#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf5 n LEU 4 N 0.00 -0.12 0.00 1.08 7.94 -1.26 -5.01 117.00 119.63 3cf5 n LEU 4 Ca 0.00 0.27 0.00 0.00 -1.11 0.00 0.00 56.01 55.17 3cf5 n LEU 4 Cb 0.00 -0.73 0.00 0.00 0.53 0.00 0.00 43.42 43.22 3cf5 n LEU 4 CO 0.00 -0.61 0.00 1.17 -1.11 0.00 0.00 177.39 176.84 3cf5 n LYS 5 N -1.84 0.00 0.24 1.96 4.81 -1.26 -4.84 118.16 117.23 3cf5 n LYS 5 Ca -0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.33 3cf5 n LYS 5 Cb 0.11 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.11 3cf5 n LYS 5 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 3cf5 h THR 6 N 0.00 0.03 0.00 3.15 2.02 -1.97 -0.56 112.91 115.58 3cf5 h THR 6 Ca 0.00 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.66 3cf5 h THR 6 Cb 0.00 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 3cf5 h THR 6 CO 0.00 0.01 0.00 0.11 0.37 0.00 0.00 175.52 176.01 3cf5 h LYS 7 N -1.17 0.00 0.08 6.66 1.57 -1.94 1.00 116.57 122.77 3cf5 h LYS 7 Ca -0.07 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3cf5 h LYS 7 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 3cf5 h LYS 7 CO 0.11 0.00 -0.05 -0.92 -0.57 0.00 0.00 179.45 178.02 3cf5 h TYR 8 N 0.00 -0.14 0.00 -1.35 3.20 -1.81 0.43 116.97 117.30 3cf5 h TYR 8 Ca 0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3cf5 h TYR 8 Cb 0.10 0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.42 3cf5 h TYR 8 CO 0.00 -0.08 0.00 0.09 -1.64 0.00 0.00 178.16 176.53 3cf5 n ASN 9 N -2.48 0.00 0.00 -2.11 3.02 -0.26 -1.36 115.26 112.07 3cf5 n ASN 9 Ca -0.01 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 3cf5 n ASN 9 Cb 0.05 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 3cf5 n ASN 9 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3cf5 n ASP 10 N -0.38 0.00 -0.25 6.41 9.92 0.34 0.42 116.55 133.01 3cf5 n ASP 10 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 54.32 3cf5 n ASP 10 Cb 0.00 0.00 0.19 0.00 -0.64 0.00 0.00 41.12 40.67 3cf5 n ASP 10 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 3cf5 h GLN 11 N 0.00 0.34 0.00 -1.24 4.20 -0.32 -2.86 115.11 115.23 3cf5 h GLN 11 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3cf5 h GLN 11 Cb 0.00 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3cf5 h GLN 11 CO 0.00 0.22 0.00 0.28 -0.67 0.00 0.00 178.83 178.66 3cf5 n VAL 12 N -5.08 0.00 0.00 -0.54 0.31 0.22 -3.78 118.33 109.45 3cf5 n VAL 12 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 3cf5 n VAL 12 Cb 0.45 -0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 3cf5 n VAL 12 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3cf5 n ARG 13 N -0.31 0.00 0.02 5.55 0.63 1.43 0.94 116.66 124.92 3cf5 n ARG 13 Ca 0.00 0.37 -0.03 0.00 -0.92 0.00 0.00 57.85 57.27 3cf5 n ARG 13 Cb 0.00 -0.62 -0.02 0.00 0.45 0.00 0.00 32.46 32.27 3cf5 n ARG 13 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 3cf5 h PRO 14 N 0.00 -0.14 -1.81 -0.14 0.11 -1.51 0.22 132.00 128.73 3cf5 h PRO 14 Ca 0.00 0.01 0.53 0.00 0.11 0.00 0.00 66.00 66.65 3cf5 h PRO 14 Cb 0.00 0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.06 3cf5 h PRO 14 CO 0.00 -0.09 1.29 0.00 -0.21 0.00 0.00 178.00 178.99 3cf5 n ALA 15 N -2.54 1.75 0.09 -0.75 0.00 -0.92 0.24 120.51 118.37 3cf5 n ALA 15 Ca -0.02 0.65 -0.13 0.00 0.00 0.00 0.00 53.44 53.94 3cf5 n ALA 15 Cb 0.08 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 18.37 3cf5 n ALA 15 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3cf5 h LEU 16 N 0.00 -0.19 -1.48 0.00 3.38 0.38 0.31 115.31 117.70 3cf5 h LEU 16 Ca 0.89 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 58.58 3cf5 h LEU 16 Cb 3.49 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 44.28 3cf5 h LEU 16 CO -0.06 0.14 -0.22 0.24 0.09 0.00 0.00 178.44 178.63 3cf5 h MET 17 N -0.54 0.06 -1.39 1.13 2.86 0.40 4.74 114.93 122.19 3cf5 h MET 17 Ca -0.02 -0.01 -0.24 0.00 -2.06 0.00 0.00 59.70 57.36 3cf5 h MET 17 Cb 0.41 -0.01 -0.12 0.00 0.06 0.00 0.00 31.60 31.95 3cf5 h MET 17 CO 0.04 0.28 0.31 1.04 1.06 0.00 0.00 176.91 179.64 3cf5 n GLN 18 N -4.26 1.60 0.00 1.72 1.13 0.35 -2.92 117.38 115.01 3cf5 n GLN 18 Ca -0.02 -1.25 0.00 0.00 -1.94 0.00 0.00 57.00 53.79 3cf5 n GLN 18 Cb 0.29 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.15 3cf5 n GLN 18 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 3cf5 n GLN 19 N 0.30 0.00 0.00 -1.09 7.27 0.98 -4.77 117.38 120.07 3cf5 n GLN 19 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.31 3cf5 n GLN 19 Cb 0.71 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.36 3cf5 n GLN 19 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 3cf5 n PHE 20 N -1.28 0.00 -2.74 3.69 3.01 1.54 -5.04 117.46 116.64 3cf5 n PHE 20 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.47 3cf5 n PHE 20 Cb 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.48 3cf5 n PHE 20 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3cf5 s GLY 21 N 0.00 -1.65 -0.12 1.37 0.00 -1.25 -4.68 107.32 100.99 3cf5 s GLY 21 Ca 0.00 1.11 -0.11 0.00 0.00 0.00 0.00 44.72 45.72 3cf5 s GLY 21 CO 0.00 4.31 0.22 -0.19 0.00 0.00 0.00 173.10 177.45 3cf5 s TYR 22 N 1.71 3.56 -0.71 1.90 1.51 -1.26 -4.97 117.35 119.10 3cf5 s TYR 22 Ca 0.17 0.60 0.16 0.00 -1.01 0.00 0.00 57.07 56.99 3cf5 s TYR 22 Cb 0.06 -2.13 0.72 0.00 -0.11 0.00 0.00 41.96 40.49 3cf5 s TYR 22 CO -0.14 0.54 1.50 0.43 -1.11 0.00 0.00 175.55 176.76 3cf5 n SER 23 N 2.55 0.30 -2.77 2.29 7.64 -1.26 -4.80 113.62 117.57 3cf5 n SER 23 Ca -0.16 0.59 -0.09 0.00 1.01 0.00 0.00 58.87 60.21 3cf5 n SER 23 Cb 0.53 -0.65 0.02 0.00 -1.01 0.00 0.00 64.21 63.11 3cf5 n SER 23 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3cf5 n SER 24 N -1.85 -2.16 -0.00 6.43 7.64 -1.26 -5.00 113.62 117.41 3cf5 n SER 24 Ca 0.02 -2.60 0.10 0.00 1.01 0.00 0.00 58.87 57.40 3cf5 n SER 24 Cb 0.14 3.62 -0.14 0.00 -1.01 0.00 0.00 64.21 66.82 3cf5 n SER 24 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3cf5 n VAL 25 N -0.53 0.00 -0.04 0.44 0.24 -1.26 -4.10 118.33 113.08 3cf5 n VAL 25 Ca -0.08 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.34 61.84 3cf5 n VAL 25 Cb 0.58 0.51 -0.09 0.00 -1.47 0.00 0.00 33.84 33.38 3cf5 n VAL 25 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 3cf5 h MET 26 N 0.00 0.22 -1.23 7.34 2.86 -1.98 -3.23 114.93 118.91 3cf5 h MET 26 Ca 0.00 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 3cf5 h MET 26 Cb 0.74 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.41 3cf5 h MET 26 CO 0.00 0.71 0.00 0.00 1.06 0.00 0.00 176.91 178.68 3cf5 n ALA 27 N -2.43 2.48 -3.01 6.32 0.00 -1.26 -4.82 120.51 117.80 3cf5 n ALA 27 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.04 3cf5 n ALA 27 Cb 0.36 -1.01 -0.16 0.00 0.00 0.00 0.00 19.45 18.64 3cf5 n ALA 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3cf5 s VAL 28 N 0.16 2.53 0.02 0.00 1.01 -1.22 -4.91 120.40 117.99 3cf5 s VAL 28 Ca 0.00 -0.86 -0.39 0.00 0.00 0.00 0.00 61.98 60.72 3cf5 s VAL 28 Cb 0.00 -2.00 -0.19 0.00 0.00 0.00 0.00 36.38 34.19 3cf5 s VAL 28 CO 0.00 0.55 1.14 -2.65 0.00 0.00 0.00 175.10 174.14 3cf5 n PRO 29 N 3.31 0.29 -1.09 2.72 -0.02 -1.26 -4.89 135.00 134.06 3cf5 n PRO 29 Ca -0.18 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 3cf5 n PRO 29 Cb 0.53 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 3cf5 n PRO 29 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3cf5 n ARG 30 N 1.75 0.50 -4.00 -0.52 1.74 -1.26 -4.86 116.66 110.01 3cf5 n ARG 30 Ca 0.20 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.97 3cf5 n ARG 30 Cb 0.11 0.00 -0.16 0.00 -1.02 0.00 0.00 32.46 31.39 3cf5 n ARG 30 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3cf5 s ILE 31 N -1.30 1.65 -0.06 0.55 1.01 -1.26 -1.88 121.20 119.91 3cf5 s ILE 31 Ca 0.00 -0.97 -0.24 0.00 0.00 0.00 0.00 60.65 59.44 3cf5 s ILE 31 Cb 0.00 -1.70 -0.27 0.00 0.01 0.00 0.00 42.46 40.50 3cf5 s ILE 31 CO 0.00 0.21 0.93 -0.08 0.00 0.00 0.00 174.94 175.99 3cf5 h GLU 32 N 7.98 0.21 -1.61 2.79 4.81 0.18 -3.44 114.58 125.50 3cf5 h GLU 32 Ca -0.29 -0.29 0.06 0.00 -0.13 0.00 0.00 59.36 58.71 3cf5 h GLU 32 Cb 1.10 0.10 -0.24 0.00 0.63 0.00 0.00 28.75 30.34 3cf5 h GLU 32 CO 0.48 1.08 0.48 -1.59 -0.73 0.00 0.00 179.01 178.73 3cf5 s LYS 33 N -2.67 0.59 -0.12 1.92 -2.85 -1.03 -4.41 119.74 111.17 3cf5 s LYS 33 Ca -0.15 0.35 0.01 0.00 -1.00 0.00 0.00 55.97 55.17 3cf5 s LYS 33 Cb 0.00 0.28 -0.01 0.00 -2.06 0.00 0.00 37.83 36.04 3cf5 s LYS 33 CO 0.77 -0.14 -0.16 0.42 0.10 0.00 0.00 175.35 176.34 3cf5 s ILE 34 N -0.55 2.82 0.42 3.79 -1.09 0.65 -0.74 121.20 126.50 3cf5 s ILE 34 Ca -0.00 -0.75 0.06 0.00 -2.23 0.00 0.00 60.65 57.73 3cf5 s ILE 34 Cb -0.02 -2.16 -0.07 0.00 -1.58 0.00 0.00 42.46 38.63 3cf5 s ILE 34 CO -0.01 0.53 0.01 -0.69 -1.23 0.00 0.00 174.94 173.56 3cf5 s VAL 35 N 0.33 1.78 -0.37 2.92 1.01 -0.99 0.05 120.40 125.13 3cf5 s VAL 35 Ca -0.12 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 59.87 3cf5 s VAL 35 Cb -0.16 -2.83 0.15 0.00 0.00 0.00 0.00 36.38 33.54 3cf5 s VAL 35 CO 0.06 0.00 0.27 -0.69 0.00 0.00 0.00 175.10 174.75 3cf5 s VAL 36 N -2.79 0.14 0.02 2.92 1.01 -0.69 -2.88 120.40 118.12 3cf5 s VAL 36 Ca 0.30 -1.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.04 3cf5 s VAL 36 Cb 0.08 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 3cf5 s VAL 36 CO 0.15 -1.02 1.09 0.21 0.00 0.00 0.00 175.10 175.53 3cf5 s ASN 37 N 0.78 7.22 -0.66 3.32 3.04 0.09 -3.15 114.94 125.58 3cf5 s ASN 37 Ca 0.23 1.81 0.05 0.00 0.04 0.00 0.00 52.86 55.00 3cf5 s ASN 37 Cb -0.13 -2.57 0.27 0.00 -1.54 0.00 0.00 41.25 37.27 3cf5 s ASN 37 CO -0.06 -0.38 0.84 1.21 -3.04 0.00 0.00 177.10 175.67 3cf5 n GLU 38 N 4.04 2.80 -1.13 0.43 4.07 1.73 -2.71 120.64 129.87 3cf5 n GLU 38 Ca 0.08 -4.71 -0.33 0.00 -0.06 0.00 0.00 57.16 52.14 3cf5 n GLU 38 Cb 0.49 -2.27 -0.02 0.00 -0.06 0.00 0.00 31.44 29.57 3cf5 n GLU 38 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3cf5 n GLY 39 N 0.67 3.83 0.00 8.31 0.00 -1.26 0.51 105.19 117.24 3cf5 n GLY 39 Ca 0.30 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3cf5 n GLY 39 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3cf5 n LEU 40 N 4.01 0.00 0.00 0.99 -0.00 -1.12 -4.84 117.00 116.03 3cf5 n LEU 40 Ca 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.66 3cf5 n LEU 40 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.63 3cf5 n LEU 40 CO 0.81 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.81 3cf5 n GLY 41 N 5.00 0.71 5.03 1.47 0.00 -1.25 -4.65 105.19 111.50 3cf5 n GLY 41 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3cf5 n GLY 41 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3cf5 n SER 42 N -3.34 0.00 0.00 1.61 2.88 -1.26 -2.58 113.62 110.93 3cf5 n SER 42 Ca 0.00 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.64 3cf5 n SER 42 Cb 0.00 0.00 0.46 0.00 -0.75 0.00 0.00 64.21 63.92 3cf5 n SER 42 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3cf5 n SER 43 N 0.97 0.00 -3.30 -3.46 3.41 -1.26 -3.94 113.62 106.04 3cf5 n SER 43 Ca 0.00 0.41 -0.24 0.00 -0.26 0.00 0.00 58.87 58.78 3cf5 n SER 43 Cb 0.00 -0.46 -0.08 0.00 -0.26 0.00 0.00 64.21 63.40 3cf5 n SER 43 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3cf5 s LYS 44 N -2.92 0.90 -1.48 4.33 1.02 -1.06 -5.03 119.74 115.50 3cf5 s LYS 44 Ca 0.12 -1.89 -0.11 0.00 0.02 0.00 0.00 55.97 54.10 3cf5 s LYS 44 Cb 0.14 -1.19 0.02 0.00 -0.52 0.00 0.00 37.83 36.28 3cf5 s LYS 44 CO 0.37 -1.37 2.43 -1.91 -0.92 0.00 0.00 175.35 173.96 3cf5 n GLU 45 N 2.94 3.38 -3.40 1.68 2.13 -1.25 -4.10 120.64 122.03 3cf5 n GLU 45 Ca 0.27 -2.67 -0.45 0.00 0.66 0.00 0.00 57.16 54.97 3cf5 n GLU 45 Cb 0.49 -3.03 -0.05 0.00 0.27 0.00 0.00 31.44 29.12 3cf5 n GLU 45 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3cf5 s ASP 46 N 2.30 6.28 0.16 4.31 1.01 -1.26 -4.86 116.67 124.61 3cf5 s ASP 46 Ca 0.54 -2.34 0.05 0.00 0.71 0.00 0.00 52.55 51.51 3cf5 s ASP 46 Cb 0.15 -2.14 0.25 0.00 1.01 0.00 0.00 42.92 42.19 3cf5 s ASP 46 CO -0.07 -0.65 0.93 -1.54 0.21 0.00 0.00 175.17 174.04 3cf5 n SER 47 N 4.43 0.12 -0.07 0.27 3.41 -1.26 0.12 113.62 120.64 3cf5 n SER 47 Ca 0.02 0.34 -0.21 0.00 -0.26 0.00 0.00 58.87 58.76 3cf5 n SER 47 Cb 0.43 -0.29 -0.13 0.00 -0.26 0.00 0.00 64.21 63.97 3cf5 n SER 47 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3cf5 n LYS 48 N -1.58 0.69 0.02 4.33 2.85 -1.26 -4.45 118.16 118.75 3cf5 n LYS 48 Ca -0.00 0.25 -0.01 0.00 -1.05 0.00 0.00 58.31 57.49 3cf5 n LYS 48 Cb 0.36 -1.62 0.26 0.00 -0.65 0.00 0.00 35.03 33.38 3cf5 n LYS 48 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3cf5 h ALA 49 N -0.09 1.26 -0.95 0.58 0.00 0.57 -2.79 119.26 117.83 3cf5 h ALA 49 Ca -0.50 -0.27 0.22 0.00 0.00 0.00 0.00 54.91 54.36 3cf5 h ALA 49 Cb 1.89 -0.13 -0.12 0.00 0.00 0.00 0.00 17.79 19.43 3cf5 h ALA 49 CO -0.05 0.49 0.52 0.82 0.00 0.00 0.00 179.25 181.03 3cf5 h ILE 50 N 0.45 0.57 -0.85 0.00 2.04 -1.60 -0.47 117.51 117.64 3cf5 h ILE 50 Ca 0.08 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 3cf5 h ILE 50 Cb 0.49 -0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.48 3cf5 h ILE 50 CO 0.03 0.10 0.51 0.44 0.00 0.00 0.00 178.15 179.23 3cf5 h ASP 51 N 0.56 1.03 -0.65 1.72 3.32 -1.74 -3.02 116.42 117.64 3cf5 h ASP 51 Ca 0.59 -0.07 0.08 0.00 0.02 0.00 0.00 57.03 57.65 3cf5 h ASP 51 Cb 1.05 -0.26 -0.11 0.00 0.22 0.00 0.00 39.33 40.24 3cf5 h ASP 51 CO -0.46 0.79 -0.51 0.50 -1.72 0.00 0.00 179.24 177.84 3cf5 h LYS 52 N 1.17 -0.21 0.00 3.56 3.64 -1.18 -1.77 116.57 121.79 3cf5 h LYS 52 Ca 0.31 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 3cf5 h LYS 52 Cb -0.04 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3cf5 h LYS 52 CO -0.06 -0.14 0.00 0.00 -2.27 0.00 0.00 179.45 176.99 3cf5 n ALA 53 N -3.18 -0.04 -0.34 5.00 0.00 -1.14 -0.07 120.51 120.74 3cf5 n ALA 53 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3cf5 n ALA 53 Cb 0.33 0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3cf5 n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cf5 n ALA 54 N -1.16 0.00 -0.23 0.00 0.00 -1.17 0.23 120.51 118.18 3cf5 n ALA 54 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3cf5 n ALA 54 Cb 0.00 0.38 0.10 0.00 0.00 0.00 0.00 19.45 19.93 3cf5 n ALA 54 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3cf5 n LYS 55 N -2.20 -0.06 0.00 0.00 4.76 -0.68 -0.52 118.16 119.47 3cf5 n LYS 55 Ca 0.00 1.00 0.00 0.00 -2.87 0.00 0.00 58.31 56.44 3cf5 n LYS 55 Cb 0.00 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 3cf5 n LYS 55 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3cf5 n GLU 56 N -5.03 0.00 -0.15 1.97 1.02 0.29 -3.31 120.64 115.43 3cf5 n GLU 56 Ca 0.11 0.14 -0.01 0.00 -0.02 0.00 0.00 57.16 57.38 3cf5 n GLU 56 Cb 0.34 -0.99 0.01 0.00 -0.02 0.00 0.00 31.44 30.78 3cf5 n GLU 56 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3cf5 n LEU 57 N -0.91 -0.26 -0.05 -4.62 4.77 0.63 0.15 117.00 116.71 3cf5 n LEU 57 Ca 0.00 0.67 0.18 0.00 -0.03 0.00 0.00 56.01 56.83 3cf5 n LEU 57 Cb 0.00 -0.15 0.63 0.00 -2.33 0.00 0.00 43.42 41.57 3cf5 n LEU 57 CO 0.00 -0.60 1.19 0.00 -1.33 0.00 0.00 177.39 176.65 3cf5 h ALA 58 N 0.51 2.37 -0.00 -1.18 0.00 -0.88 0.88 119.26 120.95 3cf5 h ALA 58 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3cf5 h ALA 58 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3cf5 h ALA 58 CO -0.38 -0.53 -0.46 1.28 0.00 0.00 0.00 179.25 179.16 3cf5 n LEU 59 N -4.41 0.71 -0.06 0.00 4.77 0.40 0.16 117.00 118.56 3cf5 n LEU 59 Ca 0.11 -0.12 0.01 0.00 -0.03 0.00 0.00 56.01 55.98 3cf5 n LEU 59 Cb 0.57 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3cf5 n LEU 59 CO 0.36 0.16 0.22 2.30 -1.33 0.00 0.00 177.39 179.09 3cf5 n ILE 60 N -1.23 0.00 -0.87 -0.08 -5.35 -0.16 -4.53 119.36 107.14 3cf5 n ILE 60 Ca 0.07 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 3cf5 n ILE 60 Cb 0.34 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 3cf5 n ILE 60 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3cf5 n THR 61 N -0.15 0.00 -3.90 7.28 -2.24 0.29 -4.96 114.28 110.60 3cf5 n THR 61 Ca 0.01 -0.03 -0.34 0.00 -2.27 0.00 0.00 64.05 61.42 3cf5 n THR 61 Cb 0.05 1.87 0.01 0.00 -2.10 0.00 0.00 70.33 70.16 3cf5 n THR 61 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3cf5 n LEU 62 N -0.00 -0.83 -3.57 3.22 4.77 0.12 -4.92 117.00 115.79 3cf5 n LEU 62 Ca 0.00 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 3cf5 n LEU 62 Cb 0.22 -1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 39.78 3cf5 n LEU 62 CO 0.00 0.59 0.76 -1.58 -1.33 0.00 0.00 177.39 175.84 3cf5 s GLN 63 N -6.11 0.25 -0.10 3.23 0.74 -1.09 -5.02 119.66 111.57 3cf5 s GLN 63 Ca 0.24 0.48 -0.29 0.00 0.05 0.00 0.00 55.36 55.84 3cf5 s GLN 63 Cb -0.14 0.12 -0.04 0.00 1.10 0.00 0.00 33.01 34.06 3cf5 s GLN 63 CO 0.87 -0.06 1.51 0.21 -0.55 0.00 0.00 175.29 177.27 3cf5 s LYS 64 N 1.53 4.20 0.68 1.67 2.20 -1.26 -3.72 119.74 125.02 3cf5 s LYS 64 Ca -0.07 1.99 -0.04 0.00 -0.36 0.00 0.00 55.97 57.50 3cf5 s LYS 64 Cb -0.03 -3.91 0.08 0.00 -1.51 0.00 0.00 37.83 32.45 3cf5 s LYS 64 CO -0.14 -0.80 0.96 -1.25 -0.36 0.00 0.00 175.35 173.75 3cf5 s PRO 65 N 3.85 2.09 0.01 4.03 0.04 -1.26 -4.96 135.00 138.80 3cf5 s PRO 65 Ca 0.67 -0.61 0.04 0.00 0.04 0.00 0.00 61.00 61.14 3cf5 s PRO 65 Cb -0.29 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 3cf5 s PRO 65 CO 0.24 -1.20 -0.10 0.42 0.04 0.00 0.00 177.00 176.40 3cf5 s ILE 66 N -3.12 3.41 -1.03 0.56 1.01 0.63 -4.92 121.20 117.75 3cf5 s ILE 66 Ca 0.61 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 3cf5 s ILE 66 Cb -0.09 -2.47 0.06 0.00 0.01 0.00 0.00 42.46 39.97 3cf5 s ILE 66 CO 0.43 0.38 1.44 -0.63 0.00 0.00 0.00 174.94 176.55 3cf5 s ILE 67 N -0.98 4.02 -0.81 2.92 1.01 -1.26 -0.38 121.20 125.73 3cf5 s ILE 67 Ca 0.16 -0.94 -0.27 0.00 0.00 0.00 0.00 60.65 59.61 3cf5 s ILE 67 Cb -0.11 -5.04 -0.25 0.00 0.01 0.00 0.00 42.46 37.07 3cf5 s ILE 67 CO 0.07 -1.90 1.95 0.35 0.00 0.00 0.00 174.94 175.41 3cf5 n THR 68 N 6.70 0.34 -1.72 2.92 -2.24 0.43 -4.77 114.28 115.93 3cf5 n THR 68 Ca 0.33 -0.34 -0.41 0.00 -2.27 0.00 0.00 64.05 61.36 3cf5 n THR 68 Cb 0.50 -2.04 0.01 0.00 -2.10 0.00 0.00 70.33 66.70 3cf5 n THR 68 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3cf5 n LYS 69 N 8.06 2.14 -1.04 -0.78 5.02 -1.26 -2.76 118.16 127.55 3cf5 n LYS 69 Ca 0.43 0.76 -0.38 0.00 -2.02 0.00 0.00 58.31 57.11 3cf5 n LYS 69 Cb 0.45 -2.46 -0.04 0.00 -0.02 0.00 0.00 35.03 32.97 3cf5 n LYS 69 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cf5 n ALA 70 N 0.01 -2.52 0.13 7.82 0.00 0.10 -4.62 120.51 121.43 3cf5 n ALA 70 Ca 0.05 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3cf5 n ALA 70 Cb 0.39 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3cf5 n ALA 70 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3cf5 n LYS 71 N 0.86 0.13 -0.66 0.00 4.81 -1.26 -3.83 118.16 118.20 3cf5 n LYS 71 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 3cf5 n LYS 71 Cb 0.13 -1.20 0.00 0.00 0.02 0.00 0.00 35.03 33.98 3cf5 n LYS 71 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3cf5 n LYS 72 N 0.62 0.00 -1.72 1.64 5.02 -1.22 -4.88 118.16 117.62 3cf5 n LYS 72 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 3cf5 n LYS 72 Cb 0.04 -3.28 -0.03 0.00 -0.02 0.00 0.00 35.03 31.74 3cf5 n LYS 72 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3cf5 n SER 73 N 0.00 3.90 -3.10 4.39 7.64 -1.10 -3.95 113.62 121.40 3cf5 n SER 73 Ca 0.00 1.08 -0.24 0.00 1.01 0.00 0.00 58.87 60.72 3cf5 n SER 73 Cb 0.00 -1.57 -0.04 0.00 -1.01 0.00 0.00 64.21 61.59 3cf5 n SER 73 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3cf5 n ILE 74 N 3.65 1.63 -1.13 0.44 5.41 -1.20 -1.19 119.36 126.97 3cf5 n ILE 74 Ca 0.15 -5.09 -0.30 0.00 1.00 0.00 0.00 62.75 58.51 3cf5 n ILE 74 Cb 0.35 -1.17 0.13 0.00 -0.71 0.00 0.00 39.64 38.24 3cf5 n ILE 74 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 3cf5 s SER 75 N -2.82 3.62 0.02 4.38 0.01 -1.26 -4.76 113.70 112.88 3cf5 s SER 75 Ca 0.44 1.69 -0.03 0.00 1.31 0.00 0.00 55.95 59.35 3cf5 s SER 75 Cb 0.28 -2.34 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 3cf5 s SER 75 CO -0.10 -2.57 0.27 -3.20 0.41 0.00 0.00 173.24 168.05 3cf5 n ASN 76 N -3.86 -0.11 -3.67 2.44 5.15 -1.26 -3.96 115.26 109.99 3cf5 n ASN 76 Ca 0.08 0.30 0.00 0.00 -0.60 0.00 0.00 54.58 54.36 3cf5 n ASN 76 Cb 0.54 -0.08 0.00 0.00 -0.53 0.00 0.00 39.78 39.71 3cf5 n ASN 76 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3cf5 n PHE 77 N -3.24 -0.36 -2.13 1.20 3.01 -1.26 -4.79 117.46 109.89 3cf5 n PHE 77 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 3cf5 n PHE 77 Cb 0.03 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.47 3cf5 n PHE 77 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 3cf5 s LYS 78 N 0.00 3.29 0.14 -1.08 2.20 -1.26 -4.90 119.74 118.12 3cf5 s LYS 78 Ca 0.00 1.10 -0.20 0.00 -0.36 0.00 0.00 55.97 56.51 3cf5 s LYS 78 Cb 0.00 -4.17 0.05 0.00 -1.51 0.00 0.00 37.83 32.20 3cf5 s LYS 78 CO 0.00 -1.91 0.50 -0.51 -0.36 0.00 0.00 175.35 173.07 3cf5 s LEU 79 N 6.75 -0.07 0.00 5.43 1.02 -1.25 -4.88 118.68 125.68 3cf5 s LEU 79 Ca 0.71 -0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.71 3cf5 s LEU 79 Cb -0.18 2.21 0.00 0.00 0.02 0.00 0.00 46.19 48.24 3cf5 s LEU 79 CO 0.31 -0.90 0.00 -2.11 0.02 0.00 0.00 176.35 173.67 3cf5 n ARG 80 N -0.26 0.00 0.00 1.70 0.00 -0.33 -4.67 116.66 113.09 3cf5 n ARG 80 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 3cf5 n ARG 80 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.10 3cf5 n ARG 80 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 3cf5 n GLN 81 N 0.00 1.37 -2.08 2.89 7.27 -1.25 -2.71 117.38 122.86 3cf5 n GLN 81 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.70 3cf5 n GLN 81 Cb 0.00 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.62 3cf5 n GLN 81 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 3cf5 s GLY 82 N -0.79 0.25 -0.03 1.69 0.00 -1.25 -3.43 107.32 103.77 3cf5 s GLY 82 Ca 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 43.94 3cf5 s GLY 82 CO 0.00 3.37 -0.09 -0.29 0.00 0.00 0.00 173.10 176.09 3cf5 s MET 83 N 6.94 0.95 -0.50 2.90 1.75 -1.25 -4.77 119.30 125.32 3cf5 s MET 83 Ca 0.65 -0.29 -0.46 0.00 -1.25 0.00 0.00 55.69 54.34 3cf5 s MET 83 Cb -0.12 -0.89 -0.20 0.00 2.84 0.00 0.00 34.83 36.47 3cf5 s MET 83 CO 0.18 0.10 1.76 -2.30 -0.65 0.00 0.00 175.02 174.10 3cf5 n PRO 84 N 3.34 0.00 0.10 4.11 -0.02 -1.26 0.03 135.00 141.31 3cf5 n PRO 84 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 3cf5 n PRO 84 Cb 0.54 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 3cf5 n PRO 84 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3cf5 n VAL 85 N 4.74 0.42 -4.08 -1.45 0.24 -1.26 -4.71 118.33 112.23 3cf5 n VAL 85 Ca 0.38 0.14 -0.25 0.00 -2.04 0.00 0.00 64.34 62.57 3cf5 n VAL 85 Cb -0.05 -0.91 -0.02 0.00 -1.47 0.00 0.00 33.84 31.39 3cf5 n VAL 85 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3cf5 n GLY 86 N 2.23 3.02 2.83 7.63 0.00 -1.11 -2.81 105.19 116.98 3cf5 n GLY 86 Ca 0.00 -2.31 -0.15 0.00 0.00 0.00 0.00 46.02 43.56 3cf5 n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cf5 s ILE 87 N -2.49 -0.08 -0.07 -0.61 1.01 0.18 -0.43 121.20 118.72 3cf5 s ILE 87 Ca 0.20 0.24 0.02 0.00 0.00 0.00 0.00 60.65 61.11 3cf5 s ILE 87 Cb -0.02 -0.17 -0.03 0.00 0.01 0.00 0.00 42.46 42.26 3cf5 s ILE 87 CO 0.13 0.10 -0.11 -0.75 0.00 0.00 0.00 174.94 174.31 3cf5 s LYS 88 N 1.34 2.71 -0.30 2.79 2.20 0.49 0.48 119.74 129.45 3cf5 s LYS 88 Ca -0.07 -0.63 -0.01 0.00 -0.36 0.00 0.00 55.97 54.91 3cf5 s LYS 88 Cb -0.12 -2.50 0.13 0.00 -1.51 0.00 0.00 37.83 33.82 3cf5 s LYS 88 CO -0.04 0.60 0.26 0.08 -0.36 0.00 0.00 175.35 175.88 3cf5 s VAL 89 N -0.65 -0.29 0.19 4.02 1.01 -1.19 -0.27 120.40 123.22 3cf5 s VAL 89 Ca 0.10 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 3cf5 s VAL 89 Cb -0.11 -0.96 -0.08 0.00 0.00 0.00 0.00 36.38 35.23 3cf5 s VAL 89 CO 0.01 -0.56 0.62 -0.89 0.00 0.00 0.00 175.10 174.28 3cf5 s THR 90 N 2.16 4.75 -0.01 3.92 2.01 -1.26 -1.70 115.64 125.51 3cf5 s THR 90 Ca 0.10 0.98 0.03 0.00 0.31 0.00 0.00 61.69 63.11 3cf5 s THR 90 Cb -0.15 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.59 3cf5 s THR 90 CO -0.30 0.19 -0.11 -0.76 -0.69 0.00 0.00 174.62 172.95 3cf5 s LEU 91 N -2.07 2.02 -0.06 4.42 1.43 0.11 -4.97 118.68 119.55 3cf5 s LEU 91 Ca 0.41 -0.19 -0.13 0.00 -1.03 0.00 0.00 54.13 53.19 3cf5 s LEU 91 Cb -0.15 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.55 3cf5 s LEU 91 CO 0.20 0.13 0.32 0.00 0.23 0.00 0.00 176.35 177.22 3cf5 s ARG 92 N -0.25 0.55 4.54 1.70 1.70 -1.26 -0.25 118.95 125.67 3cf5 s ARG 92 Ca 0.04 0.08 0.00 0.00 -0.47 0.00 0.00 55.73 55.38 3cf5 s ARG 92 Cb -0.04 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.59 3cf5 s ARG 92 CO -0.00 -0.13 0.00 0.41 -1.08 0.00 0.00 175.30 174.50 3cf5 n GLY 93 N 1.95 0.71 0.00 3.88 0.00 -1.26 -3.72 105.19 106.75 3cf5 n GLY 93 Ca -0.18 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.41 3cf5 n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cf5 n GLU 94 N 0.00 0.00 -0.52 1.61 1.02 -1.26 -1.27 120.64 120.23 3cf5 n GLU 94 Ca 0.00 0.00 0.42 0.00 -0.02 0.00 0.00 57.16 57.56 3cf5 n GLU 94 Cb 0.00 -0.45 0.69 0.00 -0.02 0.00 0.00 31.44 31.65 3cf5 n GLU 94 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3cf5 n ARG 95 N -0.01 -0.02 0.12 3.49 1.74 -1.25 0.53 116.66 121.25 3cf5 n ARG 95 Ca 0.00 1.15 -0.05 0.00 -0.77 0.00 0.00 57.85 58.18 3cf5 n ARG 95 Cb 0.00 -2.36 -0.02 0.00 -1.02 0.00 0.00 32.46 29.05 3cf5 n ARG 95 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 3cf5 h MET 96 N 0.00 -0.30 -0.97 5.56 4.05 -1.64 -0.09 114.93 121.54 3cf5 h MET 96 Ca 0.86 0.02 0.10 0.00 -0.28 0.00 0.00 59.70 60.40 3cf5 h MET 96 Cb 2.97 0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 33.76 3cf5 h MET 96 CO -0.32 -0.20 0.62 1.88 0.23 0.00 0.00 176.91 179.12 3cf5 h TYR 97 N -0.31 1.09 -0.61 1.39 0.99 0.15 1.25 116.97 120.93 3cf5 h TYR 97 Ca -0.03 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.74 3cf5 h TYR 97 Cb 0.24 -0.35 -0.03 0.00 1.00 0.00 0.00 36.73 37.59 3cf5 h TYR 97 CO 0.10 0.48 0.40 0.28 -0.00 0.00 0.00 178.16 179.42 3cf5 h VAL 98 N 0.99 1.16 0.06 -2.88 2.07 0.04 0.30 116.25 117.98 3cf5 h VAL 98 Ca 0.46 -0.30 -0.16 0.00 0.82 0.00 0.00 66.70 67.51 3cf5 h VAL 98 Cb 0.41 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 3cf5 h VAL 98 CO -0.22 0.16 -0.84 0.15 0.02 0.00 0.00 177.57 176.84 3cf5 h PHE 99 N 0.82 0.22 -0.72 1.57 3.57 -0.68 -3.33 116.94 118.38 3cf5 h PHE 99 Ca 0.22 -0.16 0.07 0.00 3.53 0.00 0.00 57.97 61.63 3cf5 h PHE 99 Cb -0.08 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 38.56 3cf5 h PHE 99 CO -0.03 1.33 -0.43 -0.11 -2.23 0.00 0.00 178.31 176.84 3cf5 n LEU 100 N -4.29 -0.77 -0.31 0.59 7.94 0.43 0.67 117.00 121.26 3cf5 n LEU 100 Ca -0.20 1.54 0.15 0.00 -1.11 0.00 0.00 56.01 56.39 3cf5 n LEU 100 Cb 0.71 -0.29 0.32 0.00 0.53 0.00 0.00 43.42 44.68 3cf5 n LEU 100 CO 0.35 -1.18 0.94 -0.08 -1.11 0.00 0.00 177.39 176.31 3cf5 h GLU 101 N 0.00 0.17 -0.61 1.96 4.81 -0.56 0.19 114.58 120.54 3cf5 h GLU 101 Ca 0.12 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.45 3cf5 h GLU 101 Cb 0.30 -0.04 -0.12 0.00 0.63 0.00 0.00 28.75 29.52 3cf5 h GLU 101 CO -0.68 0.11 -0.31 0.87 -0.73 0.00 0.00 179.01 178.28 3cf5 h LYS 102 N 0.18 -0.13 0.06 1.92 1.57 0.12 0.54 116.57 120.83 3cf5 h LYS 102 Ca 0.59 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.38 3cf5 h LYS 102 Cb 1.22 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 3cf5 h LYS 102 CO -0.69 -0.09 -0.08 1.25 -0.57 0.00 0.00 179.45 179.26 3cf5 h LEU 103 N -0.14 -0.23 -1.38 2.94 5.85 -0.42 3.75 115.31 125.69 3cf5 h LEU 103 Ca 0.25 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 3cf5 h LEU 103 Cb 0.54 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3cf5 h LEU 103 CO -0.69 -0.13 0.06 0.40 -0.34 0.00 0.00 178.44 177.74 3cf5 h ILE 104 N -0.18 1.16 0.00 4.05 2.04 -0.89 -2.17 117.51 121.53 3cf5 h ILE 104 Ca 0.01 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.28 3cf5 h ILE 104 Cb 0.19 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 3cf5 h ILE 104 CO -0.05 0.21 -0.25 -1.13 0.00 0.00 0.00 178.15 176.94 3cf5 h ASN 105 N 0.47 0.00 0.00 1.72 -0.73 0.46 -3.43 115.58 114.06 3cf5 h ASN 105 Ca 0.11 0.00 -0.06 0.00 1.87 0.00 0.00 56.30 58.22 3cf5 h ASN 105 Cb 0.22 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.80 3cf5 h ASN 105 CO -0.00 0.49 -1.11 -0.38 -0.37 0.00 0.00 177.43 176.06 3cf5 n ILE 106 N -3.99 1.45 0.00 2.57 5.41 1.20 -4.50 119.36 121.50 3cf5 n ILE 106 Ca -0.03 0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.81 3cf5 n ILE 106 Cb 0.13 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 36.87 3cf5 n ILE 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3cf5 n GLY 107 N 1.67 0.00 0.36 7.39 0.00 0.10 0.89 105.19 115.60 3cf5 n GLY 107 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 3cf5 n GLY 107 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3cf5 h LEU 108 N 0.00 -0.93 -0.99 0.99 3.38 -1.68 -2.69 115.31 113.40 3cf5 h LEU 108 Ca 0.00 0.09 0.19 0.00 0.09 0.00 0.00 57.88 58.25 3cf5 h LEU 108 Cb 0.00 0.33 -0.18 0.00 0.09 0.00 0.00 40.66 40.89 3cf5 h LEU 108 CO 0.00 -0.45 -0.26 -0.65 0.09 0.00 0.00 178.44 177.16 3cf5 h PRO 109 N -0.65 -0.00 -3.03 1.13 0.11 -1.66 0.21 132.00 128.11 3cf5 h PRO 109 Ca -0.00 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.40 3cf5 h PRO 109 Cb 0.62 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.68 3cf5 h PRO 109 CO -0.11 -0.00 3.07 0.54 -0.21 0.00 0.00 178.00 181.29 3cf5 n ARG 110 N -5.61 3.92 -3.92 1.05 1.74 0.26 -4.86 116.66 109.24 3cf5 n ARG 110 Ca 0.15 -2.84 -0.28 0.00 -0.77 0.00 0.00 57.85 54.12 3cf5 n ARG 110 Cb 0.48 -2.81 -0.17 0.00 -1.02 0.00 0.00 32.46 28.95 3cf5 n ARG 110 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3cf5 s ILE 111 N 0.92 1.16 0.04 0.55 1.01 0.74 -4.70 121.20 120.91 3cf5 s ILE 111 Ca 0.58 -0.49 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 3cf5 s ILE 111 Cb 0.17 -1.22 -0.08 0.00 0.01 0.00 0.00 42.46 41.34 3cf5 s ILE 111 CO -0.07 0.29 1.71 -0.60 0.00 0.00 0.00 174.94 176.26 3cf5 s ARG 112 N 1.64 4.18 0.00 2.79 3.00 -1.26 -0.90 118.95 128.40 3cf5 s ARG 112 Ca 0.03 2.35 0.00 0.00 -1.00 0.00 0.00 55.73 57.11 3cf5 s ARG 112 Cb -0.14 -3.77 0.00 0.00 0.00 0.00 0.00 34.95 31.04 3cf5 s ARG 112 CO -0.08 -0.80 0.00 -0.25 0.00 0.00 0.00 175.30 174.17 3cf5 n ASP 113 N 6.25 0.00 -4.58 -2.12 8.00 -1.26 -5.01 116.55 117.83 3cf5 n ASP 113 Ca 0.17 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.31 3cf5 n ASP 113 Cb 0.41 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.60 3cf5 n ASP 113 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3cf5 n PHE 114 N -2.00 0.37 0.00 1.24 7.35 -0.08 -4.92 117.46 119.42 3cf5 n PHE 114 Ca 0.00 0.38 0.00 0.00 -0.76 0.00 0.00 57.45 57.07 3cf5 n PHE 114 Cb 0.00 -2.04 0.00 0.00 0.35 0.00 0.00 39.48 37.79 3cf5 n PHE 114 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3cf5 n ARG 115 N -1.70 2.33 -1.59 -4.13 1.74 -1.26 -5.03 116.66 107.02 3cf5 n ARG 115 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 3cf5 n ARG 115 Cb 0.50 -0.20 0.00 0.00 -1.02 0.00 0.00 32.46 31.73 3cf5 n ARG 115 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3cf5 n GLY 116 N -0.00 0.20 3.09 -0.13 0.00 -1.26 -4.38 105.19 102.71 3cf5 n GLY 116 Ca 0.00 -1.61 -0.18 0.00 0.00 0.00 0.00 46.02 44.22 3cf5 n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cf5 s ILE 117 N -2.65 0.88 0.37 -0.61 1.01 -0.79 -4.72 121.20 114.67 3cf5 s ILE 117 Ca 0.00 -0.81 -0.24 0.00 0.00 0.00 0.00 60.65 59.59 3cf5 s ILE 117 Cb 0.00 -0.80 -0.13 0.00 0.01 0.00 0.00 42.46 41.54 3cf5 s ILE 117 CO 0.00 -0.00 0.66 -3.20 0.00 0.00 0.00 174.94 172.40 3cf5 n ASN 118 N 2.13 -0.39 0.00 3.58 2.85 -1.26 -3.57 115.26 118.61 3cf5 n ASN 118 Ca -0.17 1.00 0.00 0.00 -0.11 0.00 0.00 54.58 55.29 3cf5 n ASN 118 Cb 0.55 -1.14 0.00 0.00 1.24 0.00 0.00 39.78 40.43 3cf5 n ASN 118 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3cf5 n PRO 119 N 0.65 0.00 0.00 1.20 -0.04 -1.26 -4.98 135.00 130.57 3cf5 n PRO 119 Ca 0.12 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 3cf5 n PRO 119 Cb 0.36 -0.72 0.00 0.00 -0.04 0.00 0.00 33.50 33.10 3cf5 n PRO 119 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3cf5 n ASN 120 N -1.58 0.00 -4.60 3.54 3.02 -1.26 -4.76 115.26 109.62 3cf5 n ASN 120 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 3cf5 n ASN 120 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3cf5 n ASN 120 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cf5 n ALA 121 N 0.00 -0.05 -2.69 5.41 0.00 -1.26 -5.03 120.51 116.90 3cf5 n ALA 121 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.77 3cf5 n ALA 121 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.41 3cf5 n ALA 121 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3cf5 n PHE 122 N -0.02 0.00 -1.05 0.00 3.01 -1.26 -4.90 117.46 113.23 3cf5 n PHE 122 Ca 0.09 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.38 3cf5 n PHE 122 Cb 0.35 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.66 3cf5 n PHE 122 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3cf5 n ASP 123 N 0.00 -0.85 0.00 4.37 8.00 -0.89 -4.47 116.55 122.71 3cf5 n ASP 123 Ca 0.00 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.19 3cf5 n ASP 123 Cb 0.00 -0.41 0.00 0.00 -0.02 0.00 0.00 41.12 40.69 3cf5 n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cf5 n GLY 124 N 3.96 -0.06 0.00 0.44 0.00 -1.26 0.59 105.19 108.87 3cf5 n GLY 124 Ca 0.47 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.59 3cf5 n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf5 n ARG 125 N -0.85 0.73 -0.79 1.61 5.12 -1.26 -4.49 116.66 116.72 3cf5 n ARG 125 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3cf5 n ARG 125 Cb 0.07 -1.40 0.00 0.00 -1.16 0.00 0.00 32.46 29.97 3cf5 n ARG 125 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3cf5 n GLY 126 N 0.41 0.62 3.80 -0.13 0.00 0.20 -4.43 105.19 105.65 3cf5 n GLY 126 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 3cf5 n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cf5 s ASN 127 N -2.06 5.79 0.21 1.61 0.01 -0.56 -4.28 114.94 115.66 3cf5 s ASN 127 Ca 0.00 0.21 0.07 0.00 -0.71 0.00 0.00 52.86 52.43 3cf5 s ASN 127 Cb 0.00 -1.71 -0.04 0.00 0.41 0.00 0.00 41.25 39.92 3cf5 s ASN 127 CO 0.00 0.30 0.11 -0.47 -1.51 0.00 0.00 177.10 175.53 3cf5 s TYR 128 N -1.15 3.01 0.02 2.20 5.04 -1.07 -2.09 117.35 123.31 3cf5 s TYR 128 Ca 0.21 -0.10 0.07 0.00 -2.44 0.00 0.00 57.07 54.81 3cf5 s TYR 128 Cb -0.12 -1.41 -0.02 0.00 0.35 0.00 0.00 41.96 40.76 3cf5 s TYR 128 CO 0.12 0.53 -0.20 -0.80 -1.34 0.00 0.00 175.55 173.86 3cf5 s ASN 129 N -3.38 2.37 -0.07 4.32 0.01 -1.26 -1.27 114.94 115.66 3cf5 s ASN 129 Ca 0.31 -0.45 0.01 0.00 -0.71 0.00 0.00 52.86 52.02 3cf5 s ASN 129 Cb -0.09 -0.22 0.02 0.00 0.41 0.00 0.00 41.25 41.37 3cf5 s ASN 129 CO 0.22 0.19 -0.07 -0.22 -1.51 0.00 0.00 177.10 175.71 3cf5 s LEU 130 N -0.86 1.31 -0.69 0.60 0.20 -0.13 -4.93 118.68 114.17 3cf5 s LEU 130 Ca 0.07 -0.23 -0.00 0.00 0.69 0.00 0.00 54.13 54.66 3cf5 s LEU 130 Cb -0.08 -0.69 0.17 0.00 -0.43 0.00 0.00 46.19 45.17 3cf5 s LEU 130 CO 0.01 -0.06 0.51 -0.83 -0.29 0.00 0.00 176.35 175.69 3cf5 s GLY 131 N 1.17 2.73 0.73 7.98 0.00 -1.26 -0.83 107.32 117.84 3cf5 s GLY 131 Ca -0.06 -3.53 -0.11 0.00 0.00 0.00 0.00 44.72 41.02 3cf5 s GLY 131 CO -0.02 1.11 1.08 -0.42 0.00 0.00 0.00 173.10 174.85 3cf5 s ILE 132 N -0.70 3.60 0.00 0.90 -1.09 -1.01 -5.00 121.20 117.90 3cf5 s ILE 132 Ca 0.21 0.52 0.00 0.00 -2.23 0.00 0.00 60.65 59.15 3cf5 s ILE 132 Cb -0.15 -3.38 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 3cf5 s ILE 132 CO -0.07 -0.68 0.00 0.29 -1.23 0.00 0.00 174.94 173.25 3cf5 n LYS 133 N -3.15 0.00 -1.16 2.79 5.02 -1.25 -3.84 118.16 116.57 3cf5 n LYS 133 Ca 0.07 0.00 -0.45 0.00 -2.02 0.00 0.00 58.31 55.91 3cf5 n LYS 133 Cb 0.56 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.51 3cf5 n LYS 133 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3cf5 n GLU 134 N 0.00 0.00 0.00 1.97 2.13 -1.25 -2.92 120.64 120.57 3cf5 n GLU 134 Ca 0.00 0.00 0.14 0.00 0.66 0.00 0.00 57.16 57.96 3cf5 n GLU 134 Cb 0.00 -1.12 0.57 0.00 0.27 0.00 0.00 31.44 31.16 3cf5 n GLU 134 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3cf5 n GLN 135 N 1.12 0.72 -2.62 5.31 6.02 0.16 -4.61 117.38 123.48 3cf5 n GLN 135 Ca 0.15 -0.28 -0.43 0.00 -0.01 0.00 0.00 57.00 56.43 3cf5 n GLN 135 Cb 0.08 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.84 3cf5 n GLN 135 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3cf5 n LEU 136 N -0.90 5.09 0.00 1.08 4.77 -1.26 -3.40 117.00 122.38 3cf5 n LEU 136 Ca 0.14 -4.04 0.00 0.00 -0.03 0.00 0.00 56.01 52.08 3cf5 n LEU 136 Cb 0.29 -1.72 0.00 0.00 -2.33 0.00 0.00 43.42 39.66 3cf5 n LEU 136 CO 0.24 0.32 0.00 2.30 -1.33 0.00 0.00 177.39 178.92 3cf5 n ILE 137 N 5.96 0.00 -4.42 -0.08 -5.35 -1.26 -4.83 119.36 109.38 3cf5 n ILE 137 Ca 0.47 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.60 3cf5 n ILE 137 Cb 0.45 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.25 3cf5 n ILE 137 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3cf5 s PHE 138 N 0.00 3.11 -1.77 4.28 0.40 -1.22 -4.53 117.98 118.25 3cf5 s PHE 138 Ca 0.00 0.16 0.10 0.00 -0.60 0.00 0.00 56.93 56.59 3cf5 s PHE 138 Cb 0.00 -1.77 0.57 0.00 0.51 0.00 0.00 43.02 42.33 3cf5 s PHE 138 CO 0.00 0.44 1.11 -0.35 0.70 0.00 0.00 175.22 177.13 3cf5 n PRO 139 N 2.13 0.25 -0.01 0.24 -0.04 -1.26 -2.82 135.00 133.49 3cf5 n PRO 139 Ca -0.18 0.08 -0.02 0.00 -0.04 0.00 0.00 63.50 63.33 3cf5 n PRO 139 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 3cf5 n PRO 139 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3cf5 n GLU 140 N -1.11 0.04 -1.20 0.54 -0.58 -1.26 -5.04 120.64 112.02 3cf5 n GLU 140 Ca 0.07 0.02 -0.55 0.00 -0.42 0.00 0.00 57.16 56.27 3cf5 n GLU 140 Cb 0.05 -0.59 -0.10 0.00 -0.57 0.00 0.00 31.44 30.23 3cf5 n GLU 140 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 3cf5 n ILE 141 N -3.06 0.00 -4.03 -3.67 2.08 -1.13 -4.93 119.36 104.63 3cf5 n ILE 141 Ca -0.04 0.00 -0.32 0.00 0.56 0.00 0.00 62.75 62.96 3cf5 n ILE 141 Cb 0.53 -0.44 -0.15 0.00 -0.75 0.00 0.00 39.64 38.82 3cf5 n ILE 141 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 3cf5 s THR 142 N 4.76 2.28 -0.56 1.39 2.01 -1.26 -4.73 115.64 119.52 3cf5 s THR 142 Ca 1.04 -1.98 0.25 0.00 0.31 0.00 0.00 61.69 61.31 3cf5 s THR 142 Cb -1.33 -2.52 0.28 0.00 0.01 0.00 0.00 72.50 68.95 3cf5 s THR 142 CO 0.62 -0.32 1.75 0.22 -0.69 0.00 0.00 174.62 176.20 3cf5 h TYR 143 N 7.71 0.00 -0.79 4.92 3.20 -1.97 -0.96 116.97 129.08 3cf5 h TYR 143 Ca -0.12 0.00 -0.46 0.00 3.14 0.00 0.00 58.73 61.29 3cf5 h TYR 143 Cb 1.03 0.00 -0.24 0.00 1.54 0.00 0.00 36.73 39.06 3cf5 h TYR 143 CO 0.55 0.00 0.59 -0.25 -1.64 0.00 0.00 178.16 177.41 3cf5 n ASP 144 N -2.37 5.04 0.00 -2.11 8.00 -1.26 -3.70 116.55 120.16 3cf5 n ASP 144 Ca 0.04 -3.36 0.00 0.00 0.71 0.00 0.00 54.79 52.18 3cf5 n ASP 144 Cb 0.35 -0.87 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 3cf5 n ASP 144 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3cf5 n MET 145 N -0.64 0.00 0.00 -1.24 2.81 -1.03 -5.16 117.12 111.86 3cf5 n MET 145 Ca 0.48 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.37 3cf5 n MET 145 Cb 1.11 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.62 3cf5 n MET 145 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3cf5 n VAL 146 N 0.00 0.00 0.03 2.03 0.24 -0.39 -4.99 118.33 115.25 3cf5 n VAL 146 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3cf5 n VAL 146 Cb 0.08 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 3cf5 n VAL 146 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3cf5 n ASP 147 N 0.00 0.19 0.00 -1.34 9.92 -1.26 -5.07 116.55 118.99 3cf5 n ASP 147 Ca 0.00 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 3cf5 n ASP 147 Cb 0.00 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 3cf5 n ASP 147 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 3cf5 n LYS 148 N -2.81 0.00 0.00 -1.24 2.85 -1.26 -5.17 118.16 110.53 3cf5 n LYS 148 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3cf5 n LYS 148 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3cf5 n LYS 148 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 3cf5 n THR 149 N -0.84 0.00 -0.64 0.58 -1.04 -1.26 -5.07 114.28 106.01 3cf5 n THR 149 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3cf5 n THR 149 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3cf5 n THR 149 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3cf5 n ARG 150 N 0.00 0.41 0.00 -2.82 0.63 -1.26 -5.00 116.66 108.61 3cf5 n ARG 150 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3cf5 n ARG 150 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 3cf5 n ARG 150 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3cf5 n GLY 151 N 0.62 4.56 0.00 5.14 0.00 -1.24 0.36 105.19 114.61 3cf5 n GLY 151 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 3cf5 n GLY 151 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3cf5 n MET 152 N 0.00 0.00 -5.01 1.61 0.00 -1.15 -4.75 117.12 107.82 3cf5 n MET 152 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.43 3cf5 n MET 152 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 33.22 33.06 3cf5 n MET 152 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 3cf5 s ASP 153 N 0.00 2.42 -0.02 3.17 -1.08 -1.10 -2.40 116.67 117.65 3cf5 s ASP 153 Ca 0.00 -0.37 0.07 0.00 -0.52 0.00 0.00 52.55 51.72 3cf5 s ASP 153 Cb 0.00 -0.27 -0.02 0.00 -1.46 0.00 0.00 42.92 41.18 3cf5 s ASP 153 CO 0.00 0.25 -0.23 -0.63 0.52 0.00 0.00 175.17 175.08 3cf5 s ILE 154 N -0.49 1.82 -0.16 4.11 1.09 -0.01 -0.73 121.20 126.83 3cf5 s ILE 154 Ca 0.08 -0.98 -0.05 0.00 -1.10 0.00 0.00 60.65 58.60 3cf5 s ILE 154 Cb -0.08 -1.52 -0.03 0.00 -1.06 0.00 0.00 42.46 39.77 3cf5 s ILE 154 CO -0.01 0.52 -0.01 -0.89 -0.10 0.00 0.00 174.94 174.45 3cf5 s THR 155 N -0.47 4.13 -0.34 2.92 2.01 -1.14 -0.96 115.64 121.79 3cf5 s THR 155 Ca 0.07 -0.27 -0.12 0.00 0.31 0.00 0.00 61.69 61.68 3cf5 s THR 155 Cb -0.10 -2.83 -0.01 0.00 0.01 0.00 0.00 72.50 69.58 3cf5 s THR 155 CO -0.00 0.48 0.21 -0.63 -0.69 0.00 0.00 174.62 173.99 3cf5 s ILE 156 N 0.40 5.03 -0.27 1.82 1.01 -0.40 -2.34 121.20 126.45 3cf5 s ILE 156 Ca -0.02 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3cf5 s ILE 156 Cb -0.14 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.72 3cf5 s ILE 156 CO 0.02 -0.01 0.07 -0.69 0.00 0.00 0.00 174.94 174.34 3cf5 s VAL 157 N 1.68 4.16 -0.01 2.92 1.01 0.08 -2.60 120.40 127.64 3cf5 s VAL 157 Ca 0.05 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.67 3cf5 s VAL 157 Cb -0.17 -3.02 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 3cf5 s VAL 157 CO 0.09 0.24 -0.07 0.42 0.00 0.00 0.00 175.10 175.78 3cf5 s THR 158 N 1.57 0.57 0.57 3.92 -4.23 -1.26 0.19 115.64 116.97 3cf5 s THR 158 Ca 0.05 -0.30 0.36 0.00 -1.18 0.00 0.00 61.69 60.62 3cf5 s THR 158 Cb -0.16 -0.49 0.36 0.00 1.34 0.00 0.00 72.50 73.55 3cf5 s THR 158 CO 0.03 0.17 2.10 0.71 -0.54 0.00 0.00 174.62 177.08 3cf5 h THR 159 N 5.06 0.00 -0.69 3.99 1.35 -1.69 -3.41 112.91 117.51 3cf5 h THR 159 Ca -0.30 0.00 -0.60 0.00 -0.55 0.00 0.00 66.41 64.96 3cf5 h THR 159 Cb 1.18 0.80 0.01 0.00 -1.73 0.00 0.00 68.15 68.41 3cf5 h THR 159 CO 0.50 0.00 0.42 0.00 -0.25 0.00 0.00 175.52 176.18 3cf5 n ALA 160 N -1.96 -1.17 0.06 6.62 0.00 -1.26 -4.81 120.51 117.99 3cf5 n ALA 160 Ca -0.02 0.35 -0.21 0.00 0.00 0.00 0.00 53.44 53.56 3cf5 n ALA 160 Cb 0.20 -1.31 -0.12 0.00 0.00 0.00 0.00 19.45 18.22 3cf5 n ALA 160 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3cf5 h LYS 161 N 3.26 0.61 -6.06 0.00 3.64 -1.85 -3.34 116.57 112.82 3cf5 h LYS 161 Ca -0.31 -0.75 -0.59 0.00 -1.27 0.00 0.00 60.65 57.73 3cf5 h LYS 161 Cb 0.95 0.23 -0.12 0.00 -0.41 0.00 0.00 32.23 32.88 3cf5 h LYS 161 CO 0.64 1.33 -0.67 0.95 -2.27 0.00 0.00 179.45 179.43 3cf5 s THR 162 N -3.10 2.61 0.18 1.00 -4.23 -1.26 -4.05 115.64 106.79 3cf5 s THR 162 Ca -0.10 -2.11 0.01 0.00 -1.18 0.00 0.00 61.69 58.30 3cf5 s THR 162 Cb 0.05 -2.66 -0.11 0.00 1.34 0.00 0.00 72.50 71.12 3cf5 s THR 162 CO 0.91 -0.27 1.43 0.44 -0.54 0.00 0.00 174.62 176.60 3cf5 h ASP 163 N 1.97 0.36 0.00 3.99 3.32 -1.84 -1.20 116.42 123.02 3cf5 h ASP 163 Ca -0.42 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.38 3cf5 h ASP 163 Cb 1.25 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.69 3cf5 h ASP 163 CO 0.65 1.00 0.00 1.21 -1.72 0.00 0.00 179.24 180.38 3cf5 n GLU 164 N -3.78 0.00 -0.35 3.56 2.13 -1.26 -0.81 120.64 120.14 3cf5 n GLU 164 Ca -0.04 0.47 0.37 0.00 0.66 0.00 0.00 57.16 58.61 3cf5 n GLU 164 Cb 0.73 -1.26 0.69 0.00 0.27 0.00 0.00 31.44 31.88 3cf5 n GLU 164 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3cf5 h GLU 165 N 0.00 0.00 0.00 5.31 5.08 -1.97 -2.14 114.58 120.86 3cf5 h GLU 165 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3cf5 h GLU 165 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3cf5 h GLU 165 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 3cf5 n ALA 166 N -2.62 -0.22 -0.03 3.43 0.00 0.01 -3.25 120.51 117.82 3cf5 n ALA 166 Ca 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.71 3cf5 n ALA 166 Cb 1.45 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.90 3cf5 n ALA 166 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3cf5 n ARG 167 N -1.27 -0.03 0.00 0.00 0.63 -0.02 -0.78 116.66 115.19 3cf5 n ARG 167 Ca 0.00 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.37 3cf5 n ARG 167 Cb 0.00 -0.65 0.00 0.00 0.45 0.00 0.00 32.46 32.26 3cf5 n ARG 167 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3cf5 n ALA 168 N -2.63 0.00 -0.20 5.13 0.00 -1.23 0.12 120.51 121.69 3cf5 n ALA 168 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3cf5 n ALA 168 Cb 0.02 0.28 -0.05 0.00 0.00 0.00 0.00 19.45 19.70 3cf5 n ALA 168 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3cf5 n LEU 169 N -1.36 -0.51 -0.22 0.00 7.94 -0.39 0.14 117.00 122.60 3cf5 n LEU 169 Ca 0.00 0.97 -0.05 0.00 -1.11 0.00 0.00 56.01 55.82 3cf5 n LEU 169 Cb 0.00 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 43.78 3cf5 n LEU 169 CO 0.00 -0.75 0.61 -0.07 -1.11 0.00 0.00 177.39 176.07 3cf5 h LEU 170 N 0.00 -1.25 0.14 -1.96 3.38 0.13 -0.74 115.31 115.01 3cf5 h LEU 170 Ca 0.08 0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 3cf5 h LEU 170 Cb 0.20 0.61 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3cf5 h LEU 170 CO -0.45 -0.31 -0.07 -0.61 0.09 0.00 0.00 178.44 177.09 3cf5 h GLN 171 N -0.16 -0.18 -0.40 1.13 4.15 0.90 -3.03 115.11 117.52 3cf5 h GLN 171 Ca 0.23 0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.75 3cf5 h GLN 171 Cb 0.56 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.21 3cf5 h GLN 171 CO -0.71 0.26 -0.08 0.66 -1.93 0.00 0.00 178.83 177.02 3cf5 h SER 172 N -0.71 -0.34 0.00 -0.69 4.64 -0.66 0.64 113.55 116.43 3cf5 h SER 172 Ca -0.02 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3cf5 h SER 172 Cb 0.52 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3cf5 h SER 172 CO 0.03 -0.12 0.13 0.80 -0.87 0.00 0.00 176.83 176.80 3cf5 n MET 173 N -5.29 0.10 0.00 4.77 0.00 -0.29 -4.76 117.12 111.66 3cf5 n MET 173 Ca 0.02 0.59 0.00 0.00 -0.00 0.00 0.00 57.70 58.31 3cf5 n MET 173 Cb 0.22 -1.98 0.00 0.00 0.00 0.00 0.00 33.22 31.46 3cf5 n MET 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3cf5 n GLY 174 N -1.30 2.51 3.65 -5.12 0.00 0.22 -5.06 105.19 100.10 3cf5 n GLY 174 Ca -0.01 -0.82 0.02 0.00 0.00 0.00 0.00 46.02 45.21 3cf5 n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3cf5 s LEU 175 N 0.00 -0.04 -0.10 0.99 2.96 -1.02 -4.67 118.68 116.80 3cf5 s LEU 175 Ca 0.00 0.06 -0.13 0.00 -0.22 0.00 0.00 54.13 53.84 3cf5 s LEU 175 Cb 0.00 1.06 -0.05 0.00 0.50 0.00 0.00 46.19 47.70 3cf5 s LEU 175 CO 0.00 -0.01 0.32 -2.16 -1.32 0.00 0.00 176.35 173.18 3cf5 s PRO 176 N 0.85 4.02 -0.18 0.98 0.04 -1.26 -4.75 135.00 134.71 3cf5 s PRO 176 Ca -0.05 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.18 3cf5 s PRO 176 Cb -0.03 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.20 3cf5 s PRO 176 CO -0.11 0.47 -0.17 -0.06 0.04 0.00 0.00 177.00 177.17 3cf5 s PHE 177 N -0.27 2.79 -1.00 0.56 0.40 -1.26 -1.89 117.98 117.31 3cf5 s PHE 177 Ca 0.19 -1.41 -0.24 0.00 -0.60 0.00 0.00 56.93 54.88 3cf5 s PHE 177 Cb -0.14 -1.93 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 3cf5 s PHE 177 CO 0.08 -0.70 1.87 1.03 0.70 0.00 0.00 175.22 178.20 3cf5 s ARG 178 N 1.19 2.73 0.00 0.44 0.52 -1.23 -4.79 118.95 117.81 3cf5 s ARG 178 Ca 0.02 -0.68 0.30 0.00 -0.52 0.00 0.00 55.73 54.85 3cf5 s ARG 178 Cb -0.14 -5.17 1.49 0.00 0.52 0.00 0.00 34.95 31.65 3cf5 s ARG 178 CO -0.08 -3.33 1.99 1.63 0.02 0.00 0.00 175.30 175.53