfe s ASN 45 CO 0.03 0.08 2.46 0.18 -2.79 0.00 0.00 177.10 177.05 1cfe n LEU 46 N 2.70 6.90 -0.07 3.21 4.77 -1.26 -4.61 117.00 128.64 1cfe n LEU 46 Ca -0.05 -3.83 -0.07 0.00 -0.03 0.00 0.00 56.01 52.03 1cfe n LEU 46 Cb 0.51 -1.44 -0.05 0.00 -2.33 0.00 0.00 43.42 40.11 1cfe n LEU 46 CO 0.45 1.21 -0.06 0.40 -1.33 0.00 0.00 177.39 178.06 1cfe h ILE 47 N 3.56 0.50 -3.68 -0.08 2.04 -2.00 -3.50 117.51 114.34 1cfe h ILE 47 Ca 0.66 -1.43 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1cfe h ILE 47 Cb 0.41 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1cfe h ILE 47 CO 1.77 0.17 -0.90 0.00 0.00 0.00 0.00 178.15 179.19 1cfe n HIS 48 N -4.66 -4.36 0.14 1.37 1.44 -1.26 -4.81 115.22 103.06 1cfe n HIS 48 Ca -0.08 2.33 -0.14 0.00 -2.01 0.00 0.00 57.72 57.83 1cfe n HIS 48 Cb 0.24 -3.51 -0.06 0.00 0.12 0.00 0.00 29.99 26.78 1cfe n HIS 48 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1cfe h SER 49 N 1.58 -0.88 0.00 4.39 4.64 -1.98 -3.50 113.55 117.80 1cfe h SER 49 Ca 0.00 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1cfe h SER 49 Cb 0.04 0.33 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1cfe h SER 49 CO 0.00 -0.41 0.00 0.61 -0.87 0.00 0.00 176.83 176.16 1cfe n GLY 50 N -1.42 0.42 3.91 -0.77 0.00 -1.26 -5.00 105.19 101.07 1cfe n GLY 50 Ca -0.07 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 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 0.73 -2.53 0.00 4.61 0.00 -1.26 -0.83 120.51 121.23 1cfe n ALA 51 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1cfe n ALA 51 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 -1.81 3.03 3.89 0.00 0.00 -0.65 -4.18 105.19 105.47 1cfe n GLY 52 Ca -0.18 -0.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.69 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 3.28 0.10 1.61 8.01 -0.01 -4.23 118.70 127.46 1cfe s GLU 53 Ca 0.00 0.36 -0.16 0.00 0.01 0.00 0.00 54.97 55.18 1cfe s GLU 53 Cb 0.00 -2.20 0.03 0.00 -4.31 0.00 0.00 34.13 27.65 1cfe s GLU 53 CO 0.00 -0.59 0.39 0.54 0.01 0.00 0.00 175.26 175.61 1cfe s ASN 54 N -4.22 -0.22 0.02 -0.19 2.20 -0.77 -4.54 114.94 107.22 1cfe s ASN 54 Ca 0.53 -0.26 -0.00 0.00 -0.94 0.00 0.00 52.86 52.19 1cfe s ASN 54 Cb -0.11 0.45 -0.02 0.00 -2.00 0.00 0.00 41.25 39.58 1cfe s ASN 54 CO 0.49 -0.79 -0.02 -0.76 -2.94 0.00 0.00 177.10 173.07 1cfe s LEU 55 N -2.60 2.20 -0.05 3.54 1.43 -1.26 -1.12 118.68 120.82 1cfe s LEU 55 Ca 0.01 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.68 1cfe s LEU 55 Cb 0.01 0.11 0.01 0.00 0.03 0.00 0.00 46.19 46.36 1cfe s LEU 55 CO -0.09 -0.28 -0.11 0.00 0.23 0.00 0.00 176.35 176.09 1cfe s ALA 56 N -1.36 1.15 0.92 4.21 0.00 0.32 -5.02 121.76 121.99 1cfe s ALA 56 Ca -0.15 -0.39 -0.13 0.00 0.00 0.00 0.00 51.96 51.30 1cfe s ALA 56 Cb -0.09 -0.50 0.15 0.00 0.00 0.00 0.00 23.12 22.68 1cfe s ALA 56 CO -0.01 0.12 1.15 -1.59 0.00 0.00 0.00 175.76 175.44 1cfe s LYS 57 N 0.53 1.04 0.00 0.00 -2.85 -1.26 -0.63 119.74 116.57 1cfe s LYS 57 Ca -0.11 0.22 0.00 0.00 -1.00 0.00 0.00 55.97 55.08 1cfe s LYS 57 Cb -0.14 -1.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 1cfe s LYS 57 CO 0.03 -2.25 0.00 0.41 0.10 0.00 0.00 175.35 173.63 1cfe n GLY 58 N -2.30 2.48 0.00 0.59 0.00 -0.34 -4.80 105.19 100.82 1cfe n GLY 58 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.51 7.00 -0.02 0.00 -1.26 -4.36 105.19 105.04 1cfe n GLY 59 Ca 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.82 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 -0.30 2.98 1.68 -0.02 0.00 -1.26 -1.33 105.19 106.93 1cfe n GLY 60 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 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 2.71 3.63 -4.62 1.61 5.75 -1.26 -4.95 116.55 119.42 1cfe n ASP 61 Ca 0.00 -3.50 -0.43 0.00 -0.01 0.00 0.00 54.79 50.85 1cfe n ASP 61 Cb 0.00 -0.72 -0.03 0.00 -1.03 0.00 0.00 41.12 39.34 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 -3.16 1.57 0.63 2.11 5.36 -0.44 -4.96 117.98 119.08 1cfe s PHE 62 Ca 0.51 0.32 -0.07 0.00 -0.96 0.00 0.00 56.93 56.73 1cfe s PHE 62 Cb 0.43 -4.04 0.01 0.00 -0.34 0.00 0.00 43.02 39.09 1cfe s PHE 62 CO 0.08 -3.93 0.95 0.95 -1.46 0.00 0.00 175.22 171.81 1cfe s THR 63 N 6.27 3.50 0.32 0.12 -4.23 -1.26 -4.80 115.64 115.55 1cfe s THR 63 Ca 0.86 0.09 0.01 0.00 -1.18 0.00 0.00 61.69 61.47 1cfe s THR 63 Cb -0.31 -3.42 0.28 0.00 1.34 0.00 0.00 72.50 70.38 1cfe s THR 63 CO 0.34 -0.46 1.93 1.23 -0.54 0.00 0.00 174.62 177.12 1cfe h GLY 64 N -0.32 1.20 0.92 3.99 0.00 -1.94 0.00 103.07 106.93 1cfe h GLY 64 Ca -0.45 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 46.50 1cfe h GLY 64 CO 0.61 0.30 0.04 -0.09 0.00 0.00 0.00 176.54 177.41 1cfe h ARG 65 N 0.98 0.10 -0.96 4.80 2.43 -1.85 -1.21 114.38 118.67 1cfe h ARG 65 Ca 0.36 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.61 1cfe h ARG 65 Cb 0.15 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.61 1cfe h ARG 65 CO -0.12 0.07 0.62 0.00 -1.51 0.00 0.00 179.97 179.02 1cfe h ALA 66 N 1.07 1.53 0.25 2.80 0.00 -1.78 0.73 119.26 123.86 1cfe h ALA 66 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1cfe h ALA 66 Cb 0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1cfe h ALA 66 CO -0.05 0.28 -0.24 0.00 0.00 0.00 0.00 179.25 179.24 1cfe h ALA 67 N 1.52 -0.50 -0.60 0.00 0.00 -0.18 0.37 119.26 119.87 1cfe h ALA 67 Ca 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1cfe h ALA 67 Cb 0.36 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1cfe h ALA 67 CO -0.20 -0.81 0.35 0.28 0.00 0.00 0.00 179.25 178.87 1cfe h VAL 68 N -0.52 1.18 -0.30 0.00 2.07 -0.54 -0.83 116.25 117.32 1cfe h VAL 68 Ca -0.01 -0.43 0.08 0.00 0.82 0.00 0.00 66.70 67.16 1cfe h VAL 68 Cb 0.47 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1cfe h VAL 68 CO -0.05 0.19 0.21 1.56 0.02 0.00 0.00 177.57 179.51 1cfe h GLN 69 N 0.81 0.03 -0.40 1.57 1.08 -0.58 0.11 115.11 117.74 1cfe h GLN 69 Ca 0.21 -0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.33 1cfe h GLN 69 Cb 0.01 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1cfe h GLN 69 CO -0.04 0.02 -0.08 1.25 -0.95 0.00 0.00 178.83 179.04 1cfe h LEU 70 N 0.03 0.75 -0.93 1.46 5.85 0.12 0.18 115.31 122.76 1cfe h LEU 70 Ca 0.14 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 1cfe h LEU 70 Cb 0.52 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1cfe h LEU 70 CO -0.01 0.93 0.01 -0.50 -0.34 0.00 0.00 178.44 178.53 1cfe h TRP 71 N 0.56 0.83 -0.00 1.25 6.55 -0.51 -1.35 115.95 123.28 1cfe h TRP 71 Ca 0.10 -0.11 0.00 0.00 0.95 0.00 0.00 58.89 59.83 1cfe h TRP 71 Cb 0.59 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 28.66 1cfe h TRP 71 CO 0.05 0.77 -0.03 0.28 -1.05 0.00 0.00 178.44 178.46 1cfe n VAL 72 N -4.22 0.00 -0.06 1.49 0.31 0.18 -2.86 118.33 113.17 1cfe n VAL 72 Ca 0.03 -0.08 0.12 0.00 -0.01 0.00 0.00 64.34 64.39 1cfe n VAL 72 Cb 0.29 -0.13 0.52 0.00 -0.91 0.00 0.00 33.84 33.62 1cfe n VAL 72 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1cfe h SER 73 N 0.78 0.33 0.00 4.52 0.87 0.55 -2.68 113.55 117.92 1cfe h SER 73 Ca 0.00 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 1cfe h SER 73 Cb 0.24 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1cfe h SER 73 CO 0.00 0.20 -0.06 -0.62 -0.53 0.00 0.00 176.83 175.82 1cfe n GLU 74 N -4.47 1.04 0.26 2.24 -0.58 -1.13 -4.55 120.64 113.45 1cfe n GLU 74 Ca 0.09 -0.21 -0.10 0.00 -0.42 0.00 0.00 57.16 56.52 1cfe n GLU 74 Cb 0.37 -1.29 -0.05 0.00 -0.57 0.00 0.00 31.44 29.90 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 1.99 -0.64 0.00 3.49 2.43 -1.75 -3.32 114.38 116.59 1cfe h ARG 75 Ca 0.04 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1cfe h ARG 75 Cb 0.94 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1cfe h ARG 75 CO 0.07 -0.43 0.00 -0.35 -1.51 0.00 0.00 179.97 177.75 1cfe n PRO 76 N -4.15 0.04 0.06 0.20 -0.04 -1.26 -1.40 135.00 128.44 1cfe n PRO 76 Ca -0.08 0.44 -0.04 0.00 -0.04 0.00 0.00 63.50 63.78 1cfe n PRO 76 Cb 0.26 -1.60 -0.08 0.00 -0.04 0.00 0.00 33.50 32.04 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 -3.92 3.54 4.64 -1.93 -3.44 113.55 112.44 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 0.11 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1cfe h SER 77 CO 0.00 0.81 0.24 -0.72 -0.87 0.00 0.00 176.83 176.28 1cfe s TYR 78 N -2.78 3.51 0.00 4.77 -0.85 -0.50 0.47 117.35 121.96 1cfe s TYR 78 Ca -0.00 1.16 0.00 0.00 -0.52 0.00 0.00 57.07 57.71 1cfe s TYR 78 Cb 0.09 -2.56 0.00 0.00 0.38 0.00 0.00 41.96 39.87 1cfe s TYR 78 CO 0.80 -0.30 0.00 -1.71 -1.52 0.00 0.00 175.55 172.82 1cfe n ASN 79 N -1.76 0.00 0.00 -0.18 2.85 -1.25 -4.84 115.26 110.07 1cfe n ASN 79 Ca 0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.51 1cfe n ASN 79 Cb 0.54 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.56 1cfe n ASN 79 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1cfe n TYR 80 N 0.00 0.00 -0.35 1.20 4.19 -1.26 -4.95 117.16 115.99 1cfe n TYR 80 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1cfe n TYR 80 Cb 0.00 0.00 0.06 0.00 0.49 0.00 0.00 39.34 39.89 1cfe n TYR 80 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1cfe n ALA 81 N 0.00 -0.05 1.17 2.98 0.00 -1.26 -0.37 120.51 122.97 1cfe n ALA 81 Ca 0.00 0.95 0.12 0.00 0.00 0.00 0.00 53.44 54.51 1cfe n ALA 81 Cb 0.00 -0.45 0.24 0.00 0.00 0.00 0.00 19.45 19.24 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 -5.40 0.00 -4.30 0.00 -2.24 -1.26 -4.96 114.28 96.11 1cfe n THR 82 Ca 0.11 -0.22 -0.39 0.00 -2.27 0.00 0.00 64.05 61.28 1cfe n THR 82 Cb 0.39 0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 69.35 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 -0.17 -1.55 0.00 3.42 5.15 0.50 -4.80 115.26 117.81 1cfe n ASN 83 Ca 0.12 -1.15 0.00 0.00 -0.60 0.00 0.00 54.58 52.95 1cfe n ASN 83 Cb 0.41 -1.47 0.00 0.00 -0.53 0.00 0.00 39.78 38.19 1cfe n ASN 83 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1cfe n GLN 84 N -3.81 0.00 -2.06 1.20 10.64 -1.26 -4.83 117.38 117.27 1cfe n GLN 84 Ca 0.09 0.00 -0.28 0.00 -1.83 0.00 0.00 57.00 54.98 1cfe n GLN 84 Cb 0.43 0.00 0.07 0.00 -0.86 0.00 0.00 30.24 29.87 1cfe n GLN 84 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1cfe s VAL 86 N -3.35 5.09 0.00 0.00 1.01 0.18 -4.77 120.40 118.56 1cfe s VAL 86 Ca 0.60 1.00 0.00 0.00 0.00 0.00 0.00 61.98 63.58 1cfe s VAL 86 Cb -0.11 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1cfe s VAL 86 CO 0.48 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1cfe n GLY 87 N 2.82 2.53 2.75 4.51 0.00 -1.26 -3.68 105.19 112.86 1cfe n GLY 87 Ca -0.08 0.35 -0.06 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.29 3.36 -0.02 0.00 -1.26 -5.13 105.19 101.85 1cfe n GLY 88 Ca 0.00 0.31 -0.27 0.00 0.00 0.00 0.00 46.02 46.06 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 2.24 -2.29 -1.94 1.61 4.01 -1.24 -4.89 118.16 115.66 1cfe n LYS 89 Ca 0.13 -1.73 -0.41 0.00 -0.51 0.00 0.00 58.31 55.80 1cfe n LYS 89 Cb 0.60 -1.42 -0.02 0.00 -0.51 0.00 0.00 35.03 33.68 1cfe n LYS 89 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1cfe n LYS 90 N -4.21 2.53 -2.63 1.97 5.02 -1.26 -4.71 118.16 114.88 1cfe n LYS 90 Ca 0.15 -2.65 -0.22 0.00 -2.02 0.00 0.00 58.31 53.56 1cfe n LYS 90 Cb 0.54 -3.35 -0.00 0.00 -0.02 0.00 0.00 35.03 32.20 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 -0.31 2.51 0.03 0.00 0.00 -1.26 -4.62 116.66 113.01 1cfe n ARG 92 Ca 0.30 -4.14 0.00 0.00 -0.00 0.00 0.00 57.85 54.01 1cfe n ARG 92 Cb 0.66 -1.94 0.00 0.00 0.00 0.00 0.00 32.46 31.18 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 -0.22 -0.44 -0.25 -0.14 8.25 -1.26 -4.86 115.22 116.30 1cfe n HIS 93 Ca 0.28 0.08 0.06 0.00 -0.26 0.00 0.00 57.72 57.88 1cfe n HIS 93 Cb 0.63 0.40 0.19 0.00 1.12 0.00 0.00 29.99 32.33 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 0.24 -0.72 4.41 3.20 -1.84 0.20 116.97 122.46 1cfe h TYR 94 Ca 0.00 0.04 0.16 0.00 3.14 0.00 0.00 58.73 62.07 1cfe h TYR 94 Cb 0.19 0.01 -0.13 0.00 1.54 0.00 0.00 36.73 38.34 1cfe h TYR 94 CO 0.00 -0.11 -0.06 1.79 -1.64 0.00 0.00 178.16 178.14 1cfe h THR 95 N 0.24 0.34 -0.38 1.81 1.35 -1.90 0.95 112.91 115.33 1cfe h THR 95 Ca 0.42 -0.02 -0.12 0.00 -0.55 0.00 0.00 66.41 66.14 1cfe h THR 95 Cb 0.74 0.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 1cfe h THR 95 CO -0.54 0.01 -0.26 -0.61 -0.25 0.00 0.00 175.52 173.87 1cfe h GLN 96 N 0.07 0.78 -0.53 4.72 5.75 -0.96 0.25 115.11 125.18 1cfe h GLN 96 Ca 0.38 -0.33 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1cfe h GLN 96 Cb 0.63 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.13 1cfe h GLN 96 CO -0.67 0.95 0.28 0.28 -2.65 0.00 0.00 178.83 177.02 1cfe h VAL 97 N 0.67 1.19 0.00 2.39 2.07 -0.49 -3.12 116.25 118.95 1cfe h VAL 97 Ca 0.08 -0.49 -0.16 0.00 0.82 0.00 0.00 66.70 66.95 1cfe h VAL 97 Cb 0.79 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1cfe h VAL 97 CO 0.06 0.20 -0.94 1.62 0.02 0.00 0.00 177.57 178.54 1cfe h VAL 98 N 0.71 0.99 0.00 2.57 3.04 -0.67 -3.47 116.25 119.43 1cfe h VAL 98 Ca 0.18 -2.51 -0.43 0.00 -1.01 0.00 0.00 66.70 62.93 1cfe h VAL 98 Cb 0.07 2.44 -0.05 0.00 -2.01 0.00 0.00 31.29 31.74 1cfe h VAL 98 CO -0.03 0.57 1.13 1.87 -1.01 0.00 0.00 177.57 180.10 1cfe n TRP 99 N -3.16 0.56 -0.18 3.17 -0.00 0.87 -4.78 117.44 113.91 1cfe n TRP 99 Ca -0.03 0.38 0.07 0.00 -0.00 0.00 0.00 57.50 57.92 1cfe n TRP 99 Cb 0.84 -1.67 0.36 0.00 -0.00 0.00 0.00 31.31 30.85 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 7.71 0.71 0.00 5.87 1.12 -0.64 0.98 114.38 130.13 1cfe h ARG 100 Ca -0.05 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.76 1cfe h ARG 100 Cb 0.96 -0.16 -0.00 0.00 -0.01 0.00 0.00 29.97 30.76 1cfe h ARG 100 CO 0.91 0.47 -0.07 -0.97 -3.11 0.00 0.00 179.97 177.20 1cfe h ASN 101 N 0.73 0.00 -2.20 -3.80 -0.00 -1.81 -3.39 115.58 105.11 1cfe h ASN 101 Ca 0.32 0.00 -0.59 0.00 -0.00 0.00 0.00 56.30 56.03 1cfe h ASN 101 Cb 0.31 0.00 -0.11 0.00 -0.00 0.00 0.00 38.32 38.52 1cfe h ASN 101 CO -0.11 0.07 0.98 -0.55 -0.00 0.00 0.00 177.43 177.81 1cfe s SER 102 N -5.85 6.28 0.00 1.15 0.15 0.34 -4.36 113.70 111.41 1cfe s SER 102 Ca -0.03 -0.98 0.24 0.00 0.70 0.00 0.00 55.95 55.88 1cfe s SER 102 Cb 0.12 -2.50 0.28 0.00 -1.71 0.00 0.00 66.02 62.21 1cfe s SER 102 CO 0.54 -1.58 1.26 1.33 1.20 0.00 0.00 173.24 175.99 1cfe n VAL 103 N 6.26 0.00 -3.95 4.45 0.24 -1.21 -4.79 118.33 119.31 1cfe n VAL 103 Ca 0.09 -0.04 -0.21 0.00 -2.04 0.00 0.00 64.34 62.14 1cfe n VAL 103 Cb 0.48 0.59 -0.03 0.00 -1.47 0.00 0.00 33.84 33.41 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 -2.87 3.05 -0.22 7.34 3.00 -1.13 -1.09 118.95 127.03 1cfe s ARG 104 Ca 0.13 -1.01 -0.19 0.00 0.00 0.00 0.00 55.73 54.66 1cfe s ARG 104 Cb 0.17 -2.67 0.06 0.00 0.00 0.00 0.00 34.95 32.51 1cfe s ARG 104 CO 0.71 0.32 0.57 -1.17 0.00 0.00 0.00 175.30 175.73 1cfe s LEU 105 N -3.94 -0.24 -0.23 2.53 2.96 -0.87 -4.06 118.68 114.83 1cfe s LEU 105 Ca 0.36 1.17 -0.11 0.00 -0.22 0.00 0.00 54.13 55.32 1cfe s LEU 105 Cb -0.08 1.97 0.08 0.00 0.50 0.00 0.00 46.19 48.66 1cfe s LEU 105 CO 0.27 -0.20 0.55 -0.83 -1.32 0.00 0.00 176.35 174.81 1cfe s GLY 106 N 0.45 -0.50 0.33 7.98 0.00 -0.30 -0.39 107.32 114.89 1cfe s GLY 106 Ca -0.01 1.96 0.05 0.00 0.00 0.00 0.00 44.72 46.72 1cfe s GLY 106 CO -0.01 2.24 0.03 0.00 0.00 0.00 0.00 173.10 175.35 1cfe s GLY 108 N -3.51 1.69 -0.29 0.00 0.00 -0.01 -4.47 107.32 100.72 1cfe s GLY 108 Ca 0.35 -1.68 0.02 0.00 0.00 0.00 0.00 44.72 43.41 1cfe s GLY 108 CO 0.15 -1.18 0.54 -1.60 0.00 0.00 0.00 173.10 171.01 1cfe s ARG 109 N -3.39 0.51 0.14 2.90 3.52 -1.26 -2.68 118.95 118.70 1cfe s ARG 109 Ca 0.34 0.65 0.07 0.00 -0.13 0.00 0.00 55.73 56.67 1cfe s ARG 109 Cb 0.01 0.18 -0.04 0.00 -1.56 0.00 0.00 34.95 33.55 1cfe s ARG 109 CO 0.21 -0.84 -0.04 0.00 -0.81 0.00 0.00 175.30 173.82 1cfe s ALA 110 N 2.76 3.12 0.19 6.12 0.00 -0.21 -4.97 121.76 128.77 1cfe s ALA 110 Ca 0.14 -1.30 -0.08 0.00 0.00 0.00 0.00 51.96 50.73 1cfe s ALA 110 Cb -0.13 -0.97 -0.07 0.00 0.00 0.00 0.00 23.12 21.95 1cfe s ALA 110 CO -0.23 0.57 0.48 0.50 0.00 0.00 0.00 175.76 177.07 1cfe s ARG 111 N -2.60 3.74 0.24 0.00 3.52 -1.26 -0.46 118.95 122.13 1cfe s ARG 111 Ca 0.25 0.14 -0.08 0.00 -0.13 0.00 0.00 55.73 55.92 1cfe s ARG 111 Cb -0.10 -2.74 -0.02 0.00 -1.56 0.00 0.00 34.95 30.53 1cfe s ARG 111 CO 0.17 0.39 0.36 0.00 -0.81 0.00 0.00 175.30 175.41 1cfe h ASN 113 N 2.36 0.06 0.00 0.00 7.08 -1.86 -3.11 115.58 120.11 1cfe h ASN 113 Ca -0.29 -0.04 0.00 0.00 -3.08 0.00 0.00 56.30 52.88 1cfe h ASN 113 Cb 1.25 -0.02 0.00 0.00 -2.08 0.00 0.00 38.32 37.47 1cfe h ASN 113 CO 0.41 0.08 0.00 -0.46 -2.08 0.00 0.00 177.43 175.39 1cfe n ASN 114 N -5.03 0.13 -0.03 6.14 6.94 -1.26 -4.47 115.26 117.68 1cfe n ASN 114 Ca -0.06 -1.04 0.11 0.00 -0.02 0.00 0.00 54.58 53.57 1cfe n ASN 114 Cb 0.05 0.00 0.05 0.00 -2.36 0.00 0.00 39.78 37.51 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 -0.02 -1.04 7.00 4.83 0.00 -1.26 -4.97 105.19 109.73 1cfe n GLY 115 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.41 0.00 -2.69 1.61 8.01 -1.18 -1.20 117.44 120.58 1cfe n TRP 116 Ca 0.05 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.82 1cfe n TRP 116 Cb 0.34 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.61 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 0.00 2.70 -0.67 -5.99 0.52 -1.26 0.04 118.94 114.27 1cfe s TRP 117 Ca 0.00 -0.92 -0.25 0.00 0.02 0.00 0.00 56.10 54.95 1cfe s TRP 117 Cb 0.00 -4.54 0.05 0.00 -1.15 0.00 0.00 33.47 27.83 1cfe s TRP 117 CO 0.00 -1.79 1.10 0.12 0.02 0.00 0.00 176.95 176.40 1cfe s PHE 118 N 4.28 2.53 -0.14 -1.98 5.36 0.39 -1.20 117.98 127.22 1cfe s PHE 118 Ca 0.39 -0.21 -0.24 0.00 -0.96 0.00 0.00 56.93 55.92 1cfe s PHE 118 Cb -0.03 -4.41 -0.02 0.00 -0.34 0.00 0.00 43.02 38.21 1cfe s PHE 118 CO -0.06 -1.78 0.74 0.42 -1.46 0.00 0.00 175.22 173.08 1cfe s ILE 119 N 4.78 4.97 -0.00 3.12 1.09 0.20 -1.05 121.20 134.31 1cfe s ILE 119 Ca 0.30 1.47 0.00 0.00 -1.10 0.00 0.00 60.65 61.32 1cfe s ILE 119 Cb -0.12 -4.06 -0.04 0.00 -1.06 0.00 0.00 42.46 37.18 1cfe s ILE 119 CO 0.14 0.12 0.06 -0.44 -0.10 0.00 0.00 174.94 174.72 1cfe s SER 120 N 1.06 5.52 -0.01 3.58 0.01 -1.09 -0.52 113.70 122.25 1cfe s SER 120 Ca 0.36 0.10 -0.00 0.00 1.31 0.00 0.00 55.95 57.72 1cfe s SER 120 Cb -0.17 -1.55 0.01 0.00 0.21 0.00 0.00 66.02 64.53 1cfe s SER 120 CO 0.14 0.27 0.02 0.00 0.41 0.00 0.00 173.24 174.08 1cfe s ASN 122 N 0.34 4.22 0.05 0.00 -0.87 -0.01 -1.85 114.94 116.83 1cfe s ASN 122 Ca -0.03 -0.47 0.02 0.00 -1.57 0.00 0.00 52.86 50.81 1cfe s ASN 122 Cb -0.04 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.25 40.43 1cfe s ASN 122 CO -0.01 0.16 -0.07 -0.31 -2.57 0.00 0.00 177.10 174.30 1cfe s TYR 123 N -1.28 0.71 -0.02 2.20 1.51 -1.26 -1.15 117.35 118.06 1cfe s TYR 123 Ca 0.21 -0.59 -0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1cfe s TYR 123 Cb -0.11 -0.42 0.02 0.00 -0.11 0.00 0.00 41.96 41.35 1cfe s TYR 123 CO 0.13 -0.10 0.03 0.34 -1.11 0.00 0.00 175.55 174.84 1cfe s ASP 124 N -1.88 0.05 1.35 2.29 -1.08 -1.26 -4.33 116.67 111.82 1cfe s ASP 124 Ca -0.06 0.04 -0.22 0.00 -0.52 0.00 0.00 52.55 51.79 1cfe s ASP 124 Cb -0.07 -0.05 0.34 0.00 -1.46 0.00 0.00 42.92 41.69 1cfe s ASP 124 CO -0.01 -0.11 1.02 -2.16 0.52 0.00 0.00 175.17 174.43 1cfe s PRO 125 N 0.87 -2.38 0.33 4.34 0.04 -1.26 -2.84 135.00 134.11 1cfe s PRO 125 Ca -0.07 -0.07 -0.27 0.00 0.04 0.00 0.00 61.00 60.63 1cfe s PRO 125 Cb -0.10 -1.46 -0.13 0.00 0.04 0.00 0.00 34.50 32.84 1cfe s PRO 125 CO -0.03 -4.47 0.95 1.33 0.04 0.00 0.00 177.00 174.83 1cfe n VAL 126 N -5.30 2.08 -4.51 -0.36 0.24 -1.26 -4.76 118.33 104.46 1cfe n VAL 126 Ca 0.14 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.34 61.68 1cfe n VAL 126 Cb 0.60 -0.97 -0.08 0.00 -1.47 0.00 0.00 33.84 31.93 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 -0.65 2.71 -0.53 7.63 0.00 -1.26 -4.71 107.32 110.51 1cfe s GLY 127 Ca 0.60 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 44.12 1cfe s GLY 127 CO 0.59 -1.80 0.00 0.70 0.00 0.00 0.00 173.10 172.59 1cfe n ASN 128 N -1.48 -5.38 -4.93 1.64 5.03 -1.26 -1.64 115.26 107.24 1cfe n ASN 128 Ca -0.05 0.12 -0.20 0.00 0.87 0.00 0.00 54.58 55.32 1cfe n ASN 128 Cb 0.64 -3.32 0.06 0.00 -1.02 0.00 0.00 39.78 36.14 1cfe n ASN 128 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1cfe s TRP 129 N -1.60 2.00 0.34 3.10 -0.11 -1.26 -4.95 118.94 116.46 1cfe s TRP 129 Ca 0.00 -0.42 -0.19 0.00 1.22 0.00 0.00 56.10 56.71 1cfe s TRP 129 Cb 0.00 -2.54 -0.10 0.00 -1.50 0.00 0.00 33.47 29.34 1cfe s TRP 129 CO 0.00 -1.09 0.82 -1.50 -4.62 0.00 0.00 176.95 170.56 1cfe s ILE 130 N -2.74 4.52 -1.15 5.86 2.07 -1.26 -4.43 121.20 124.07 1cfe s ILE 130 Ca 0.61 1.27 -0.06 0.00 -1.41 0.00 0.00 60.65 61.05 1cfe s ILE 130 Cb -0.07 -3.69 -0.03 0.00 0.13 0.00 0.00 42.46 38.80 1cfe s ILE 130 CO 0.39 -0.13 0.87 0.61 -1.91 0.00 0.00 174.94 174.77 1cfe n GLY 131 N -0.19 -0.78 0.00 1.50 0.00 -1.26 -4.89 105.19 99.58 1cfe n GLY 131 Ca 0.04 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1cfe n GLY 131 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cfe n GLN 132 N -3.80 0.00 0.00 1.61 6.02 -1.26 -5.17 117.38 114.78 1cfe n GLN 132 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 1cfe n GLN 132 Cb 0.64 -0.50 0.00 0.00 1.02 0.00 0.00 30.24 31.40 1cfe n GLN 132 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1cfe n ARG 133 N -1.35 0.00 0.01 -1.09 1.74 -1.26 -4.57 116.66 110.13 1cfe n ARG 133 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1cfe n ARG 133 Cb 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.31 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 0.00 0.23 0.00 5.56 0.13 -1.89 -3.25 132.00 132.78 1cfe h PRO 134 Ca 0.00 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1cfe h PRO 134 Cb 0.00 0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.25 1cfe h PRO 134 CO 0.00 1.11 0.00 2.48 -0.23 0.00 0.00 178.00 181.36