#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fd7 n PRO 2 N 0.00 0.05 -0.00 0.00 -0.02 -1.26 -4.96 135.00 128.81 1fd7 n PRO 2 Ca 0.00 0.09 0.03 0.00 -2.02 0.00 0.00 63.50 61.61 1fd7 n PRO 2 Cb 0.00 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.06 1fd7 n PRO 2 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1fd7 n GLN 3 N -3.27 4.28 -4.21 -0.52 6.02 -1.26 -4.97 117.38 113.44 1fd7 n GLN 3 Ca 0.13 -0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.99 1fd7 n GLN 3 Cb 0.51 -0.87 -0.10 0.00 1.02 0.00 0.00 30.24 30.80 1fd7 n GLN 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1fd7 s THR 4 N -1.75 0.32 0.27 5.09 -4.23 -1.26 -5.04 115.64 109.04 1fd7 s THR 4 Ca 0.02 -1.96 0.17 0.00 -1.18 0.00 0.00 61.69 58.74 1fd7 s THR 4 Cb 0.06 -2.23 0.12 0.00 1.34 0.00 0.00 72.50 71.78 1fd7 s THR 4 CO 0.30 -0.32 1.78 -0.29 -0.54 0.00 0.00 174.62 175.55 1fd7 h ILE 5 N 2.70 1.03 -0.13 2.99 2.10 -1.97 -2.13 117.51 122.10 1fd7 h ILE 5 Ca -0.36 -1.43 -0.22 0.00 1.08 0.00 0.00 64.86 63.93 1fd7 h ILE 5 Cb 1.22 1.83 0.01 0.00 -1.09 0.00 0.00 36.82 38.79 1fd7 h ILE 5 CO 0.59 0.37 -0.77 0.74 -1.08 0.00 0.00 178.15 178.01 1fd7 h THR 6 N 0.00 1.29 -0.52 2.19 2.02 -1.98 0.15 112.91 116.07 1fd7 h THR 6 Ca -0.00 -1.98 -0.04 0.00 0.77 0.00 0.00 66.41 65.16 1fd7 h THR 6 Cb 0.80 2.06 -0.02 0.00 -1.74 0.00 0.00 68.15 69.24 1fd7 h THR 6 CO 0.05 0.62 0.17 -0.33 0.37 0.00 0.00 175.52 176.40 1fd7 h GLU 7 N 0.46 0.80 -0.35 6.66 5.08 -1.92 -0.93 114.58 124.39 1fd7 h GLU 7 Ca -0.06 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 1fd7 h GLU 7 Cb 1.40 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1fd7 h GLU 7 CO 0.16 0.73 0.04 1.25 -1.00 0.00 0.00 179.01 180.19 1fd7 h LEU 8 N 0.70 0.57 -1.34 1.33 6.46 -1.33 -2.98 115.31 118.73 1fd7 h LEU 8 Ca 0.17 -0.28 -0.05 0.00 -0.12 0.00 0.00 57.88 57.60 1fd7 h LEU 8 Cb 0.26 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 1fd7 h LEU 8 CO -0.01 0.71 -0.08 0.00 -0.62 0.00 0.00 178.44 178.44 1fd7 n SER 10 N -4.28 0.17 0.00 0.00 3.41 -0.38 -2.38 113.62 110.16 1fd7 n SER 10 Ca 0.00 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 1fd7 n SER 10 Cb 0.26 -0.58 0.64 0.00 -0.26 0.00 0.00 64.21 64.27 1fd7 n SER 10 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1fd7 n GLU 11 N -1.68 0.18 -4.78 4.33 1.02 -0.73 -4.83 120.64 114.14 1fd7 n GLU 11 Ca 0.04 0.03 -0.31 0.00 -0.02 0.00 0.00 57.16 56.89 1fd7 n GLU 11 Cb 0.21 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.00 1fd7 n GLU 11 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1fd7 s TYR 12 N -2.81 2.56 0.69 -0.32 1.51 -1.00 -5.13 117.35 112.85 1fd7 s TYR 12 Ca 0.19 -0.26 -0.11 0.00 -1.01 0.00 0.00 57.07 55.88 1fd7 s TYR 12 Cb 0.18 -1.50 0.01 0.00 -0.11 0.00 0.00 41.96 40.54 1fd7 s TYR 12 CO 0.46 0.21 1.06 0.50 -1.11 0.00 0.00 175.55 176.67 1fd7 s ARG 13 N -1.20 2.88 -1.43 -0.62 3.52 -1.26 -3.92 118.95 116.92 1fd7 s ARG 13 Ca 0.13 1.02 -0.11 0.00 -0.13 0.00 0.00 55.73 56.65 1fd7 s ARG 13 Cb -0.10 -1.98 0.04 0.00 -1.56 0.00 0.00 34.95 31.34 1fd7 s ARG 13 CO 0.04 -1.15 1.08 0.09 -0.81 0.00 0.00 175.30 174.55 1fd7 n ASN 14 N -3.05 -5.82 -4.48 -2.12 4.13 -1.26 -4.95 115.26 97.71 1fd7 n ASN 14 Ca 0.08 -0.61 -0.23 0.00 1.68 0.00 0.00 54.58 55.50 1fd7 n ASN 14 Cb 0.53 -4.60 -0.11 0.00 -1.54 0.00 0.00 39.78 34.06 1fd7 n ASN 14 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1fd7 s THR 15 N -3.30 1.73 0.16 3.41 -4.23 -1.25 -0.75 115.64 111.41 1fd7 s THR 15 Ca 0.60 -2.10 -0.23 0.00 -1.18 0.00 0.00 61.69 58.78 1fd7 s THR 15 Cb -0.28 -2.62 0.07 0.00 1.34 0.00 0.00 72.50 71.00 1fd7 s THR 15 CO 0.75 -0.19 0.65 0.00 -0.54 0.00 0.00 174.62 175.29 1fd7 s GLN 16 N -3.73 1.31 -0.11 3.99 -2.07 -0.84 -4.90 119.66 113.30 1fd7 s GLN 16 Ca 0.32 -0.53 -0.02 0.00 -1.82 0.00 0.00 55.36 53.31 1fd7 s GLN 16 Cb 0.05 0.57 -0.03 0.00 -1.09 0.00 0.00 33.01 32.51 1fd7 s GLN 16 CO 0.14 -0.58 -0.03 0.42 -1.32 0.00 0.00 175.29 173.93 1fd7 s ILE 17 N -3.71 4.05 -0.21 3.63 -1.09 -1.26 -1.52 121.20 121.09 1fd7 s ILE 17 Ca 0.03 -0.33 -0.06 0.00 -2.23 0.00 0.00 60.65 58.06 1fd7 s ILE 17 Cb -0.02 -2.72 -0.03 0.00 -1.58 0.00 0.00 42.46 38.11 1fd7 s ILE 17 CO -0.10 0.56 0.02 -0.31 -1.23 0.00 0.00 174.94 173.89 1fd7 s TYR 18 N -0.40 3.07 -0.46 3.97 1.51 -0.20 -4.96 117.35 119.87 1fd7 s TYR 18 Ca 0.07 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.47 1fd7 s TYR 18 Cb -0.12 -2.12 0.03 0.00 -0.11 0.00 0.00 41.96 39.64 1fd7 s TYR 18 CO 0.02 -0.23 0.91 0.99 -1.11 0.00 0.00 175.55 176.13 1fd7 s THR 19 N 1.09 4.49 -0.17 -0.71 2.01 -1.26 -1.09 115.64 120.00 1fd7 s THR 19 Ca 0.03 0.69 -0.20 0.00 0.31 0.00 0.00 61.69 62.51 1fd7 s THR 19 Cb -0.14 -4.42 -0.17 0.00 0.01 0.00 0.00 72.50 67.77 1fd7 s THR 19 CO 0.02 -0.83 0.31 0.40 -0.69 0.00 0.00 174.62 173.83 1fd7 h ILE 20 N 6.07 0.98 -6.53 1.82 1.08 -0.08 -3.49 117.51 117.36 1fd7 h ILE 20 Ca -0.24 -1.97 -0.51 0.00 -0.39 0.00 0.00 64.86 61.75 1fd7 h ILE 20 Cb 1.08 2.09 -0.10 0.00 -3.07 0.00 0.00 36.82 36.82 1fd7 h ILE 20 CO 1.02 0.33 -0.85 -3.20 -0.69 0.00 0.00 178.15 174.77 1fd7 n ASN 21 N -4.54 -1.99 -3.56 1.72 4.05 0.41 -4.92 115.26 106.42 1fd7 n ASN 21 Ca -0.19 -0.97 -0.10 0.00 0.45 0.00 0.00 54.58 53.77 1fd7 n ASN 21 Cb 0.50 -3.12 -0.02 0.00 1.23 0.00 0.00 39.78 38.37 1fd7 n ASN 21 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1fd7 s ASP 22 N -3.86 -0.44 0.64 1.20 2.15 -0.81 -4.90 116.67 110.65 1fd7 s ASP 22 Ca 0.34 -0.18 -0.11 0.00 0.43 0.00 0.00 52.55 53.04 1fd7 s ASP 22 Cb -0.18 0.60 -0.03 0.00 -0.30 0.00 0.00 42.92 43.00 1fd7 s ASP 22 CO 0.89 -1.01 1.04 -1.59 -0.17 0.00 0.00 175.17 174.33 1fd7 s LYS 23 N -3.68 3.46 0.23 4.34 -2.85 -1.26 -0.52 119.74 119.47 1fd7 s LYS 23 Ca 0.05 0.70 -0.30 0.00 -1.00 0.00 0.00 55.97 55.42 1fd7 s LYS 23 Cb -0.02 -2.07 -0.09 0.00 -2.06 0.00 0.00 37.83 33.58 1fd7 s LYS 23 CO -0.07 -0.66 1.37 0.42 0.10 0.00 0.00 175.35 176.51 1fd7 s ILE 24 N -3.21 2.93 -0.11 3.79 1.01 -1.26 -4.76 121.20 119.60 1fd7 s ILE 24 Ca 0.56 0.78 -0.18 0.00 0.00 0.00 0.00 60.65 61.80 1fd7 s ILE 24 Cb -0.11 -3.50 -0.27 0.00 0.01 0.00 0.00 42.46 38.59 1fd7 s ILE 24 CO 0.54 0.13 0.61 0.25 0.00 0.00 0.00 174.94 176.46 1fd7 h LEU 25 N 5.08 0.33 -7.89 2.97 5.85 -1.51 -3.48 115.31 116.66 1fd7 h LEU 25 Ca -0.46 -0.85 -0.19 0.00 0.84 0.00 0.00 57.88 57.22 1fd7 h LEU 25 Cb 1.22 -0.11 -0.23 0.00 0.37 0.00 0.00 40.66 41.90 1fd7 h LEU 25 CO 0.77 1.52 -0.70 -0.94 -0.34 0.00 0.00 178.44 178.74 1fd7 s SER 26 N -6.94 0.15 -0.08 1.25 1.04 -1.18 -4.97 113.70 102.98 1fd7 s SER 26 Ca -0.19 -0.33 0.02 0.00 0.48 0.00 0.00 55.95 55.93 1fd7 s SER 26 Cb 0.03 0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.23 1fd7 s SER 26 CO 0.76 -0.20 -0.14 -0.47 0.98 0.00 0.00 173.24 174.17 1fd7 s TYR 27 N -0.97 1.65 -0.07 5.02 6.14 -1.26 -1.67 117.35 126.19 1fd7 s TYR 27 Ca -0.11 -0.65 0.02 0.00 0.64 0.00 0.00 57.07 56.98 1fd7 s TYR 27 Cb -0.07 -1.19 0.01 0.00 0.42 0.00 0.00 41.96 41.13 1fd7 s TYR 27 CO -0.01 -0.32 -0.13 0.99 0.64 0.00 0.00 175.55 176.72 1fd7 s THR 28 N 0.69 1.23 -0.04 4.34 2.01 0.20 -5.01 115.64 119.06 1fd7 s THR 28 Ca -0.14 -0.53 0.02 0.00 0.31 0.00 0.00 61.69 61.35 1fd7 s THR 28 Cb -0.16 -1.11 0.01 0.00 0.01 0.00 0.00 72.50 71.25 1fd7 s THR 28 CO 0.03 0.38 -0.07 -0.70 -0.69 0.00 0.00 174.62 173.57 1fd7 s GLU 29 N 0.63 1.04 -0.02 4.92 2.12 -1.26 -0.86 118.70 125.26 1fd7 s GLU 29 Ca -0.15 -0.23 0.06 0.00 0.36 0.00 0.00 54.97 55.01 1fd7 s GLU 29 Cb -0.16 -0.96 -0.01 0.00 0.26 0.00 0.00 34.13 33.25 1fd7 s GLU 29 CO 0.04 -0.00 -0.20 0.45 -0.54 0.00 0.00 175.26 175.01 1fd7 s SER 30 N 0.64 2.38 -0.08 -1.70 0.15 -0.31 -4.98 113.70 109.79 1fd7 s SER 30 Ca -0.10 -0.37 0.14 0.00 0.70 0.00 0.00 55.95 56.32 1fd7 s SER 30 Cb -0.13 -0.38 0.44 0.00 -1.71 0.00 0.00 66.02 64.24 1fd7 s SER 30 CO 0.01 0.23 1.36 1.15 1.20 0.00 0.00 173.24 177.19 1fd7 n MET 31 N 2.73 3.00 -2.44 5.44 0.00 -1.26 -2.81 117.12 121.77 1fd7 n MET 31 Ca -0.16 -2.46 -0.41 0.00 0.00 0.00 0.00 57.70 54.67 1fd7 n MET 31 Cb 0.53 -1.57 -0.04 0.00 0.00 0.00 0.00 33.22 32.14 1fd7 n MET 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1fd7 s ALA 32 N -1.83 3.41 0.03 3.17 0.00 -1.26 -4.87 121.76 120.42 1fd7 s ALA 32 Ca 0.34 0.91 -0.36 0.00 0.00 0.00 0.00 51.96 52.85 1fd7 s ALA 32 Cb 0.23 -3.36 -0.15 0.00 0.00 0.00 0.00 23.12 19.84 1fd7 s ALA 32 CO 0.14 -0.25 1.55 0.41 0.00 0.00 0.00 175.76 177.61 1fd7 n GLY 33 N 1.65 0.87 3.08 0.00 0.00 -1.26 -0.97 105.19 108.56 1fd7 n GLY 33 Ca 0.01 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.78 1fd7 n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fd7 n LYS 34 N 3.80 -0.08 -2.50 1.61 4.76 -1.26 -4.82 118.16 119.66 1fd7 n LYS 34 Ca 0.20 0.02 -0.10 0.00 -2.87 0.00 0.00 58.31 55.56 1fd7 n LYS 34 Cb 0.23 -3.09 0.04 0.00 -1.84 0.00 0.00 35.03 30.37 1fd7 n LYS 34 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1fd7 n ARG 35 N -2.00 2.50 -2.63 1.97 5.12 -0.15 -4.97 116.66 116.50 1fd7 n ARG 35 Ca 0.00 -3.78 -0.42 0.00 -1.93 0.00 0.00 57.85 51.72 1fd7 n ARG 35 Cb 0.02 -1.88 -0.03 0.00 -1.16 0.00 0.00 32.46 29.41 1fd7 n ARG 35 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1fd7 s GLU 36 N -3.71 3.53 0.27 5.56 8.01 -1.18 -4.23 118.70 126.94 1fd7 s GLU 36 Ca 0.37 -1.12 -0.15 0.00 0.01 0.00 0.00 54.97 54.08 1fd7 s GLU 36 Cb 0.36 -5.10 0.01 0.00 -4.31 0.00 0.00 34.13 25.08 1fd7 s GLU 36 CO -0.01 -2.11 0.56 0.00 0.01 0.00 0.00 175.26 173.72 1fd7 s MET 37 N 4.63 1.66 -0.02 1.61 0.23 -1.12 -4.23 119.30 122.06 1fd7 s MET 37 Ca 0.41 -1.20 0.05 0.00 -1.03 0.00 0.00 55.69 53.93 1fd7 s MET 37 Cb -0.02 0.52 -0.01 0.00 -1.53 0.00 0.00 34.83 33.78 1fd7 s MET 37 CO -0.06 -0.72 -0.18 0.08 -2.03 0.00 0.00 175.02 172.10 1fd7 s VAL 38 N -3.88 1.48 -0.05 5.16 1.01 -1.23 -1.16 120.40 121.73 1fd7 s VAL 38 Ca 0.19 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1fd7 s VAL 38 Cb -0.02 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.12 1fd7 s VAL 38 CO 0.09 0.42 -0.14 -0.63 0.00 0.00 0.00 175.10 174.84 1fd7 s ILE 39 N -0.30 1.24 0.12 2.22 1.01 -0.04 -1.30 121.20 124.15 1fd7 s ILE 39 Ca 0.04 -0.58 0.07 0.00 0.00 0.00 0.00 60.65 60.18 1fd7 s ILE 39 Cb -0.09 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 1fd7 s ILE 39 CO 0.00 0.37 -0.18 0.27 0.00 0.00 0.00 174.94 175.41 1fd7 s ILE 40 N 0.35 1.56 0.15 2.92 -4.36 -0.10 -0.62 121.20 121.10 1fd7 s ILE 40 Ca -0.09 -1.65 0.03 0.00 -0.26 0.00 0.00 60.65 58.68 1fd7 s ILE 40 Cb -0.13 -1.55 -0.04 0.00 1.25 0.00 0.00 42.46 41.98 1fd7 s ILE 40 CO 0.03 -0.23 -0.06 0.42 0.24 0.00 0.00 174.94 175.33 1fd7 s THR 41 N -1.63 0.95 0.29 8.37 -4.23 -0.67 -1.18 115.64 117.53 1fd7 s THR 41 Ca 0.08 -2.01 0.06 0.00 -1.18 0.00 0.00 61.69 58.64 1fd7 s THR 41 Cb -0.08 -1.90 -0.06 0.00 1.34 0.00 0.00 72.50 71.80 1fd7 s THR 41 CO 0.04 -0.69 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.03 1fd7 s PHE 42 N -3.47 2.01 0.59 3.99 0.08 -0.69 -1.22 117.98 119.26 1fd7 s PHE 42 Ca 0.18 -0.72 0.28 0.00 0.12 0.00 0.00 56.93 56.79 1fd7 s PHE 42 Cb 0.04 -1.18 1.62 0.00 -0.57 0.00 0.00 43.02 42.93 1fd7 s PHE 42 CO 0.01 0.27 2.07 0.87 -0.10 0.00 0.00 175.22 178.34 1fd7 h LYS 43 N 2.22 0.00 0.00 0.44 6.56 -1.90 -0.95 116.57 122.95 1fd7 h LYS 43 Ca -0.40 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.19 1fd7 h LYS 43 Cb 1.24 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 1fd7 h LYS 43 CO 0.68 0.00 0.00 -1.13 -2.06 0.00 0.00 179.45 176.94 1fd7 n SER 44 N -3.81 0.00 0.00 0.86 3.41 -1.26 -4.86 113.62 107.95 1fd7 n SER 44 Ca 0.03 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 1fd7 n SER 44 Cb 0.37 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1fd7 n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fd7 n GLY 45 N -0.49 0.82 3.80 5.00 0.00 -0.36 -5.04 105.19 108.93 1fd7 n GLY 45 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1fd7 n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fd7 s GLU 46 N -0.12 4.37 -0.04 1.61 0.41 -1.25 -4.87 118.70 118.81 1fd7 s GLU 46 Ca 0.00 1.02 0.04 0.00 -0.41 0.00 0.00 54.97 55.62 1fd7 s GLU 46 Cb 0.00 -2.90 -0.00 0.00 -1.78 0.00 0.00 34.13 29.45 1fd7 s GLU 46 CO 0.00 0.38 -0.17 0.99 -0.49 0.00 0.00 175.26 175.97 1fd7 s THR 47 N -1.51 1.43 0.10 3.63 2.01 -1.26 -1.70 115.64 118.34 1fd7 s THR 47 Ca 0.44 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.76 1fd7 s THR 47 Cb -0.18 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.06 1fd7 s THR 47 CO 0.22 0.41 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.10 1fd7 s PHE 48 N 0.06 1.07 0.22 4.92 0.08 -0.33 -4.05 117.98 119.96 1fd7 s PHE 48 Ca -0.04 -0.65 0.08 0.00 0.12 0.00 0.00 56.93 56.43 1fd7 s PHE 48 Cb -0.12 -0.58 -0.05 0.00 -0.57 0.00 0.00 43.02 41.70 1fd7 s PHE 48 CO 0.02 0.00 -0.13 1.14 -0.10 0.00 0.00 175.22 176.15 1fd7 s GLN 49 N -2.77 1.39 -0.26 0.44 -2.07 -0.23 -0.92 119.66 115.24 1fd7 s GLN 49 Ca 0.05 -1.64 -0.08 0.00 -1.82 0.00 0.00 55.36 51.88 1fd7 s GLN 49 Cb -0.03 -1.17 -0.03 0.00 -1.09 0.00 0.00 33.01 30.70 1fd7 s GLN 49 CO 0.00 0.17 0.08 0.08 -1.32 0.00 0.00 175.29 174.30 1fd7 s VAL 50 N -2.95 4.35 0.69 3.63 1.01 -0.42 -0.23 120.40 126.48 1fd7 s VAL 50 Ca 0.24 -0.20 -0.14 0.00 0.00 0.00 0.00 61.98 61.88 1fd7 s VAL 50 Cb -0.00 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1fd7 s VAL 50 CO 0.08 0.31 1.12 -1.61 0.00 0.00 0.00 175.10 175.00 1fd7 s GLU 51 N 1.61 2.56 0.27 2.72 2.02 -1.26 -3.50 118.70 123.12 1fd7 s GLU 51 Ca 0.06 1.43 -0.30 0.00 0.02 0.00 0.00 54.97 56.18 1fd7 s GLU 51 Cb -0.15 -1.92 -0.11 0.00 0.10 0.00 0.00 34.13 32.05 1fd7 s GLU 51 CO 0.04 -1.45 1.60 0.08 0.02 0.00 0.00 175.26 175.55 1fd7 s VAL 52 N -2.36 2.12 0.19 2.63 1.01 -1.26 -4.89 120.40 117.84 1fd7 s VAL 52 Ca 0.67 0.10 -0.33 0.00 0.00 0.00 0.00 61.98 62.42 1fd7 s VAL 52 Cb -0.22 -3.06 -0.14 0.00 0.00 0.00 0.00 36.38 32.96 1fd7 s VAL 52 CO 0.44 0.01 1.50 -2.65 0.00 0.00 0.00 175.10 174.41 1fd7 n PRO 53 N 2.48 2.07 -1.24 2.72 -0.02 -1.26 -4.94 135.00 134.81 1fd7 n PRO 53 Ca 0.09 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1fd7 n PRO 53 Cb 0.37 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1fd7 n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fd7 n GLY 54 N 2.83 3.37 0.30 -1.23 0.00 -1.26 -5.03 105.19 104.16 1fd7 n GLY 54 Ca 0.15 -1.33 0.19 0.00 0.00 0.00 0.00 46.02 45.03 1fd7 n GLY 54 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fd7 h SER 55 N 0.00 0.00 1.59 1.61 4.64 -2.03 -1.01 113.55 118.35 1fd7 h SER 55 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fd7 h SER 55 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fd7 h SER 55 CO 0.00 0.00 -0.00 0.06 -0.87 0.00 0.00 176.83 176.02 1fd7 h GLN 56 N 0.00 0.00 -6.51 4.77 -0.00 -1.96 -3.44 115.11 107.96 1fd7 h GLN 56 Ca 0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 58.65 58.12 1fd7 h GLN 56 Cb 0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.78 1fd7 h GLN 56 CO 0.00 0.00 0.03 -1.01 -0.00 0.00 0.00 178.83 177.85 1fd7 s HIS 57 N -3.40 3.57 0.46 0.06 3.76 -0.39 -5.09 115.29 114.26 1fd7 s HIS 57 Ca 0.05 1.22 0.00 0.00 -0.15 0.00 0.00 55.06 56.17 1fd7 s HIS 57 Cb 0.07 -2.50 -0.00 0.00 1.11 0.00 0.00 32.58 31.26 1fd7 s HIS 57 CO 0.62 0.31 0.68 0.96 -0.85 0.00 0.00 174.74 176.46 1fd7 s ILE 58 N -1.62 3.93 0.29 0.60 -4.36 -1.26 -4.90 121.20 113.88 1fd7 s ILE 58 Ca 0.44 -0.48 0.02 0.00 -0.26 0.00 0.00 60.65 60.36 1fd7 s ILE 58 Cb -0.14 -3.46 0.29 0.00 1.25 0.00 0.00 42.46 40.40 1fd7 s ILE 58 CO 0.20 -0.33 1.85 0.44 0.24 0.00 0.00 174.94 177.34 1fd7 h ASP 59 N 0.36 0.92 0.04 4.36 5.19 -1.98 -1.38 116.42 123.93 1fd7 h ASP 59 Ca -0.46 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 1fd7 h ASP 59 Cb 1.25 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.62 1fd7 h ASP 59 CO 0.57 0.50 0.00 0.77 -3.12 0.00 0.00 179.24 177.96 1fd7 h SER 60 N 0.99 0.00 1.15 6.45 4.64 -2.05 -1.35 113.55 123.38 1fd7 h SER 60 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1fd7 h SER 60 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1fd7 h SER 60 CO -0.25 0.00 -0.44 1.56 -0.87 0.00 0.00 176.83 176.84 1fd7 h GLN 61 N 0.00 0.00 -0.08 4.77 4.20 -1.64 -3.37 115.11 119.00 1fd7 h GLN 61 Ca 0.00 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 1fd7 h GLN 61 Cb 0.02 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.74 1fd7 h GLN 61 CO 0.00 0.00 -0.33 0.87 -0.67 0.00 0.00 178.83 178.70 1fd7 h LYS 62 N 0.00 -0.42 -0.19 1.46 1.79 -1.32 0.42 116.57 118.31 1fd7 h LYS 62 Ca 0.00 0.03 -0.09 0.00 -2.18 0.00 0.00 60.65 58.41 1fd7 h LYS 62 Cb 0.79 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.53 1fd7 h LYS 62 CO 0.00 -0.28 -0.29 -0.22 -1.08 0.00 0.00 179.45 177.58 1fd7 h LYS 63 N -0.43 0.37 -0.17 3.15 3.64 -1.76 -2.91 116.57 118.45 1fd7 h LYS 63 Ca 0.08 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 1fd7 h LYS 63 Cb 0.56 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1fd7 h LYS 63 CO -0.32 0.63 -0.37 0.00 -2.27 0.00 0.00 179.45 177.12 1fd7 h ALA 64 N 1.37 1.04 -0.05 5.00 0.00 -1.43 -0.03 119.26 125.17 1fd7 h ALA 64 Ca 0.05 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1fd7 h ALA 64 Cb 0.68 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1fd7 h ALA 64 CO 0.05 0.60 0.02 0.82 0.00 0.00 0.00 179.25 180.74 1fd7 h ILE 65 N 0.32 1.13 -0.49 0.00 2.04 -0.03 0.22 117.51 120.71 1fd7 h ILE 65 Ca 0.03 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1fd7 h ILE 65 Cb 0.81 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1fd7 h ILE 65 CO 0.06 0.11 0.23 -0.33 0.00 0.00 0.00 178.15 178.22 1fd7 h GLU 66 N -0.08 0.71 -0.75 2.37 4.39 -1.38 -2.27 114.58 117.57 1fd7 h GLU 66 Ca 0.02 -0.11 0.09 0.00 0.34 0.00 0.00 59.36 59.70 1fd7 h GLU 66 Cb 0.16 -0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 28.62 1fd7 h GLU 66 CO -0.00 0.60 0.40 -0.09 -1.16 0.00 0.00 179.01 178.76 1fd7 h ARG 67 N 0.64 0.66 -0.71 2.33 2.43 -0.78 -1.41 114.38 117.54 1fd7 h ARG 67 Ca 0.17 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1fd7 h ARG 67 Cb 0.14 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 1fd7 h ARG 67 CO -0.02 0.44 0.16 1.98 -1.51 0.00 0.00 179.97 181.02 1fd7 h MET 68 N 0.68 1.14 -0.85 0.20 4.05 -0.42 -0.69 114.93 119.04 1fd7 h MET 68 Ca 0.37 -0.28 -0.03 0.00 -0.28 0.00 0.00 59.70 59.48 1fd7 h MET 68 Cb 0.36 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 30.97 1fd7 h MET 68 CO -0.26 1.01 0.42 0.87 0.23 0.00 0.00 176.91 179.18 1fd7 h LYS 69 N 1.08 1.23 -0.01 0.39 1.57 -1.20 -0.66 116.57 118.97 1fd7 h LYS 69 Ca 0.22 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1fd7 h LYS 69 Cb 0.39 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1fd7 h LYS 69 CO 0.00 0.93 -0.15 -0.44 -0.57 0.00 0.00 179.45 179.23 1fd7 h ASP 70 N 1.22 -0.43 -0.44 0.86 3.32 -0.81 -2.13 116.42 118.00 1fd7 h ASP 70 Ca 0.29 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 1fd7 h ASP 70 Cb 0.11 0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1fd7 h ASP 70 CO -0.04 -0.20 0.25 0.74 -1.72 0.00 0.00 179.24 178.27 1fd7 h THR 71 N -0.24 1.15 -0.98 0.35 2.02 -0.77 -2.56 112.91 111.89 1fd7 h THR 71 Ca 0.05 -0.38 0.03 0.00 0.77 0.00 0.00 66.41 66.88 1fd7 h THR 71 Cb 0.31 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.26 1fd7 h THR 71 CO -0.15 0.16 0.64 -0.07 0.37 0.00 0.00 175.52 176.47 1fd7 h LEU 72 N 0.58 1.08 0.16 2.58 3.38 -0.98 0.47 115.31 122.58 1fd7 h LEU 72 Ca 0.16 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1fd7 h LEU 72 Cb 0.03 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1fd7 h LEU 72 CO -0.03 0.76 -0.08 -0.09 0.09 0.00 0.00 178.44 179.09 1fd7 h ARG 73 N 1.26 -0.20 -0.43 1.13 2.43 -1.07 0.57 114.38 118.06 1fd7 h ARG 73 Ca 0.38 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.48 1fd7 h ARG 73 Cb -0.05 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1fd7 h ARG 73 CO -0.11 -0.05 -0.07 0.97 -1.51 0.00 0.00 179.97 179.21 1fd7 h ILE 74 N -0.32 1.25 -0.13 1.20 6.09 -1.36 -0.39 117.51 123.85 1fd7 h ILE 74 Ca -0.02 -1.08 0.00 0.00 -1.37 0.00 0.00 64.86 62.39 1fd7 h ILE 74 Cb 0.25 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 38.52 1fd7 h ILE 74 CO 0.04 0.37 0.08 0.74 -3.07 0.00 0.00 178.15 176.31 1fd7 h THR 75 N 0.68 1.04 -0.15 2.19 2.02 0.18 -1.45 112.91 117.42 1fd7 h THR 75 Ca 0.12 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.26 1fd7 h THR 75 Cb 0.52 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 1fd7 h THR 75 CO 0.03 0.04 -0.09 0.22 0.37 0.00 0.00 175.52 176.09 1fd7 h TYR 76 N 0.16 -0.22 0.00 3.16 3.20 -0.35 -1.78 116.97 121.15 1fd7 h TYR 76 Ca 0.05 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 1fd7 h TYR 76 Cb -0.01 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1fd7 h TYR 76 CO -0.07 -0.14 -0.26 -0.07 -1.64 0.00 0.00 178.16 175.98 1fd7 h LEU 77 N -0.09 0.00 -0.65 2.82 3.38 -0.89 -2.53 115.31 117.34 1fd7 h LEU 77 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1fd7 h LEU 77 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1fd7 h LEU 77 CO -0.20 0.26 -0.34 0.35 0.09 0.00 0.00 178.44 178.60 1fd7 n THR 78 N -3.98 0.00 -2.19 0.22 -2.24 -0.56 -4.94 114.28 100.58 1fd7 n THR 78 Ca -0.02 -0.17 -0.16 0.00 -2.27 0.00 0.00 64.05 61.43 1fd7 n THR 78 Cb 0.33 0.68 -0.02 0.00 -2.10 0.00 0.00 70.33 69.23 1fd7 n THR 78 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fd7 n GLU 79 N -0.46 -1.27 -2.07 -0.78 1.02 -0.72 -4.96 120.64 111.41 1fd7 n GLU 79 Ca 0.11 0.82 -0.40 0.00 -0.02 0.00 0.00 57.16 57.68 1fd7 n GLU 79 Cb 0.39 -5.20 -0.01 0.00 -0.02 0.00 0.00 31.44 26.60 1fd7 n GLU 79 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1fd7 s THR 80 N -2.78 2.66 0.22 2.62 2.01 -0.91 -4.78 115.64 114.67 1fd7 s THR 80 Ca 0.00 0.60 -0.25 0.00 0.31 0.00 0.00 61.69 62.35 1fd7 s THR 80 Cb 0.00 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 1fd7 s THR 80 CO 0.00 0.10 0.82 -0.54 -0.69 0.00 0.00 174.62 174.31 1fd7 s LYS 81 N -2.15 4.55 -0.03 4.92 1.02 -1.26 -4.33 119.74 122.46 1fd7 s LYS 81 Ca 0.55 1.18 -0.16 0.00 0.02 0.00 0.00 55.97 57.57 1fd7 s LYS 81 Cb -0.38 -3.11 -0.05 0.00 -0.52 0.00 0.00 37.83 33.77 1fd7 s LYS 81 CO 0.49 0.48 0.43 0.42 -0.92 0.00 0.00 175.35 176.25 1fd7 s ILE 82 N -1.31 5.07 0.00 2.17 1.01 0.33 -4.41 121.20 124.05 1fd7 s ILE 82 Ca 0.41 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.92 1fd7 s ILE 82 Cb -0.21 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1fd7 s ILE 82 CO 0.26 0.50 0.00 -0.67 0.00 0.00 0.00 174.94 175.03 1fd7 n ASP 83 N 2.38 0.00 -4.27 3.58 -0.08 0.10 -0.45 116.55 117.81 1fd7 n ASP 83 Ca -0.12 0.30 -0.21 0.00 -1.51 0.00 0.00 54.79 53.25 1fd7 n ASP 83 Cb 0.52 -0.40 -0.12 0.00 2.34 0.00 0.00 41.12 43.46 1fd7 n ASP 83 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1fd7 s LYS 84 N -0.80 1.11 -0.05 -0.67 1.02 -1.11 0.58 119.74 119.82 1fd7 s LYS 84 Ca 0.00 -1.23 0.06 0.00 0.02 0.00 0.00 55.97 54.82 1fd7 s LYS 84 Cb 0.00 -1.18 -0.01 0.00 -0.52 0.00 0.00 37.83 36.12 1fd7 s LYS 84 CO 0.00 0.25 -0.24 -0.51 -0.92 0.00 0.00 175.35 173.93 1fd7 s LEU 85 N -2.25 2.05 -0.35 3.17 1.43 -0.25 -0.44 118.68 122.05 1fd7 s LEU 85 Ca 0.09 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1fd7 s LEU 85 Cb -0.07 -1.31 0.01 0.00 0.03 0.00 0.00 46.19 44.84 1fd7 s LEU 85 CO 0.04 0.25 0.21 0.00 0.23 0.00 0.00 176.35 177.08 1fd7 s VAL 87 N 1.62 1.63 -0.23 0.00 -7.23 -0.58 -0.31 120.40 115.32 1fd7 s VAL 87 Ca 0.04 -1.90 -0.19 0.00 -1.81 0.00 0.00 61.98 58.12 1fd7 s VAL 87 Cb -0.18 -1.77 -0.03 0.00 0.56 0.00 0.00 36.38 34.96 1fd7 s VAL 87 CO 0.08 -0.40 0.55 0.26 -0.31 0.00 0.00 175.10 175.28 1fd7 s TRP 88 N -2.25 3.33 -0.34 2.82 0.51 0.53 -1.99 118.94 121.55 1fd7 s TRP 88 Ca 0.15 0.76 0.11 0.00 -2.12 0.00 0.00 56.10 55.00 1fd7 s TRP 88 Cb -0.04 -2.73 0.71 0.00 -0.81 0.00 0.00 33.47 30.59 1fd7 s TRP 88 CO 0.05 -0.20 1.62 0.27 -0.51 0.00 0.00 176.95 178.18 1fd7 n ASN 89 N 5.20 5.01 -1.41 2.95 0.23 0.07 -1.66 115.26 125.65 1fd7 n ASN 89 Ca -0.03 -2.88 0.02 0.00 -0.53 0.00 0.00 54.58 51.16 1fd7 n ASN 89 Cb 0.50 -0.68 0.28 0.00 -2.08 0.00 0.00 39.78 37.80 1fd7 n ASN 89 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1fd7 n ASN 90 N 0.40 4.21 -4.14 0.53 2.04 -1.26 -4.88 115.26 112.15 1fd7 n ASN 90 Ca 0.27 -3.19 -0.11 0.00 -0.44 0.00 0.00 54.58 51.11 1fd7 n ASN 90 Cb 1.13 -0.64 -0.10 0.00 -2.53 0.00 0.00 39.78 37.63 1fd7 n ASN 90 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1fd7 s LYS 91 N -2.95 0.74 -0.14 -3.83 -0.14 -1.25 -5.08 119.74 107.09 1fd7 s LYS 91 Ca 0.48 -1.16 -0.02 0.00 -1.36 0.00 0.00 55.97 53.91 1fd7 s LYS 91 Cb 0.39 -0.21 0.04 0.00 -1.68 0.00 0.00 37.83 36.37 1fd7 s LYS 91 CO 0.10 -0.00 0.00 0.99 -0.76 0.00 0.00 175.35 175.68 1fd7 s THR 92 N -2.98 0.57 0.69 2.17 2.01 -1.26 -2.48 115.64 114.35 1fd7 s THR 92 Ca 0.05 -0.27 -0.11 0.00 0.31 0.00 0.00 61.69 61.67 1fd7 s THR 92 Cb 0.01 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.66 1fd7 s THR 92 CO -0.03 0.06 1.07 -2.16 -0.69 0.00 0.00 174.62 172.87 1fd7 s PRO 93 N 1.87 2.98 0.40 4.92 0.04 -1.26 -5.07 135.00 138.88 1fd7 s PRO 93 Ca 0.02 0.62 -0.24 0.00 0.04 0.00 0.00 61.00 61.44 1fd7 s PRO 93 Cb -0.15 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 1fd7 s PRO 93 CO -0.07 -0.98 0.69 0.09 0.04 0.00 0.00 177.00 176.77 1fd7 n ASN 94 N -3.00 -0.24 -4.74 6.66 5.03 -1.04 -4.44 115.26 113.50 1fd7 n ASN 94 Ca 0.07 0.97 -0.35 0.00 0.87 0.00 0.00 54.58 56.14 1fd7 n ASN 94 Cb 0.56 -1.17 -0.08 0.00 -1.02 0.00 0.00 39.78 38.07 1fd7 n ASN 94 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1fd7 s SER 95 N -0.88 6.10 -0.03 6.41 0.15 -0.66 -1.07 113.70 123.72 1fd7 s SER 95 Ca 0.63 0.24 -0.30 0.00 0.70 0.00 0.00 55.95 57.22 1fd7 s SER 95 Cb -0.62 -2.04 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 1fd7 s SER 95 CO 0.58 0.23 1.22 -0.63 1.20 0.00 0.00 173.24 175.84 1fd7 s ILE 96 N 0.07 4.16 -0.18 6.45 1.01 0.68 -0.35 121.20 133.05 1fd7 s ILE 96 Ca 0.08 1.50 0.09 0.00 0.00 0.00 0.00 60.65 62.33 1fd7 s ILE 96 Cb -0.11 -3.97 -0.17 0.00 0.01 0.00 0.00 42.46 38.22 1fd7 s ILE 96 CO -0.00 0.01 -0.04 0.00 0.00 0.00 0.00 174.94 174.91 1fd7 n ALA 97 N 5.06 1.58 -3.34 9.38 0.00 0.58 -4.87 120.51 128.91 1fd7 n ALA 97 Ca 0.11 -1.00 -0.14 0.00 0.00 0.00 0.00 53.44 52.41 1fd7 n ALA 97 Cb 0.46 -0.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.81 1fd7 n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fd7 s ALA 98 N -2.40 -1.40 0.02 0.00 0.00 -0.78 -4.97 121.76 112.22 1fd7 s ALA 98 Ca -0.16 0.65 0.03 0.00 0.00 0.00 0.00 51.96 52.48 1fd7 s ALA 98 Cb 0.06 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.57 1fd7 s ALA 98 CO 0.59 -0.52 -0.10 -1.50 0.00 0.00 0.00 175.76 174.23 1fd7 s ILE 99 N -2.49 0.75 0.11 0.00 2.07 -1.26 -1.06 121.20 119.32 1fd7 s ILE 99 Ca -0.05 -0.66 0.06 0.00 -1.41 0.00 0.00 60.65 58.59 1fd7 s ILE 99 Cb -0.01 -0.68 -0.04 0.00 0.13 0.00 0.00 42.46 41.87 1fd7 s ILE 99 CO -0.02 0.03 -0.14 -0.94 -1.91 0.00 0.00 174.94 171.96 1fd7 s SER 100 N -0.70 1.89 -0.02 4.50 1.04 0.42 -4.99 113.70 115.84 1fd7 s SER 100 Ca 0.00 -0.76 -0.05 0.00 0.48 0.00 0.00 55.95 55.62 1fd7 s SER 100 Cb -0.06 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.01 1fd7 s SER 100 CO 0.00 -0.13 0.12 -0.04 0.98 0.00 0.00 173.24 174.17 1fd7 s MET 101 N -2.44 0.32 0.00 4.02 -1.94 -1.26 -0.72 119.30 117.27 1fd7 s MET 101 Ca 0.06 -0.14 -0.10 0.00 -1.71 0.00 0.00 55.69 53.79 1fd7 s MET 101 Cb -0.06 0.14 0.01 0.00 2.01 0.00 0.00 34.83 36.92 1fd7 s MET 101 CO 0.03 -0.06 0.20 -1.59 -0.01 0.00 0.00 175.02 173.59 1fd7 s LYS 102 N -0.71 0.57 0.00 2.03 -2.85 -1.26 -4.87 119.74 112.65 1fd7 s LYS 102 Ca -0.08 -0.35 0.23 0.00 -1.00 0.00 0.00 55.97 54.77 1fd7 s LYS 102 Cb -0.05 0.24 0.18 0.00 -2.06 0.00 0.00 37.83 36.15 1fd7 s LYS 102 CO 0.01 -0.15 1.22 0.27 0.10 0.00 0.00 175.35 176.80