#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lt6 s PRO 2 N 0.00 3.55 -0.04 0.00 0.02 -1.26 -4.88 135.00 132.39 1lt6 s PRO 2 Ca 0.00 2.36 0.10 0.00 0.02 0.00 0.00 61.00 63.48 1lt6 s PRO 2 Cb 0.00 -2.56 0.26 0.00 0.02 0.00 0.00 34.50 32.22 1lt6 s PRO 2 CO 0.00 -0.90 1.20 1.04 -0.33 0.00 0.00 177.00 178.01 1lt6 n GLN 3 N -0.40 2.77 -3.68 5.54 6.02 -1.26 -4.97 117.38 121.40 1lt6 n GLN 3 Ca 0.06 -2.09 -0.14 0.00 -0.01 0.00 0.00 57.00 54.83 1lt6 n GLN 3 Cb 0.43 -1.32 -0.08 0.00 1.02 0.00 0.00 30.24 30.30 1lt6 n GLN 3 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1lt6 s THR 4 N -1.49 0.04 0.41 5.09 2.01 -1.26 -5.04 115.64 115.40 1lt6 s THR 4 Ca 0.21 -0.36 0.12 0.00 0.31 0.00 0.00 61.69 61.97 1lt6 s THR 4 Cb 0.14 -0.78 0.17 0.00 0.01 0.00 0.00 72.50 72.04 1lt6 s THR 4 CO 0.09 -0.20 1.95 -0.29 -0.69 0.00 0.00 174.62 175.48 1lt6 h ILE 5 N 3.49 1.16 -0.17 1.82 2.10 -1.97 -2.57 117.51 121.37 1lt6 h ILE 5 Ca -0.29 -0.73 -0.16 0.00 1.08 0.00 0.00 64.86 64.76 1lt6 h ILE 5 Cb 1.17 1.30 -0.01 0.00 -1.09 0.00 0.00 36.82 38.19 1lt6 h ILE 5 CO 0.40 0.22 -0.55 0.74 -1.08 0.00 0.00 178.15 177.88 1lt6 h THR 6 N 0.11 1.33 0.28 2.19 2.02 -1.98 -1.34 112.91 115.52 1lt6 h THR 6 Ca 0.02 -1.81 -0.01 0.00 0.77 0.00 0.00 66.41 65.37 1lt6 h THR 6 Cb 0.36 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1lt6 h THR 6 CO 0.02 0.56 -0.14 -0.33 0.37 0.00 0.00 175.52 176.01 1lt6 h GLU 7 N 0.39 -0.36 -0.64 6.66 5.08 -1.78 0.15 114.58 124.07 1lt6 h GLU 7 Ca 0.01 0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 1lt6 h GLU 7 Cb 1.09 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1lt6 h GLU 7 CO 0.10 -0.11 0.05 1.37 -1.00 0.00 0.00 179.01 179.42 1lt6 h LEU 8 N -0.58 1.06 -0.25 1.33 8.10 -1.59 -2.67 115.31 120.72 1lt6 h LEU 8 Ca -0.04 -0.28 0.03 0.00 0.11 0.00 0.00 57.88 57.69 1lt6 h LEU 8 Cb 0.42 -0.28 -0.03 0.00 -0.44 0.00 0.00 40.66 40.33 1lt6 h LEU 8 CO 0.06 1.08 0.09 0.00 -4.11 0.00 0.00 178.44 175.56 1lt6 n SER 10 N -5.04 6.86 0.00 0.00 7.64 0.51 -2.65 113.62 120.94 1lt6 n SER 10 Ca -0.02 -3.05 0.00 0.00 1.01 0.00 0.00 58.87 56.81 1lt6 n SER 10 Cb 0.09 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 61.85 1lt6 n SER 10 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1lt6 n GLU 11 N 2.92 0.00 -4.21 1.43 2.13 -0.83 -4.82 120.64 117.27 1lt6 n GLU 11 Ca 0.56 -0.04 -0.12 0.00 0.66 0.00 0.00 57.16 58.22 1lt6 n GLU 11 Cb 0.29 -0.13 -0.10 0.00 0.27 0.00 0.00 31.44 31.77 1lt6 n GLU 11 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1lt6 s TYR 12 N 0.00 1.06 0.15 4.31 1.51 -1.08 -5.08 117.35 118.21 1lt6 s TYR 12 Ca 0.00 -0.89 -0.08 0.00 -1.01 0.00 0.00 57.07 55.09 1lt6 s TYR 12 Cb 0.00 -0.59 -0.06 0.00 -0.11 0.00 0.00 41.96 41.20 1lt6 s TYR 12 CO 0.00 -0.10 0.45 1.03 -1.11 0.00 0.00 175.55 175.82 1lt6 s ARG 13 N -3.83 3.74 -0.93 -0.62 1.81 -1.26 -4.29 118.95 113.57 1lt6 s ARG 13 Ca 0.16 0.13 -0.02 0.00 -1.72 0.00 0.00 55.73 54.28 1lt6 s ARG 13 Cb 0.05 -2.84 0.00 0.00 -0.45 0.00 0.00 34.95 31.71 1lt6 s ARG 13 CO -0.02 0.45 0.24 0.09 -0.68 0.00 0.00 175.30 175.39 1lt6 n ASN 14 N 0.30 -4.06 -4.54 0.23 4.13 -1.26 -4.98 115.26 105.08 1lt6 n ASN 14 Ca -0.03 -0.12 -0.25 0.00 1.68 0.00 0.00 54.58 55.86 1lt6 n ASN 14 Cb 0.52 -3.04 -0.10 0.00 -1.54 0.00 0.00 39.78 35.62 1lt6 n ASN 14 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1lt6 s THR 15 N -2.81 2.46 -0.20 3.41 -4.23 -1.26 -1.58 115.64 111.43 1lt6 s THR 15 Ca 0.12 -2.21 -0.27 0.00 -1.18 0.00 0.00 61.69 58.15 1lt6 s THR 15 Cb -0.05 -2.58 0.08 0.00 1.34 0.00 0.00 72.50 71.29 1lt6 s THR 15 CO 0.15 -0.27 0.79 0.00 -0.54 0.00 0.00 174.62 174.74 1lt6 s GLN 16 N -3.60 0.82 0.60 3.99 -2.07 -0.53 -4.90 119.66 113.96 1lt6 s GLN 16 Ca 0.32 0.66 -0.13 0.00 -1.82 0.00 0.00 55.36 54.39 1lt6 s GLN 16 Cb -0.01 0.40 -0.05 0.00 -1.09 0.00 0.00 33.01 32.26 1lt6 s GLN 16 CO 0.17 -0.16 1.02 0.42 -1.32 0.00 0.00 175.29 175.42 1lt6 s ILE 17 N -0.20 4.50 -0.06 3.63 -1.09 -1.26 -1.63 121.20 125.09 1lt6 s ILE 17 Ca -0.03 0.95 -0.02 0.00 -2.23 0.00 0.00 60.65 59.32 1lt6 s ILE 17 Cb -0.03 -3.73 0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1lt6 s ILE 17 CO 0.02 -0.93 0.12 -0.31 -1.23 0.00 0.00 174.94 172.61 1lt6 s TYR 18 N -2.94 -0.09 -0.86 3.97 1.51 0.15 -4.93 117.35 114.15 1lt6 s TYR 18 Ca 0.57 0.43 -0.15 0.00 -1.01 0.00 0.00 57.07 56.91 1lt6 s TYR 18 Cb -0.11 -0.25 0.20 0.00 -0.11 0.00 0.00 41.96 41.68 1lt6 s TYR 18 CO 0.46 -0.20 0.88 0.99 -1.11 0.00 0.00 175.55 176.57 1lt6 s THR 19 N 1.75 5.37 -0.05 -0.71 2.01 -1.26 -0.76 115.64 121.98 1lt6 s THR 19 Ca -0.02 -2.24 -0.13 0.00 0.31 0.00 0.00 61.69 59.61 1lt6 s THR 19 Cb -0.12 -4.56 -0.08 0.00 0.01 0.00 0.00 72.50 67.75 1lt6 s THR 19 CO -0.05 -1.17 0.54 0.40 -0.69 0.00 0.00 174.62 173.65 1lt6 h ILE 20 N 5.06 0.09 -5.87 1.82 5.03 -1.54 -3.48 117.51 118.62 1lt6 h ILE 20 Ca 0.13 -0.73 -0.36 0.00 -0.12 0.00 0.00 64.86 63.78 1lt6 h ILE 20 Cb 1.03 0.15 0.12 0.00 -3.03 0.00 0.00 36.82 35.09 1lt6 h ILE 20 CO 0.86 0.02 -0.86 -3.20 -0.68 0.00 0.00 178.15 174.29 1lt6 n ASN 21 N -5.05 -4.03 -3.62 1.72 5.15 0.21 -4.97 115.26 104.67 1lt6 n ASN 21 Ca -0.06 -0.81 -0.01 0.00 -0.60 0.00 0.00 54.58 53.10 1lt6 n ASN 21 Cb 0.18 -4.38 -0.01 0.00 -0.53 0.00 0.00 39.78 35.04 1lt6 n ASN 21 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1lt6 s ASP 22 N -3.83 -0.11 0.38 1.20 2.15 -0.64 -4.94 116.67 110.88 1lt6 s ASP 22 Ca 0.26 -0.10 -0.06 0.00 0.43 0.00 0.00 52.55 53.08 1lt6 s ASP 22 Cb -0.06 0.19 -0.05 0.00 -0.30 0.00 0.00 42.92 42.70 1lt6 s ASP 22 CO 0.79 -0.34 0.68 -1.59 -0.17 0.00 0.00 175.17 174.55 1lt6 s LYS 23 N -2.52 3.64 0.09 4.34 -2.85 -1.26 -0.72 119.74 120.45 1lt6 s LYS 23 Ca 0.12 0.17 -0.31 0.00 -1.00 0.00 0.00 55.97 54.95 1lt6 s LYS 23 Cb 0.02 -2.49 -0.08 0.00 -2.06 0.00 0.00 37.83 33.22 1lt6 s LYS 23 CO -0.04 0.01 1.50 0.42 0.10 0.00 0.00 175.35 177.34 1lt6 s ILE 24 N -2.38 3.18 -0.09 3.79 1.01 -1.26 -4.76 121.20 120.68 1lt6 s ILE 24 Ca 0.47 0.75 -0.27 0.00 0.00 0.00 0.00 60.65 61.59 1lt6 s ILE 24 Cb -0.10 -3.48 -0.23 0.00 0.01 0.00 0.00 42.46 38.65 1lt6 s ILE 24 CO 0.35 0.03 0.99 0.25 0.00 0.00 0.00 174.94 176.56 1lt6 h LEU 25 N 7.61 -0.00 -8.61 2.97 5.85 -1.10 -3.47 115.31 118.55 1lt6 h LEU 25 Ca -0.41 -0.77 -0.40 0.00 0.84 0.00 0.00 57.88 57.14 1lt6 h LEU 25 Cb 1.20 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 42.05 1lt6 h LEU 25 CO 0.90 0.77 -0.75 -0.44 -0.34 0.00 0.00 178.44 178.58 1lt6 s SER 26 N -5.98 1.95 -0.06 1.25 0.01 -0.91 -4.99 113.70 104.97 1lt6 s SER 26 Ca -0.18 -0.84 -0.01 0.00 1.31 0.00 0.00 55.95 56.23 1lt6 s SER 26 Cb -0.01 -0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.19 1lt6 s SER 26 CO 0.68 -0.18 0.01 -0.47 0.41 0.00 0.00 173.24 173.69 1lt6 s TYR 27 N -2.34 0.58 -0.08 2.43 6.14 -1.26 -2.81 117.35 120.02 1lt6 s TYR 27 Ca 0.10 -0.11 0.05 0.00 0.64 0.00 0.00 57.07 57.75 1lt6 s TYR 27 Cb -0.04 -0.74 -0.00 0.00 0.42 0.00 0.00 41.96 41.60 1lt6 s TYR 27 CO 0.03 -0.30 -0.24 0.99 0.64 0.00 0.00 175.55 176.67 1lt6 s THR 28 N 1.90 2.02 -0.08 4.34 2.01 0.19 -4.99 115.64 121.03 1lt6 s THR 28 Ca 0.04 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1lt6 s THR 28 Cb -0.12 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.67 1lt6 s THR 28 CO -0.05 0.55 -0.17 -0.70 -0.69 0.00 0.00 174.62 173.57 1lt6 s GLU 29 N 0.12 2.22 0.05 4.92 2.12 -1.26 -1.20 118.70 125.66 1lt6 s GLU 29 Ca -0.12 -0.59 0.09 0.00 0.36 0.00 0.00 54.97 54.71 1lt6 s GLU 29 Cb -0.16 -1.76 -0.03 0.00 0.26 0.00 0.00 34.13 32.44 1lt6 s GLU 29 CO 0.06 0.08 -0.24 0.45 -0.54 0.00 0.00 175.26 175.06 1lt6 s SER 30 N 0.57 2.93 -0.07 -1.70 0.15 -0.42 -5.01 113.70 110.15 1lt6 s SER 30 Ca -0.16 -0.57 0.10 0.00 0.70 0.00 0.00 55.95 56.02 1lt6 s SER 30 Cb -0.17 -0.26 0.15 0.00 -1.71 0.00 0.00 66.02 64.04 1lt6 s SER 30 CO 0.05 0.22 1.04 1.15 1.20 0.00 0.00 173.24 176.91 1lt6 n MET 31 N 1.78 1.16 -2.59 5.44 0.00 -1.26 -2.99 117.12 118.67 1lt6 n MET 31 Ca -0.17 -1.89 -0.34 0.00 0.00 0.00 0.00 57.70 55.30 1lt6 n MET 31 Cb 0.52 -1.11 -0.04 0.00 0.00 0.00 0.00 33.22 32.59 1lt6 n MET 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1lt6 s ALA 32 N -1.70 2.90 0.10 3.17 0.00 -1.26 -4.90 121.76 120.07 1lt6 s ALA 32 Ca 0.17 0.58 -0.36 0.00 0.00 0.00 0.00 51.96 52.35 1lt6 s ALA 32 Cb 0.15 -3.24 -0.15 0.00 0.00 0.00 0.00 23.12 19.88 1lt6 s ALA 32 CO 0.02 -0.25 1.47 0.41 0.00 0.00 0.00 175.76 177.41 1lt6 n GLY 33 N -0.30 0.79 3.32 0.00 0.00 -1.26 -1.59 105.19 106.14 1lt6 n GLY 33 Ca 0.09 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1lt6 n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lt6 n LYS 34 N 3.14 -0.55 -2.60 1.61 4.01 -1.26 -4.79 118.16 117.72 1lt6 n LYS 34 Ca 0.18 0.14 -0.14 0.00 -0.51 0.00 0.00 58.31 57.98 1lt6 n LYS 34 Cb 0.23 -4.11 0.02 0.00 -0.51 0.00 0.00 35.03 30.67 1lt6 n LYS 34 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1lt6 n ARG 35 N -1.29 1.94 -2.73 1.97 5.12 -0.62 -4.94 116.66 116.11 1lt6 n ARG 35 Ca 0.00 -3.66 -0.42 0.00 -1.93 0.00 0.00 57.85 51.83 1lt6 n ARG 35 Cb 0.14 -1.60 -0.03 0.00 -1.16 0.00 0.00 32.46 29.81 1lt6 n ARG 35 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1lt6 s GLU 36 N -3.32 3.55 0.29 5.56 8.01 -1.21 -4.13 118.70 127.45 1lt6 s GLU 36 Ca 0.34 -1.35 -0.05 0.00 0.01 0.00 0.00 54.97 53.93 1lt6 s GLU 36 Cb 0.43 -5.06 -0.01 0.00 -4.31 0.00 0.00 34.13 25.18 1lt6 s GLU 36 CO -0.03 -2.00 0.41 0.00 0.01 0.00 0.00 175.26 173.65 1lt6 s MET 37 N 3.97 1.70 0.07 1.61 0.23 -1.16 -4.21 119.30 121.51 1lt6 s MET 37 Ca 0.39 -1.61 0.07 0.00 -1.03 0.00 0.00 55.69 53.50 1lt6 s MET 37 Cb -0.03 0.42 -0.03 0.00 -1.53 0.00 0.00 34.83 33.66 1lt6 s MET 37 CO -0.08 -0.68 -0.18 0.08 -2.03 0.00 0.00 175.02 172.13 1lt6 s VAL 38 N -3.50 1.46 -0.05 5.16 1.01 -1.25 -1.30 120.40 121.92 1lt6 s VAL 38 Ca 0.30 -1.34 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 1lt6 s VAL 38 Cb 0.01 -1.33 0.03 0.00 0.00 0.00 0.00 36.38 35.09 1lt6 s VAL 38 CO 0.16 -0.05 0.12 -0.63 0.00 0.00 0.00 175.10 174.70 1lt6 s ILE 39 N -1.08 -0.03 0.07 2.22 1.01 -0.34 -3.13 121.20 119.92 1lt6 s ILE 39 Ca 0.04 0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.87 1lt6 s ILE 39 Cb -0.09 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 1lt6 s ILE 39 CO 0.03 0.05 -0.18 0.27 0.00 0.00 0.00 174.94 175.11 1lt6 s ILE 40 N 0.74 1.45 0.08 2.92 -4.36 -0.28 -0.64 121.20 121.12 1lt6 s ILE 40 Ca -0.06 -1.34 0.01 0.00 -0.26 0.00 0.00 60.65 59.01 1lt6 s ILE 40 Cb -0.08 -1.32 -0.04 0.00 1.25 0.00 0.00 42.46 42.27 1lt6 s ILE 40 CO -0.03 -0.05 -0.06 0.42 0.24 0.00 0.00 174.94 175.46 1lt6 s THR 41 N -1.08 0.55 0.23 8.37 -4.23 -1.12 0.37 115.64 118.73 1lt6 s THR 41 Ca 0.04 -1.79 0.08 0.00 -1.18 0.00 0.00 61.69 58.84 1lt6 s THR 41 Cb -0.09 -1.49 -0.05 0.00 1.34 0.00 0.00 72.50 72.20 1lt6 s THR 41 CO 0.03 -0.84 -0.13 -0.36 -0.54 0.00 0.00 174.62 172.78 1lt6 s PHE 42 N -3.40 1.82 0.43 3.99 0.08 -0.74 -0.45 117.98 119.71 1lt6 s PHE 42 Ca 0.08 -0.58 0.26 0.00 0.12 0.00 0.00 56.93 56.80 1lt6 s PHE 42 Cb 0.04 -0.89 1.30 0.00 -0.57 0.00 0.00 43.02 42.90 1lt6 s PHE 42 CO -0.05 0.37 1.70 0.87 -0.10 0.00 0.00 175.22 178.01 1lt6 h LYS 43 N 2.46 0.21 0.00 0.44 1.57 -1.91 0.41 116.57 119.75 1lt6 h LYS 43 Ca -0.39 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1lt6 h LYS 43 Cb 1.23 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1lt6 h LYS 43 CO 0.63 0.14 0.00 -1.13 -0.57 0.00 0.00 179.45 178.52 1lt6 n SER 44 N -4.61 0.57 0.00 0.86 3.41 -1.26 -4.84 113.62 107.74 1lt6 n SER 44 Ca 0.31 0.69 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1lt6 n SER 44 Cb 1.19 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 1lt6 n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lt6 n GLY 45 N -0.59 0.64 3.66 5.00 0.00 0.14 -5.06 105.19 108.98 1lt6 n GLY 45 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1lt6 n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lt6 s GLU 46 N -0.95 4.26 -0.09 1.61 0.41 -1.22 -4.83 118.70 117.89 1lt6 s GLU 46 Ca 0.00 1.44 -0.01 0.00 -0.41 0.00 0.00 54.97 55.99 1lt6 s GLU 46 Cb 0.00 -3.66 -0.03 0.00 -1.78 0.00 0.00 34.13 28.66 1lt6 s GLU 46 CO 0.00 -0.63 -0.05 0.99 -0.49 0.00 0.00 175.26 175.08 1lt6 s THR 47 N 3.21 3.82 0.11 3.63 2.01 -1.26 -1.80 115.64 125.36 1lt6 s THR 47 Ca 0.47 -0.42 0.03 0.00 0.31 0.00 0.00 61.69 62.08 1lt6 s THR 47 Cb -0.17 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 1lt6 s THR 47 CO 0.09 0.58 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.15 1lt6 s PHE 48 N -0.55 1.04 0.29 4.92 0.08 0.16 -4.08 117.98 119.84 1lt6 s PHE 48 Ca 0.08 -0.79 0.02 0.00 0.12 0.00 0.00 56.93 56.37 1lt6 s PHE 48 Cb -0.12 -0.57 -0.05 0.00 -0.57 0.00 0.00 43.02 41.71 1lt6 s PHE 48 CO 0.02 -0.04 0.10 1.14 -0.10 0.00 0.00 175.22 176.34 1lt6 s GLN 49 N -3.48 1.52 -0.20 0.44 -2.07 -0.56 -1.12 119.66 114.19 1lt6 s GLN 49 Ca 0.11 -1.84 -0.01 0.00 -1.82 0.00 0.00 55.36 51.80 1lt6 s GLN 49 Cb 0.02 -0.40 0.05 0.00 -1.09 0.00 0.00 33.01 31.59 1lt6 s GLN 49 CO -0.02 -0.30 -0.02 0.08 -1.32 0.00 0.00 175.29 173.71 1lt6 s VAL 50 N -3.60 1.07 0.91 3.63 1.01 -1.18 -1.28 120.40 120.95 1lt6 s VAL 50 Ca 0.36 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 1lt6 s VAL 50 Cb 0.07 -1.39 0.14 0.00 0.00 0.00 0.00 36.38 35.21 1lt6 s VAL 50 CO 0.15 -0.07 1.13 -1.61 0.00 0.00 0.00 175.10 174.70 1lt6 s GLU 51 N 1.62 1.09 0.60 2.72 2.02 -1.26 -3.81 118.70 121.68 1lt6 s GLU 51 Ca -0.02 1.43 -0.16 0.00 0.02 0.00 0.00 54.97 56.24 1lt6 s GLU 51 Cb -0.17 -1.74 -0.03 0.00 0.10 0.00 0.00 34.13 32.28 1lt6 s GLU 51 CO -0.07 -2.54 1.07 0.54 0.02 0.00 0.00 175.26 174.27 1lt6 s VAL 52 N -2.68 3.70 0.19 2.63 0.11 -1.26 -4.92 120.40 118.16 1lt6 s VAL 52 Ca 0.66 0.81 -0.32 0.00 -2.93 0.00 0.00 61.98 60.20 1lt6 s VAL 52 Cb -0.22 -3.33 -0.11 0.00 -1.53 0.00 0.00 36.38 31.18 1lt6 s VAL 52 CO 0.58 -0.47 1.74 -2.84 -3.33 0.00 0.00 175.10 170.78 1lt6 s PRO 53 N -4.05 4.13 0.29 1.54 0.02 -1.26 -4.97 135.00 130.70 1lt6 s PRO 53 Ca 0.64 2.59 -0.03 0.00 0.02 0.00 0.00 61.00 64.23 1lt6 s PRO 53 Cb -0.17 -3.21 -0.01 0.00 0.02 0.00 0.00 34.50 31.13 1lt6 s PRO 53 CO 0.37 -0.77 0.37 0.20 -0.33 0.00 0.00 177.00 176.85 1lt6 s GLY 54 N 1.55 1.40 0.60 0.52 0.00 -1.26 -5.04 107.32 105.09 1lt6 s GLY 54 Ca 0.76 -1.50 0.29 0.00 0.00 0.00 0.00 44.72 44.27 1lt6 s GLY 54 CO 0.33 -1.07 1.92 1.76 0.00 0.00 0.00 173.10 176.03 1lt6 h SER 55 N 2.25 0.00 -0.30 1.64 0.02 -2.02 -0.90 113.55 114.25 1lt6 h SER 55 Ca -0.29 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.58 1lt6 h SER 55 Cb 1.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 1lt6 h SER 55 CO 0.41 0.00 -0.09 0.06 -1.14 0.00 0.00 176.83 176.07 1lt6 h GLN 56 N 0.00 0.70 -6.83 3.45 -0.00 -1.97 -3.43 115.11 107.03 1lt6 h GLN 56 Ca 0.18 -0.21 -0.50 0.00 -0.00 0.00 0.00 58.65 58.11 1lt6 h GLN 56 Cb 1.05 -0.07 0.02 0.00 -0.00 0.00 0.00 27.48 28.48 1lt6 h GLN 56 CO -0.00 0.78 0.46 -1.01 -0.00 0.00 0.00 178.83 179.06 1lt6 s HIS 57 N -4.82 3.54 0.67 0.06 3.76 -0.34 -5.03 115.29 113.12 1lt6 s HIS 57 Ca -0.09 1.70 -0.06 0.00 -0.15 0.00 0.00 55.06 56.47 1lt6 s HIS 57 Cb 0.14 -3.24 0.05 0.00 1.11 0.00 0.00 32.58 30.64 1lt6 s HIS 57 CO 0.81 -0.52 0.97 0.96 -0.85 0.00 0.00 174.74 176.11 1lt6 s ILE 58 N -1.25 2.54 0.22 0.60 -4.36 -1.26 -4.91 121.20 112.78 1lt6 s ILE 58 Ca 0.47 -0.26 -0.08 0.00 -0.26 0.00 0.00 60.65 60.51 1lt6 s ILE 58 Cb -0.30 -3.08 0.16 0.00 1.25 0.00 0.00 42.46 40.49 1lt6 s ILE 58 CO 0.38 -0.08 1.78 0.44 0.24 0.00 0.00 174.94 177.71 1lt6 h ASP 59 N -0.47 0.44 0.06 4.36 5.19 -1.98 -1.30 116.42 122.74 1lt6 h ASP 59 Ca -0.44 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1lt6 h ASP 59 Cb 1.30 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.79 1lt6 h ASP 59 CO 0.60 0.27 -0.01 0.77 -3.12 0.00 0.00 179.24 177.74 1lt6 h SER 60 N 0.59 0.00 1.36 6.45 4.64 -2.04 -2.62 113.55 121.94 1lt6 h SER 60 Ca 0.32 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.58 1lt6 h SER 60 Cb 0.31 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1lt6 h SER 60 CO -0.24 0.01 -0.29 1.56 -0.87 0.00 0.00 176.83 177.00 1lt6 h GLN 61 N 0.00 0.00 -0.46 4.77 4.20 -1.61 -3.34 115.11 118.66 1lt6 h GLN 61 Ca -0.00 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.75 1lt6 h GLN 61 Cb 0.05 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 1lt6 h GLN 61 CO 0.00 0.29 0.23 0.87 -0.67 0.00 0.00 178.83 179.54 1lt6 h LYS 62 N 0.00 0.44 -0.59 1.46 1.79 -1.51 0.43 116.57 118.58 1lt6 h LYS 62 Ca -0.00 -0.03 -0.09 0.00 -2.18 0.00 0.00 60.65 58.35 1lt6 h LYS 62 Cb 1.04 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.57 1lt6 h LYS 62 CO 0.04 0.29 0.00 -0.22 -1.08 0.00 0.00 179.45 178.48 1lt6 h LYS 63 N 0.45 1.05 -0.14 3.15 3.64 -1.76 -2.91 116.57 120.05 1lt6 h LYS 63 Ca 0.20 -0.33 -0.07 0.00 -1.27 0.00 0.00 60.65 59.18 1lt6 h LYS 63 Cb 0.12 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1lt6 h LYS 63 CO -0.15 1.03 -0.22 0.00 -2.27 0.00 0.00 179.45 177.83 1lt6 h ALA 64 N 0.98 1.37 -0.81 5.00 0.00 -1.54 -2.25 119.26 122.01 1lt6 h ALA 64 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1lt6 h ALA 64 Cb 0.55 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1lt6 h ALA 64 CO 0.03 0.44 0.45 0.82 0.00 0.00 0.00 179.25 180.98 1lt6 h ILE 65 N 0.22 1.24 -0.17 0.00 2.04 -0.73 -0.21 117.51 119.90 1lt6 h ILE 65 Ca 0.04 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 1lt6 h ILE 65 Cb 0.52 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1lt6 h ILE 65 CO 0.04 0.26 -0.06 -0.33 0.00 0.00 0.00 178.15 178.06 1lt6 h GLU 66 N 1.12 0.34 -0.43 2.37 4.39 -1.44 -1.74 114.58 119.19 1lt6 h GLU 66 Ca 0.29 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.85 1lt6 h GLU 66 Cb 0.02 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1lt6 h GLU 66 CO -0.05 0.64 0.28 -0.09 -1.16 0.00 0.00 179.01 178.63 1lt6 h ARG 67 N 0.03 0.53 -0.25 2.33 2.43 -1.09 -0.18 114.38 118.18 1lt6 h ARG 67 Ca 0.04 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1lt6 h ARG 67 Cb 0.52 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1lt6 h ARG 67 CO 0.02 0.35 -0.30 1.98 -1.51 0.00 0.00 179.97 180.52 1lt6 h MET 68 N 0.55 0.64 0.00 0.20 4.05 -0.84 0.24 114.93 119.78 1lt6 h MET 68 Ca 0.16 -0.36 -0.04 0.00 -0.28 0.00 0.00 59.70 59.18 1lt6 h MET 68 Cb -0.02 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 1lt6 h MET 68 CO -0.04 0.97 -0.21 0.87 0.23 0.00 0.00 176.91 178.73 1lt6 h LYS 69 N 0.36 0.00 0.01 0.39 1.57 -0.80 -0.06 116.57 118.05 1lt6 h LYS 69 Ca 0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1lt6 h LYS 69 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1lt6 h LYS 69 CO 0.07 0.21 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.72 1lt6 h ASP 70 N 0.00 -0.02 -0.79 0.86 3.32 -0.48 -2.89 116.42 116.44 1lt6 h ASP 70 Ca -0.00 -0.48 0.06 0.00 0.02 0.00 0.00 57.03 56.63 1lt6 h ASP 70 Cb 0.39 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1lt6 h ASP 70 CO 0.03 0.47 0.47 0.74 -1.72 0.00 0.00 179.24 179.23 1lt6 h THR 71 N -0.51 1.02 -0.67 0.35 2.02 0.03 -2.67 112.91 112.48 1lt6 h THR 71 Ca -0.00 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 1lt6 h THR 71 Cb 0.49 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 1lt6 h THR 71 CO 0.00 0.16 0.31 -0.07 0.37 0.00 0.00 175.52 176.29 1lt6 h LEU 72 N 0.87 0.89 0.22 2.58 3.38 -1.04 -0.69 115.31 121.52 1lt6 h LEU 72 Ca 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1lt6 h LEU 72 Cb 0.16 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1lt6 h LEU 72 CO -0.17 0.79 -0.10 -0.09 0.09 0.00 0.00 178.44 178.95 1lt6 h ARG 73 N 0.94 -0.28 -0.32 1.13 2.43 -1.26 -1.86 114.38 115.17 1lt6 h ARG 73 Ca 0.23 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.35 1lt6 h ARG 73 Cb 0.14 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1lt6 h ARG 73 CO -0.03 -0.12 -0.09 0.97 -1.51 0.00 0.00 179.97 179.19 1lt6 h ILE 74 N -0.38 1.22 -0.63 1.20 6.09 -1.45 -0.51 117.51 123.05 1lt6 h ILE 74 Ca -0.03 -0.97 -0.06 0.00 -1.37 0.00 0.00 64.86 62.44 1lt6 h ILE 74 Cb 0.29 1.08 -0.03 0.00 0.47 0.00 0.00 36.82 38.64 1lt6 h ILE 74 CO 0.05 0.32 0.17 0.74 -3.07 0.00 0.00 178.15 176.36 1lt6 h THR 75 N 0.49 1.25 -0.00 2.19 2.02 -0.99 -1.66 112.91 116.20 1lt6 h THR 75 Ca 0.09 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.38 1lt6 h THR 75 Cb 0.46 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1lt6 h THR 75 CO 0.02 0.34 0.00 0.22 0.37 0.00 0.00 175.52 176.47 1lt6 h TYR 76 N 0.91 0.01 -0.93 3.16 3.20 -0.89 0.43 116.97 122.86 1lt6 h TYR 76 Ca 0.20 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.15 1lt6 h TYR 76 Cb 0.33 -0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.53 1lt6 h TYR 76 CO 0.02 0.23 0.58 -0.07 -1.64 0.00 0.00 178.16 177.29 1lt6 h LEU 77 N -0.22 0.89 -0.96 2.82 3.38 -0.90 -1.25 115.31 119.06 1lt6 h LEU 77 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1lt6 h LEU 77 Cb 0.23 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1lt6 h LEU 77 CO 0.00 0.54 0.00 0.35 0.09 0.00 0.00 178.44 179.42 1lt6 n THR 78 N -4.61 0.21 -4.04 0.22 -2.24 -0.64 -4.94 114.28 98.24 1lt6 n THR 78 Ca 0.15 -0.31 -0.30 0.00 -2.27 0.00 0.00 64.05 61.33 1lt6 n THR 78 Cb 0.24 0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 1lt6 n THR 78 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1lt6 n GLU 79 N 0.18 -3.57 -3.01 -0.78 1.02 -0.47 -4.91 120.64 109.10 1lt6 n GLU 79 Ca 0.15 0.42 -0.40 0.00 -0.02 0.00 0.00 57.16 57.32 1lt6 n GLU 79 Cb 0.28 -4.86 -0.05 0.00 -0.02 0.00 0.00 31.44 26.80 1lt6 n GLU 79 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1lt6 s THR 80 N -3.64 4.75 0.06 2.62 2.01 0.04 -4.88 115.64 116.60 1lt6 s THR 80 Ca 0.34 1.58 -0.31 0.00 0.31 0.00 0.00 61.69 63.60 1lt6 s THR 80 Cb -0.18 -4.09 -0.07 0.00 0.01 0.00 0.00 72.50 68.17 1lt6 s THR 80 CO 0.89 0.37 1.49 -0.54 -0.69 0.00 0.00 174.62 176.15 1lt6 s LYS 81 N -0.09 4.26 -0.08 4.92 -0.14 -1.26 -4.50 119.74 122.83 1lt6 s LYS 81 Ca 0.37 2.14 -0.17 0.00 -1.36 0.00 0.00 55.97 56.95 1lt6 s LYS 81 Cb -0.20 -3.48 -0.05 0.00 -1.68 0.00 0.00 37.83 32.42 1lt6 s LYS 81 CO 0.22 -0.60 0.46 0.42 -0.76 0.00 0.00 175.35 175.10 1lt6 s ILE 82 N 2.09 5.13 -0.00 2.17 1.01 0.10 -4.26 121.20 127.44 1lt6 s ILE 82 Ca 0.68 0.94 -0.00 0.00 0.00 0.00 0.00 60.65 62.26 1lt6 s ILE 82 Cb -0.36 -3.80 -0.00 0.00 0.01 0.00 0.00 42.46 38.31 1lt6 s ILE 82 CO 0.30 0.39 -0.00 -0.78 0.00 0.00 0.00 174.94 174.84 1lt6 h ASP 83 N 6.20 0.00 -4.01 3.58 3.58 0.16 0.88 116.42 126.82 1lt6 h ASP 83 Ca -0.44 0.00 -0.46 0.00 0.42 0.00 0.00 57.03 56.56 1lt6 h ASP 83 Cb 1.19 0.00 -0.19 0.00 1.72 0.00 0.00 39.33 42.05 1lt6 h ASP 83 CO 0.72 0.02 -0.78 -0.54 -2.88 0.00 0.00 179.24 175.79 1lt6 s LYS 84 N -1.03 1.07 -0.01 0.28 1.02 -0.95 -1.60 119.74 118.52 1lt6 s LYS 84 Ca -0.00 -1.23 0.05 0.00 0.02 0.00 0.00 55.97 54.80 1lt6 s LYS 84 Cb 0.00 -1.06 -0.01 0.00 -0.52 0.00 0.00 37.83 36.24 1lt6 s LYS 84 CO 0.00 0.22 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.00 1lt6 s LEU 85 N -2.34 2.03 -0.17 3.17 1.43 0.06 -1.09 118.68 121.77 1lt6 s LEU 85 Ca 0.09 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1lt6 s LEU 85 Cb -0.06 -0.75 0.00 0.00 0.03 0.00 0.00 46.19 45.41 1lt6 s LEU 85 CO 0.04 0.18 -0.14 0.00 0.23 0.00 0.00 176.35 176.65 1lt6 s VAL 87 N 1.03 0.95 -0.25 0.00 -7.23 -0.65 -0.02 120.40 114.23 1lt6 s VAL 87 Ca -0.01 -2.02 -0.17 0.00 -1.81 0.00 0.00 61.98 57.97 1lt6 s VAL 87 Cb -0.15 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.81 1lt6 s VAL 87 CO -0.03 -0.64 0.48 0.26 -0.31 0.00 0.00 175.10 174.86 1lt6 s TRP 88 N -3.47 3.28 -0.32 2.82 0.51 0.92 -1.45 118.94 121.22 1lt6 s TRP 88 Ca 0.19 0.61 0.11 0.00 -2.12 0.00 0.00 56.10 54.89 1lt6 s TRP 88 Cb 0.04 -2.67 0.73 0.00 -0.81 0.00 0.00 33.47 30.76 1lt6 s TRP 88 CO 0.02 -0.23 1.69 0.27 -0.51 0.00 0.00 176.95 178.18 1lt6 n ASN 89 N 5.34 5.08 -1.34 2.95 0.23 -0.62 -1.81 115.26 125.09 1lt6 n ASN 89 Ca -0.05 -2.97 0.01 0.00 -0.53 0.00 0.00 54.58 51.04 1lt6 n ASN 89 Cb 0.50 -0.70 0.27 0.00 -2.08 0.00 0.00 39.78 37.77 1lt6 n ASN 89 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1lt6 n ASN 90 N 0.29 4.00 -3.84 0.53 6.94 -1.26 -4.93 115.26 116.99 1lt6 n ASN 90 Ca 0.31 -3.23 -0.11 0.00 -0.02 0.00 0.00 54.58 51.53 1lt6 n ASN 90 Cb 1.21 -0.63 -0.09 0.00 -2.36 0.00 0.00 39.78 37.90 1lt6 n ASN 90 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1lt6 s LYS 91 N -2.96 0.57 -0.04 -3.83 3.01 -1.26 -5.09 119.74 110.13 1lt6 s LYS 91 Ca 0.47 -0.41 -0.01 0.00 -1.01 0.00 0.00 55.97 55.02 1lt6 s LYS 91 Cb 0.39 0.24 0.03 0.00 -1.01 0.00 0.00 37.83 37.48 1lt6 s LYS 91 CO 0.09 -0.15 0.01 -0.08 0.51 0.00 0.00 175.35 175.73 1lt6 s THR 92 N -1.64 0.21 0.84 2.17 -1.32 -1.26 -3.02 115.64 111.62 1lt6 s THR 92 Ca -0.12 0.15 -0.11 0.00 -1.21 0.00 0.00 61.69 60.40 1lt6 s THR 92 Cb -0.06 -0.35 0.10 0.00 -1.51 0.00 0.00 72.50 70.69 1lt6 s THR 92 CO 0.01 0.19 1.10 -2.16 -2.21 0.00 0.00 174.62 171.55 1lt6 s PRO 93 N 1.51 1.65 0.23 7.08 0.04 -1.26 -5.07 135.00 139.17 1lt6 s PRO 93 Ca -0.03 1.19 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 1lt6 s PRO 93 Cb -0.13 -1.83 -0.16 0.00 0.04 0.00 0.00 34.50 32.43 1lt6 s PRO 93 CO -0.03 -2.08 0.80 0.09 0.04 0.00 0.00 177.00 175.82 1lt6 n ASN 94 N -3.82 0.09 -4.65 6.66 5.03 -1.17 -4.51 115.26 112.90 1lt6 n ASN 94 Ca 0.09 1.15 -0.38 0.00 0.87 0.00 0.00 54.58 56.31 1lt6 n ASN 94 Cb 0.53 -1.12 -0.09 0.00 -1.02 0.00 0.00 39.78 38.09 1lt6 n ASN 94 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1lt6 s SER 95 N -0.70 6.30 0.13 6.41 0.15 -0.75 -1.50 113.70 123.73 1lt6 s SER 95 Ca 0.63 0.34 -0.31 0.00 0.70 0.00 0.00 55.95 57.31 1lt6 s SER 95 Cb -0.84 -2.19 -0.08 0.00 -1.71 0.00 0.00 66.02 61.20 1lt6 s SER 95 CO 0.57 -0.08 1.44 -0.63 1.20 0.00 0.00 173.24 175.75 1lt6 s ILE 96 N 1.51 3.13 -0.07 6.45 1.01 -0.41 -0.06 121.20 132.76 1lt6 s ILE 96 Ca 0.15 0.80 0.05 0.00 0.00 0.00 0.00 60.65 61.66 1lt6 s ILE 96 Cb -0.15 -3.52 -0.08 0.00 0.01 0.00 0.00 42.46 38.72 1lt6 s ILE 96 CO 0.08 0.06 0.00 0.00 0.00 0.00 0.00 174.94 175.08 1lt6 n ALA 97 N 3.99 1.82 -3.42 9.38 0.00 0.97 -4.90 120.51 128.35 1lt6 n ALA 97 Ca 0.12 -0.46 -0.14 0.00 0.00 0.00 0.00 53.44 52.96 1lt6 n ALA 97 Cb 0.41 0.13 -0.04 0.00 0.00 0.00 0.00 19.45 19.96 1lt6 n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lt6 s ALA 98 N -2.17 -1.58 0.07 0.00 0.00 -0.99 -4.99 121.76 112.10 1lt6 s ALA 98 Ca -0.05 0.75 0.02 0.00 0.00 0.00 0.00 51.96 52.68 1lt6 s ALA 98 Cb 0.02 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.62 1lt6 s ALA 98 CO 0.28 -0.59 -0.07 0.96 0.00 0.00 0.00 175.76 176.34 1lt6 s ILE 99 N -2.70 0.58 -0.07 0.00 -5.25 -1.26 -1.64 121.20 110.86 1lt6 s ILE 99 Ca -0.04 -1.52 -0.04 0.00 -0.99 0.00 0.00 60.65 58.06 1lt6 s ILE 99 Cb -0.01 -1.16 0.03 0.00 2.95 0.00 0.00 42.46 44.28 1lt6 s ILE 99 CO -0.04 -0.66 0.16 -0.94 -1.79 0.00 0.00 174.94 171.68 1lt6 s SER 100 N -2.35 -0.15 0.15 4.36 1.04 -0.25 -4.99 113.70 111.51 1lt6 s SER 100 Ca 0.01 0.34 0.10 0.00 0.48 0.00 0.00 55.95 56.89 1lt6 s SER 100 Cb -0.02 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.33 1lt6 s SER 100 CO -0.03 -0.12 -0.22 -0.04 0.98 0.00 0.00 173.24 173.81 1lt6 s MET 101 N 0.84 1.58 0.20 4.02 -1.94 -1.26 0.85 119.30 123.60 1lt6 s MET 101 Ca -0.06 -1.35 -0.23 0.00 -1.71 0.00 0.00 55.69 52.34 1lt6 s MET 101 Cb -0.08 -1.96 0.05 0.00 2.01 0.00 0.00 34.83 34.85 1lt6 s MET 101 CO -0.04 0.44 0.75 0.21 -0.01 0.00 0.00 175.02 176.36 1lt6 s LYS 102 N -2.33 1.48 0.00 2.03 2.36 -1.26 -4.87 119.74 117.15 1lt6 s LYS 102 Ca 0.18 -0.74 0.00 0.00 -2.55 0.00 0.00 55.97 52.85 1lt6 s LYS 102 Cb -0.09 0.55 0.00 0.00 -1.05 0.00 0.00 37.83 37.24 1lt6 s LYS 102 CO 0.09 -0.67 0.00 0.09 1.55 0.00 0.00 175.35 176.41