#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3efx n PRO 2 N 0.00 1.19 0.00 0.00 -0.02 -1.26 -4.94 135.00 129.97 3efx n PRO 2 Ca 0.00 0.45 0.09 0.00 -2.02 0.00 0.00 63.50 62.03 3efx n PRO 2 Cb 0.00 -2.35 -0.06 0.00 -0.02 0.00 0.00 33.50 31.06 3efx n PRO 2 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3efx n GLN 3 N -1.15 1.03 -3.94 -0.52 6.02 -1.26 -4.94 117.38 112.63 3efx n GLN 3 Ca 0.13 -0.40 -0.09 0.00 -0.01 0.00 0.00 57.00 56.63 3efx n GLN 3 Cb 0.46 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 30.30 3efx n GLN 3 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3efx s ASN 4 N -2.56 0.02 0.40 1.08 2.20 -1.26 -5.06 114.94 109.77 3efx s ASN 4 Ca 0.11 -0.96 0.12 0.00 -0.94 0.00 0.00 52.86 51.20 3efx s ASN 4 Cb 0.15 0.69 0.83 0.00 -2.00 0.00 0.00 41.25 40.92 3efx s ASN 4 CO 0.66 -1.33 1.90 -0.29 -2.94 0.00 0.00 177.10 175.11 3efx h ILE 5 N 2.11 1.20 0.25 0.54 2.10 -1.95 -2.07 117.51 119.69 3efx h ILE 5 Ca -0.26 -0.93 -0.01 0.00 1.08 0.00 0.00 64.86 64.74 3efx h ILE 5 Cb 1.25 1.46 0.00 0.00 -1.09 0.00 0.00 36.82 38.44 3efx h ILE 5 CO 0.33 0.27 -0.12 0.74 -1.08 0.00 0.00 178.15 178.30 3efx h THR 6 N 0.05 0.81 -0.98 2.19 2.02 -1.98 0.13 112.91 115.15 3efx h THR 6 Ca 0.01 -0.63 0.12 0.00 0.77 0.00 0.00 66.41 66.68 3efx h THR 6 Cb 0.48 1.15 -0.08 0.00 -1.74 0.00 0.00 68.15 67.96 3efx h THR 6 CO 0.03 0.13 0.62 -0.33 0.37 0.00 0.00 175.52 176.35 3efx h GLU 7 N -0.67 0.94 -0.28 6.66 5.08 -1.97 -1.26 114.58 123.08 3efx h GLU 7 Ca -0.03 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 3efx h GLU 7 Cb 0.47 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3efx h GLU 7 CO 0.06 0.62 -0.06 1.25 -1.00 0.00 0.00 179.01 179.87 3efx h LEU 8 N 0.96 0.54 -1.03 1.33 6.46 -1.18 -3.15 115.31 119.25 3efx h LEU 8 Ca 0.48 -0.36 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 3efx h LEU 8 Cb 0.48 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 40.23 3efx h LEU 8 CO -0.24 0.77 0.46 0.00 -0.62 0.00 0.00 178.44 178.81 3efx h SER 10 N 1.14 0.00 0.43 0.00 0.02 -1.20 -2.36 113.55 111.59 3efx h SER 10 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 3efx h SER 10 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3efx h SER 10 CO -0.05 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.02 3efx n GLU 11 N -3.94 0.23 -4.38 3.45 1.02 -0.82 -4.85 120.64 111.36 3efx n GLU 11 Ca 0.12 0.11 -0.28 0.00 -0.02 0.00 0.00 57.16 57.09 3efx n GLU 11 Cb 0.77 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.56 3efx n GLU 11 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3efx s TYR 12 N -2.65 2.15 0.38 -0.32 1.51 -0.89 -5.13 117.35 112.40 3efx s TYR 12 Ca 0.17 -0.39 -0.19 0.00 -1.01 0.00 0.00 57.07 55.65 3efx s TYR 12 Cb 0.13 -1.18 -0.10 0.00 -0.11 0.00 0.00 41.96 40.71 3efx s TYR 12 CO 0.31 0.29 0.86 -1.01 -1.11 0.00 0.00 175.55 174.89 3efx s HIS 13 N -1.07 3.36 -1.12 2.71 3.76 -1.26 -4.19 115.29 117.48 3efx s HIS 13 Ca 0.12 1.46 -0.03 0.00 -0.15 0.00 0.00 55.06 56.45 3efx s HIS 13 Cb -0.10 -2.72 0.00 0.00 1.11 0.00 0.00 32.58 30.87 3efx s HIS 13 CO 0.05 -0.00 0.45 0.09 -0.85 0.00 0.00 174.74 174.48 3efx n ASN 14 N -0.44 -4.85 -4.30 1.40 3.02 -1.26 -4.95 115.26 103.87 3efx n ASN 14 Ca 0.05 -0.21 -0.22 0.00 -0.03 0.00 0.00 54.58 54.17 3efx n ASN 14 Cb 0.53 -3.70 -0.12 0.00 -0.61 0.00 0.00 39.78 35.88 3efx n ASN 14 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3efx s THR 15 N -3.00 1.71 0.20 3.41 -4.23 -1.26 -0.52 115.64 111.95 3efx s THR 15 Ca 0.22 -1.76 -0.05 0.00 -1.18 0.00 0.00 61.69 58.92 3efx s THR 15 Cb -0.10 -1.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 3efx s THR 15 CO 0.28 -0.24 0.24 0.00 -0.54 0.00 0.00 174.62 174.35 3efx s GLN 16 N -2.47 1.24 -0.15 3.99 -2.07 -0.62 -4.92 119.66 114.65 3efx s GLN 16 Ca 0.12 -1.43 -0.12 0.00 -1.82 0.00 0.00 55.36 52.11 3efx s GLN 16 Cb -0.07 0.34 -0.05 0.00 -1.09 0.00 0.00 33.01 32.14 3efx s GLN 16 CO 0.05 -0.44 0.24 0.42 -1.32 0.00 0.00 175.29 174.24 3efx s ILE 17 N -4.07 5.34 -0.23 3.63 -1.09 -1.26 -1.55 121.20 121.96 3efx s ILE 17 Ca 0.29 0.44 -0.07 0.00 -2.23 0.00 0.00 60.65 59.08 3efx s ILE 17 Cb 0.04 -3.57 -0.03 0.00 -1.58 0.00 0.00 42.46 37.33 3efx s ILE 17 CO 0.08 0.45 0.05 -0.31 -1.23 0.00 0.00 174.94 173.98 3efx s TYR 18 N 0.13 3.09 -0.39 3.97 1.51 0.91 -4.98 117.35 121.59 3efx s TYR 18 Ca 0.15 -0.40 -0.23 0.00 -1.01 0.00 0.00 57.07 55.58 3efx s TYR 18 Cb -0.13 -2.19 0.01 0.00 -0.11 0.00 0.00 41.96 39.54 3efx s TYR 18 CO 0.03 -0.30 0.76 0.99 -1.11 0.00 0.00 175.55 175.93 3efx s THR 19 N 1.40 4.73 -0.26 -0.71 2.01 -1.26 -0.61 115.64 120.93 3efx s THR 19 Ca 0.05 0.70 -0.15 0.00 0.31 0.00 0.00 61.69 62.60 3efx s THR 19 Cb -0.15 -4.23 -0.12 0.00 0.01 0.00 0.00 72.50 68.02 3efx s THR 19 CO 0.03 -0.51 -0.30 -0.38 -0.69 0.00 0.00 174.62 172.77 3efx n ILE 20 N 5.87 1.52 -4.12 1.82 2.08 0.24 -4.99 119.36 121.79 3efx n ILE 20 Ca 0.02 -0.26 -0.28 0.00 0.56 0.00 0.00 62.75 62.79 3efx n ILE 20 Cb 0.48 -1.98 -0.06 0.00 -0.75 0.00 0.00 39.64 37.34 3efx n ILE 20 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 3efx n ASN 21 N -4.31 0.18 -3.54 4.38 3.02 0.48 -4.98 115.26 110.50 3efx n ASN 21 Ca -0.46 -1.14 -0.14 0.00 -0.03 0.00 0.00 54.58 52.82 3efx n ASN 21 Cb 0.80 -2.35 -0.05 0.00 -0.61 0.00 0.00 39.78 37.57 3efx n ASN 21 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3efx s ASP 22 N -4.36 -0.48 0.60 6.41 2.15 -0.45 -4.91 116.67 115.64 3efx s ASP 22 Ca 0.01 0.17 -0.15 0.00 0.43 0.00 0.00 52.55 53.01 3efx s ASP 22 Cb -0.01 0.52 -0.03 0.00 -0.30 0.00 0.00 42.92 43.10 3efx s ASP 22 CO 0.94 -0.77 1.05 -1.59 -0.17 0.00 0.00 175.17 174.63 3efx s LYS 23 N -2.67 3.32 0.18 4.34 -2.85 -1.26 -1.38 119.74 119.42 3efx s LYS 23 Ca -0.04 1.14 -0.31 0.00 -1.00 0.00 0.00 55.97 55.76 3efx s LYS 23 Cb -0.00 -2.04 -0.09 0.00 -2.06 0.00 0.00 37.83 33.64 3efx s LYS 23 CO -0.03 -0.81 1.39 0.42 0.10 0.00 0.00 175.35 176.42 3efx s ILE 24 N -2.57 3.07 -0.03 3.79 1.01 -1.26 -4.72 121.20 120.49 3efx s ILE 24 Ca 0.62 0.83 -0.22 0.00 0.00 0.00 0.00 60.65 61.89 3efx s ILE 24 Cb -0.15 -3.53 -0.27 0.00 0.01 0.00 0.00 42.46 38.52 3efx s ILE 24 CO 0.39 0.10 0.99 0.25 0.00 0.00 0.00 174.94 176.67 3efx h LEU 25 N 5.87 0.44 -7.64 2.97 5.85 -1.32 -3.47 115.31 118.00 3efx h LEU 25 Ca -0.44 -0.86 -0.19 0.00 0.84 0.00 0.00 57.88 57.23 3efx h LEU 25 Cb 1.21 -0.14 -0.26 0.00 0.37 0.00 0.00 40.66 41.85 3efx h LEU 25 CO 0.81 1.26 -0.57 -0.94 -0.34 0.00 0.00 178.44 178.66 3efx s SER 26 N -6.77 -0.09 -0.13 1.25 1.04 -1.20 -4.98 113.70 102.83 3efx s SER 26 Ca -0.14 0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.46 3efx s SER 26 Cb 0.02 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.37 3efx s SER 26 CO 0.81 -0.09 -0.20 -0.47 0.98 0.00 0.00 173.24 174.27 3efx s TYR 27 N -0.19 2.68 -0.03 5.02 5.04 -1.26 -2.25 117.35 126.36 3efx s TYR 27 Ca -0.03 -1.08 0.05 0.00 -2.44 0.00 0.00 57.07 53.58 3efx s TYR 27 Cb -0.02 -1.80 -0.01 0.00 0.35 0.00 0.00 41.96 40.48 3efx s TYR 27 CO 0.00 -0.46 -0.18 0.99 -1.34 0.00 0.00 175.55 174.57 3efx s THR 28 N 0.60 1.42 0.01 4.34 2.01 0.23 -5.00 115.64 119.25 3efx s THR 28 Ca -0.11 -0.74 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 3efx s THR 28 Cb -0.16 -1.20 -0.00 0.00 0.01 0.00 0.00 72.50 71.14 3efx s THR 28 CO 0.03 0.41 0.11 -1.83 -0.69 0.00 0.00 174.62 172.65 3efx s GLU 29 N -0.19 0.48 -0.02 4.92 -1.05 -1.26 -0.42 118.70 121.17 3efx s GLU 29 Ca 0.02 -0.49 0.02 0.00 -0.15 0.00 0.00 54.97 54.37 3efx s GLU 29 Cb -0.09 0.20 0.00 0.00 -0.44 0.00 0.00 34.13 33.80 3efx s GLU 29 CO 0.01 -0.11 -0.06 0.45 0.95 0.00 0.00 175.26 176.50 3efx s SER 30 N -1.52 0.81 0.00 0.83 0.15 -0.38 -5.01 113.70 108.59 3efx s SER 30 Ca -0.13 -0.12 0.18 0.00 0.70 0.00 0.00 55.95 56.57 3efx s SER 30 Cb -0.07 -0.20 0.38 0.00 -1.71 0.00 0.00 66.02 64.42 3efx s SER 30 CO 0.00 0.04 1.30 0.00 1.20 0.00 0.00 173.24 175.78 3efx n LEU 31 N 3.27 3.18 -4.77 3.45 -0.00 -1.26 -2.94 117.00 117.93 3efx n LEU 31 Ca -0.17 -1.66 -0.38 0.00 -0.00 0.00 0.00 56.01 53.80 3efx n LEU 31 Cb 0.55 -0.25 -0.02 0.00 -0.00 0.00 0.00 43.42 43.70 3efx n LEU 31 CO 0.25 0.73 0.82 0.00 -0.00 0.00 0.00 177.39 179.19 3efx s ALA 32 N -1.18 3.15 -0.24 1.47 0.00 -1.26 -4.74 121.76 118.97 3efx s ALA 32 Ca 0.32 0.92 -0.43 0.00 0.00 0.00 0.00 51.96 52.77 3efx s ALA 32 Cb 0.18 -3.36 -0.19 0.00 0.00 0.00 0.00 23.12 19.75 3efx s ALA 32 CO 0.25 -0.46 1.39 0.41 0.00 0.00 0.00 175.76 177.35 3efx n GLY 33 N 0.61 0.10 3.23 0.00 0.00 -1.26 0.56 105.19 108.43 3efx n GLY 33 Ca 0.04 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.95 3efx n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3efx n LYS 34 N 3.07 -0.87 -1.77 1.61 5.02 -1.26 -4.76 118.16 119.20 3efx n LYS 34 Ca 0.25 0.22 -0.06 0.00 -2.02 0.00 0.00 58.31 56.70 3efx n LYS 34 Cb 0.03 -4.35 0.07 0.00 -0.02 0.00 0.00 35.03 30.77 3efx n LYS 34 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3efx n ARG 35 N -0.82 2.05 -1.88 1.97 5.12 0.19 -4.96 116.66 118.34 3efx n ARG 35 Ca 0.00 -3.43 -0.42 0.00 -1.93 0.00 0.00 57.85 52.07 3efx n ARG 35 Cb 0.22 -1.57 -0.00 0.00 -1.16 0.00 0.00 32.46 29.94 3efx n ARG 35 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3efx n GLU 36 N -0.58 2.83 -4.35 5.56 4.71 -1.13 -4.12 120.64 123.56 3efx n GLU 36 Ca 0.23 -2.70 -0.18 0.00 -0.01 0.00 0.00 57.16 54.49 3efx n GLU 36 Cb 0.89 -3.32 -0.10 0.00 -1.01 0.00 0.00 31.44 27.90 3efx n GLU 36 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3efx s MET 37 N 3.56 1.54 0.08 3.49 0.23 -1.15 -4.94 119.30 122.10 3efx s MET 37 Ca 0.49 -1.87 0.06 0.00 -1.03 0.00 0.00 55.69 53.35 3efx s MET 37 Cb 0.12 -0.25 -0.03 0.00 -1.53 0.00 0.00 34.83 33.14 3efx s MET 37 CO -0.04 -0.37 -0.16 0.00 -2.03 0.00 0.00 175.02 172.42 3efx s ALA 38 N -3.62 1.37 -0.06 3.16 0.00 -0.87 -1.24 121.76 120.48 3efx s ALA 38 Ca 0.36 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.26 3efx s ALA 38 Cb 0.06 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.05 3efx s ALA 38 CO 0.15 0.23 -0.08 0.42 0.00 0.00 0.00 175.76 176.48 3efx s ILE 39 N -1.22 0.87 0.16 0.00 1.01 0.44 -0.74 121.20 121.72 3efx s ILE 39 Ca 0.01 -0.31 0.10 0.00 0.00 0.00 0.00 60.65 60.45 3efx s ILE 39 Cb -0.10 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 3efx s ILE 39 CO 0.03 0.30 -0.19 0.27 0.00 0.00 0.00 174.94 175.35 3efx s ILE 40 N 0.89 2.69 0.23 2.92 -4.36 -0.12 -0.60 121.20 122.85 3efx s ILE 40 Ca -0.11 -1.77 0.04 0.00 -0.26 0.00 0.00 60.65 58.55 3efx s ILE 40 Cb -0.15 -2.28 -0.05 0.00 1.25 0.00 0.00 42.46 41.23 3efx s ILE 40 CO 0.01 -0.03 -0.01 0.42 0.24 0.00 0.00 174.94 175.57 3efx s THR 41 N -1.47 1.07 0.13 8.37 -4.23 -0.96 -0.63 115.64 117.92 3efx s THR 41 Ca 0.20 -2.04 0.04 0.00 -1.18 0.00 0.00 61.69 58.72 3efx s THR 41 Cb -0.09 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 3efx s THR 41 CO 0.11 -0.34 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.38 3efx s PHE 42 N -3.40 1.22 -0.63 3.99 0.40 -0.16 -0.82 117.98 118.59 3efx s PHE 42 Ca 0.28 -0.70 0.16 0.00 -0.60 0.00 0.00 56.93 56.08 3efx s PHE 42 Cb 0.05 -0.64 0.75 0.00 0.51 0.00 0.00 43.02 43.70 3efx s PHE 42 CO 0.09 0.07 1.50 0.36 0.70 0.00 0.00 175.22 177.93 3efx n LYS 43 N 0.14 0.10 -0.02 0.44 2.85 -1.26 -1.36 118.16 119.04 3efx n LYS 43 Ca -0.13 0.45 0.13 0.00 -1.05 0.00 0.00 58.31 57.72 3efx n LYS 43 Cb 0.59 -1.73 0.56 0.00 -0.65 0.00 0.00 35.03 33.80 3efx n LYS 43 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 3efx n ASN 44 N -1.93 1.16 0.00 -5.58 6.94 -1.26 -4.91 115.26 109.69 3efx n ASN 44 Ca 0.01 -1.46 0.00 0.00 -0.02 0.00 0.00 54.58 53.11 3efx n ASN 44 Cb 0.12 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 3efx n ASN 44 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3efx n GLY 45 N 1.10 0.64 3.73 4.83 0.00 -0.47 -5.07 105.19 109.96 3efx n GLY 45 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3efx n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3efx s ALA 46 N -2.05 3.31 -0.07 4.61 0.00 -1.24 -4.89 121.76 121.43 3efx s ALA 46 Ca 0.00 0.71 0.05 0.00 0.00 0.00 0.00 51.96 52.72 3efx s ALA 46 Cb 0.00 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 3efx s ALA 46 CO 0.00 -0.15 -0.22 0.99 0.00 0.00 0.00 175.76 176.38 3efx s THR 47 N -0.02 1.89 0.09 0.00 2.01 -1.26 -0.99 115.64 117.36 3efx s THR 47 Ca 0.49 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.57 3efx s THR 47 Cb -0.27 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 3efx s THR 47 CO 0.32 0.53 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.33 3efx s PHE 48 N 0.13 0.98 0.29 4.92 0.08 0.19 -4.10 117.98 120.47 3efx s PHE 48 Ca -0.11 -0.72 0.11 0.00 0.12 0.00 0.00 56.93 56.34 3efx s PHE 48 Cb -0.15 -0.54 -0.05 0.00 -0.57 0.00 0.00 43.02 41.70 3efx s PHE 48 CO 0.06 -0.05 -0.16 1.14 -0.10 0.00 0.00 175.22 176.11 3efx s GLN 49 N -3.00 1.76 -0.19 0.44 -2.07 0.24 -0.94 119.66 115.89 3efx s GLN 49 Ca 0.06 -1.78 -0.02 0.00 -1.82 0.00 0.00 55.36 51.80 3efx s GLN 49 Cb -0.01 -1.79 -0.00 0.00 -1.09 0.00 0.00 33.01 30.11 3efx s GLN 49 CO -0.01 0.29 -0.09 0.08 -1.32 0.00 0.00 175.29 174.24 3efx s VAL 50 N -2.52 3.05 -0.04 3.63 1.01 0.08 -0.86 120.40 124.75 3efx s VAL 50 Ca 0.31 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.54 3efx s VAL 50 Cb -0.04 -2.35 -0.07 0.00 0.00 0.00 0.00 36.38 33.92 3efx s VAL 50 CO 0.16 0.47 0.55 -0.33 0.00 0.00 0.00 175.10 175.95 3efx h GLU 51 N 7.79 -0.45 0.00 2.72 5.08 -1.91 -2.31 114.58 125.50 3efx h GLU 51 Ca -0.39 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 3efx h GLU 51 Cb 1.17 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3efx h GLU 51 CO 0.60 -0.30 -0.35 1.63 -1.00 0.00 0.00 179.01 179.59 3efx n LYS 62 N -4.98 0.21 -0.23 2.33 4.01 -1.26 -4.88 118.16 113.37 3efx n LYS 62 Ca -0.06 0.20 -0.05 0.00 -0.51 0.00 0.00 58.31 57.89 3efx n LYS 62 Cb 0.19 -1.00 0.12 0.00 -0.51 0.00 0.00 35.03 33.82 3efx n LYS 62 CO 0.00 0.00 0.00 1.57 -1.11 0.00 0.00 177.40 177.86 3efx h LYS 63 N -0.43 1.07 -0.38 1.97 2.10 -2.05 -2.80 116.57 116.04 3efx h LYS 63 Ca 0.00 -0.20 -0.10 0.00 -2.00 0.00 0.00 60.65 58.36 3efx h LYS 63 Cb 0.35 -0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 31.49 3efx h LYS 63 CO 0.00 0.88 -0.16 0.00 -2.00 0.00 0.00 179.45 178.18 3efx h ALA 64 N 1.24 1.01 -0.36 0.07 0.00 -2.05 0.14 119.26 119.30 3efx h ALA 64 Ca 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3efx h ALA 64 Cb 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3efx h ALA 64 CO -0.02 0.59 0.18 0.82 0.00 0.00 0.00 179.25 180.83 3efx h ILE 65 N 0.63 1.16 -0.40 0.00 2.04 -1.97 -0.53 117.51 118.45 3efx h ILE 65 Ca 0.10 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 3efx h ILE 65 Cb 0.62 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 3efx h ILE 65 CO 0.04 0.17 0.16 -0.33 0.00 0.00 0.00 178.15 178.19 3efx h GLU 66 N 0.45 0.59 -0.76 2.37 4.39 -1.15 -2.63 114.58 117.84 3efx h GLU 66 Ca 0.13 -0.10 0.08 0.00 0.34 0.00 0.00 59.36 59.81 3efx h GLU 66 Cb 0.10 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.58 3efx h GLU 66 CO -0.02 0.55 0.42 -0.09 -1.16 0.00 0.00 179.01 178.71 3efx h ARG 67 N 0.50 0.71 -0.31 2.33 2.43 -0.65 -1.93 114.38 117.45 3efx h ARG 67 Ca 0.13 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 3efx h ARG 67 Cb 0.17 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3efx h ARG 67 CO -0.01 0.47 0.13 1.98 -1.51 0.00 0.00 179.97 181.03 3efx h MET 68 N 0.73 0.28 -0.43 0.20 4.05 -0.74 0.13 114.93 119.15 3efx h MET 68 Ca 0.36 -0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.67 3efx h MET 68 Cb 0.31 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.03 3efx h MET 68 CO -0.23 0.19 -0.14 0.87 0.23 0.00 0.00 176.91 177.82 3efx h LYS 69 N 0.29 0.78 -0.39 0.39 1.57 -1.34 -0.34 116.57 117.54 3efx h LYS 69 Ca 0.13 -0.27 0.06 0.00 -1.87 0.00 0.00 60.65 58.70 3efx h LYS 69 Cb 0.07 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.27 3efx h LYS 69 CO -0.11 0.88 0.06 -0.44 -0.57 0.00 0.00 179.45 179.27 3efx h ASP 70 N 0.70 -0.03 -0.71 0.86 3.32 -0.89 -0.35 116.42 119.33 3efx h ASP 70 Ca 0.11 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 3efx h ASP 70 Cb 0.63 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3efx h ASP 70 CO 0.04 0.02 0.29 0.74 -1.72 0.00 0.00 179.24 178.61 3efx h THR 71 N 0.18 1.25 -0.34 0.35 2.02 -0.42 -1.43 112.91 114.51 3efx h THR 71 Ca 0.19 -0.76 -0.08 0.00 0.77 0.00 0.00 66.41 66.53 3efx h THR 71 Cb 0.23 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3efx h THR 71 CO -0.26 0.31 -0.09 -0.07 0.37 0.00 0.00 175.52 175.77 3efx h LEU 72 N 1.01 0.66 0.07 2.58 3.38 -0.85 0.84 115.31 123.01 3efx h LEU 72 Ca 0.24 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3efx h LEU 72 Cb 0.20 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3efx h LEU 72 CO -0.02 0.88 -0.14 -0.09 0.09 0.00 0.00 178.44 179.16 3efx h ARG 73 N 0.44 -0.26 -0.35 1.13 2.43 -0.86 0.73 114.38 117.64 3efx h ARG 73 Ca 0.08 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.16 3efx h ARG 73 Cb 0.60 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3efx h ARG 73 CO 0.04 -0.17 -0.22 0.97 -1.51 0.00 0.00 179.97 179.07 3efx h ILE 74 N -0.27 1.27 -0.46 1.20 6.09 -1.26 0.18 117.51 124.26 3efx h ILE 74 Ca 0.03 -1.31 0.01 0.00 -1.37 0.00 0.00 64.86 62.22 3efx h ILE 74 Cb 0.30 1.24 -0.03 0.00 0.47 0.00 0.00 36.82 38.80 3efx h ILE 74 CO -0.09 0.43 0.29 0.00 -3.07 0.00 0.00 178.15 175.72 3efx h ALA 75 N 1.15 0.59 0.39 0.18 0.00 -0.69 -0.56 119.26 120.32 3efx h ALA 75 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3efx h ALA 75 Cb 0.71 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3efx h ALA 75 CO 0.05 0.01 -0.23 -0.92 0.00 0.00 0.00 179.25 178.16 3efx h TYR 76 N 0.60 -0.59 -0.35 0.00 3.20 -0.60 -0.28 116.97 118.95 3efx h TYR 76 Ca 0.18 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.05 3efx h TYR 76 Cb -0.04 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3efx h TYR 76 CO -0.05 -0.35 0.24 -0.07 -1.64 0.00 0.00 178.16 176.28 3efx h LEU 77 N -0.58 0.36 -1.81 2.82 3.38 -0.79 -2.02 115.31 116.67 3efx h LEU 77 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3efx h LEU 77 Cb 0.47 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3efx h LEU 77 CO 0.05 0.26 0.00 0.35 0.09 0.00 0.00 178.44 179.19 3efx n THR 78 N -4.49 0.32 -2.41 0.22 -2.24 -0.23 -4.96 114.28 100.49 3efx n THR 78 Ca 0.03 -0.56 -0.19 0.00 -2.27 0.00 0.00 64.05 61.06 3efx n THR 78 Cb 0.11 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.15 3efx n THR 78 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3efx n GLU 79 N 1.03 -1.79 -1.88 -0.78 1.02 -0.54 -4.92 120.64 112.77 3efx n GLU 79 Ca 0.18 0.94 -0.42 0.00 -0.02 0.00 0.00 57.16 57.84 3efx n GLU 79 Cb 0.50 -5.60 -0.02 0.00 -0.02 0.00 0.00 31.44 26.30 3efx n GLU 79 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3efx s ALA 80 N -2.97 3.75 -0.08 0.62 0.00 -0.22 -4.74 121.76 118.13 3efx s ALA 80 Ca 0.00 1.44 -0.30 0.00 0.00 0.00 0.00 51.96 53.11 3efx s ALA 80 Cb -0.00 -3.62 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 3efx s ALA 80 CO 0.00 -0.84 1.60 0.21 0.00 0.00 0.00 175.76 176.73 3efx s LYS 81 N 0.29 4.17 -0.22 0.00 2.20 -1.26 -4.30 119.74 120.62 3efx s LYS 81 Ca 0.66 2.10 -0.26 0.00 -0.36 0.00 0.00 55.97 58.10 3efx s LYS 81 Cb -0.45 -3.96 -0.00 0.00 -1.51 0.00 0.00 37.83 31.91 3efx s LYS 81 CO 0.39 -0.85 0.91 0.08 -0.36 0.00 0.00 175.35 175.52 3efx s VAL 82 N 4.03 4.79 0.00 4.02 1.01 -0.48 -3.67 120.40 130.10 3efx s VAL 82 Ca 0.71 1.76 0.00 0.00 0.00 0.00 0.00 61.98 64.45 3efx s VAL 82 Cb -0.31 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.87 3efx s VAL 82 CO 0.28 -0.09 0.17 1.21 0.00 0.00 0.00 175.10 176.67 3efx n GLU 83 N 5.93 0.00 -4.19 2.72 2.13 -0.30 -0.39 120.64 126.54 3efx n GLU 83 Ca 0.08 0.35 -0.19 0.00 0.66 0.00 0.00 57.16 58.06 3efx n GLU 83 Cb 0.47 -0.95 -0.12 0.00 0.27 0.00 0.00 31.44 31.11 3efx n GLU 83 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3efx s LYS 84 N -1.05 0.88 -0.07 5.31 1.02 -1.16 0.81 119.74 125.48 3efx s LYS 84 Ca 0.00 -1.01 0.05 0.00 0.02 0.00 0.00 55.97 55.02 3efx s LYS 84 Cb 0.00 -0.89 -0.00 0.00 -0.52 0.00 0.00 37.83 36.41 3efx s LYS 84 CO 0.00 0.20 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.90 3efx s LEU 85 N -1.85 2.00 -0.32 3.17 1.43 0.22 -1.10 118.68 122.22 3efx s LEU 85 Ca 0.00 -0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 52.45 3efx s LEU 85 Cb -0.09 -1.26 -0.01 0.00 0.03 0.00 0.00 46.19 44.85 3efx s LEU 85 CO 0.03 0.17 0.49 0.00 0.23 0.00 0.00 176.35 177.27 3efx s VAL 87 N 2.33 1.68 -0.05 0.00 -7.23 -0.60 0.20 120.40 116.74 3efx s VAL 87 Ca 0.19 -1.59 -0.28 0.00 -1.81 0.00 0.00 61.98 58.48 3efx s VAL 87 Cb -0.16 -1.57 -0.03 0.00 0.56 0.00 0.00 36.38 35.19 3efx s VAL 87 CO 0.12 -0.12 0.92 0.26 -0.31 0.00 0.00 175.10 175.97 3efx s TRP 88 N -1.33 3.59 -2.26 2.82 0.51 0.22 -1.60 118.94 120.89 3efx s TRP 88 Ca 0.07 1.55 0.23 0.00 -2.12 0.00 0.00 56.10 55.83 3efx s TRP 88 Cb -0.09 -3.06 0.54 0.00 -0.81 0.00 0.00 33.47 30.04 3efx s TRP 88 CO 0.04 -0.06 1.47 0.27 -0.51 0.00 0.00 176.95 178.17 3efx n ASN 89 N 4.26 3.71 -2.09 2.95 0.23 0.33 -2.24 115.26 122.39 3efx n ASN 89 Ca 0.05 -2.00 -0.14 0.00 -0.53 0.00 0.00 54.58 51.97 3efx n ASN 89 Cb 0.50 -0.37 0.25 0.00 -2.08 0.00 0.00 39.78 38.08 3efx n ASN 89 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3efx n ASN 90 N 1.58 4.36 -3.98 0.53 6.94 -1.26 -4.90 115.26 118.53 3efx n ASN 90 Ca 0.22 -3.35 -0.11 0.00 -0.02 0.00 0.00 54.58 51.31 3efx n ASN 90 Cb 0.62 -0.78 -0.12 0.00 -2.36 0.00 0.00 39.78 37.13 3efx n ASN 90 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3efx s LYS 91 N -3.06 0.34 -0.14 -3.83 1.02 -1.26 -5.10 119.74 107.72 3efx s LYS 91 Ca 0.55 -0.50 0.01 0.00 0.02 0.00 0.00 55.97 56.04 3efx s LYS 91 Cb 0.45 -0.08 0.02 0.00 -0.52 0.00 0.00 37.83 37.69 3efx s LYS 91 CO 0.12 0.01 -0.15 0.99 -0.92 0.00 0.00 175.35 175.40 3efx s THR 92 N -1.04 1.57 0.95 2.17 2.01 -1.26 -2.03 115.64 118.01 3efx s THR 92 Ca -0.10 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.15 3efx s THR 92 Cb -0.07 -1.47 0.14 0.00 0.01 0.00 0.00 72.50 71.10 3efx s THR 92 CO -0.00 0.46 0.98 -2.65 -0.69 0.00 0.00 174.62 172.71 3efx n PRO 93 N 4.67 -0.61 -1.59 4.92 -0.02 -1.26 -5.07 135.00 136.04 3efx n PRO 93 Ca -0.17 -0.12 -0.40 0.00 -2.02 0.00 0.00 63.50 60.79 3efx n PRO 93 Cb 0.50 -2.25 0.03 0.00 -0.02 0.00 0.00 33.50 31.76 3efx n PRO 93 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3efx n ASN 94 N -3.71 0.72 -4.45 2.55 4.13 -0.86 -4.48 115.26 109.17 3efx n ASN 94 Ca 0.10 0.91 -0.34 0.00 1.68 0.00 0.00 54.58 56.93 3efx n ASN 94 Cb 0.53 -1.33 -0.13 0.00 -1.54 0.00 0.00 39.78 37.30 3efx n ASN 94 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3efx s SER 95 N -0.98 4.71 -0.06 6.41 0.15 -0.95 -0.60 113.70 122.38 3efx s SER 95 Ca 0.68 -0.20 -0.30 0.00 0.70 0.00 0.00 55.95 56.83 3efx s SER 95 Cb -0.49 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.00 3efx s SER 95 CO 0.53 0.10 1.29 -0.63 1.20 0.00 0.00 173.24 175.73 3efx s ILE 96 N 0.78 4.09 -0.22 6.45 1.01 -0.04 -0.61 121.20 132.66 3efx s ILE 96 Ca -0.01 1.41 0.03 0.00 0.00 0.00 0.00 60.65 62.08 3efx s ILE 96 Cb -0.14 -3.91 -0.20 0.00 0.01 0.00 0.00 42.46 38.22 3efx s ILE 96 CO 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 174.94 174.86 3efx n ALA 97 N 5.63 1.35 -2.93 9.38 0.00 0.13 -4.91 120.51 129.17 3efx n ALA 97 Ca 0.12 -1.04 -0.10 0.00 0.00 0.00 0.00 53.44 52.43 3efx n ALA 97 Cb 0.45 -0.23 -0.05 0.00 0.00 0.00 0.00 19.45 19.62 3efx n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3efx s ALA 98 N -2.53 -0.77 0.00 0.00 0.00 -0.79 -4.98 121.76 112.70 3efx s ALA 98 Ca -0.29 -0.19 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3efx s ALA 98 Cb 0.08 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 3efx s ALA 98 CO 0.66 -0.63 -0.05 -1.50 0.00 0.00 0.00 175.76 174.25 3efx s ILE 99 N -3.82 0.37 0.08 0.00 2.07 -1.26 -1.52 121.20 117.12 3efx s ILE 99 Ca 0.04 -0.34 0.09 0.00 -1.41 0.00 0.00 60.65 59.03 3efx s ILE 99 Cb 0.02 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.24 3efx s ILE 99 CO -0.11 0.01 -0.25 -0.94 -1.91 0.00 0.00 174.94 171.74 3efx s SER 100 N -0.37 2.98 -0.03 4.50 1.04 -0.26 -5.01 113.70 116.56 3efx s SER 100 Ca -0.01 -0.65 0.03 0.00 0.48 0.00 0.00 55.95 55.81 3efx s SER 100 Cb -0.03 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.86 3efx s SER 100 CO -0.00 0.18 -0.11 -0.04 0.98 0.00 0.00 173.24 174.24 3efx s MET 101 N -1.61 1.21 0.00 4.02 -1.94 -1.26 -1.15 119.30 118.56 3efx s MET 101 Ca 0.11 -0.40 0.00 0.00 -1.71 0.00 0.00 55.69 53.69 3efx s MET 101 Cb -0.10 -1.10 0.00 0.00 2.01 0.00 0.00 34.83 35.65 3efx s MET 101 CO 0.04 0.15 0.00 0.00 -0.01 0.00 0.00 175.02 175.20