#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ai7 n SER 4 N 0.00 0.70 -0.15 -3.46 7.64 -1.26 -3.45 113.62 113.64 1ai7 n SER 4 Ca 0.00 0.55 0.10 0.00 1.01 0.00 0.00 58.87 60.53 1ai7 n SER 4 Cb 0.00 -0.72 -0.08 0.00 -1.01 0.00 0.00 64.21 62.40 1ai7 n SER 4 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ai7 n SER 5 N -2.15 1.26 -4.75 6.43 3.41 -1.26 -4.82 113.62 111.74 1ai7 n SER 5 Ca 0.06 -1.13 -0.40 0.00 -0.26 0.00 0.00 58.87 57.14 1ai7 n SER 5 Cb 0.42 0.84 -0.05 0.00 -0.26 0.00 0.00 64.21 65.16 1ai7 n SER 5 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ai7 s GLU 6 N -2.75 4.47 -0.16 4.33 2.12 -1.22 -5.06 118.70 120.43 1ai7 s GLU 6 Ca 0.11 1.01 0.00 0.00 0.36 0.00 0.00 54.97 56.45 1ai7 s GLU 6 Cb 0.16 -3.37 0.02 0.00 0.26 0.00 0.00 34.13 31.21 1ai7 s GLU 6 CO 0.74 0.28 -0.14 0.42 -0.54 0.00 0.00 175.26 176.02 1ai7 s ILE 7 N -0.02 1.62 -0.18 -3.70 1.01 -1.26 -4.54 121.20 114.13 1ai7 s ILE 7 Ca 0.37 -0.69 -0.08 0.00 0.00 0.00 0.00 60.65 60.26 1ai7 s ILE 7 Cb -0.20 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 1ai7 s ILE 7 CO 0.22 0.44 0.07 -0.75 0.00 0.00 0.00 174.94 174.92 1ai7 s LYS 8 N 1.46 3.97 -0.28 2.79 2.20 -0.42 -4.97 119.74 124.49 1ai7 s LYS 8 Ca 0.04 -0.33 -0.00 0.00 -0.36 0.00 0.00 55.97 55.32 1ai7 s LYS 8 Cb -0.13 -3.22 0.05 0.00 -1.51 0.00 0.00 37.83 33.02 1ai7 s LYS 8 CO -0.11 0.29 -0.04 0.42 -0.36 0.00 0.00 175.35 175.55 1ai7 s ILE 9 N 0.32 2.69 -0.21 5.43 1.01 -1.26 -1.28 121.20 127.90 1ai7 s ILE 9 Ca 0.04 -1.47 -0.07 0.00 0.00 0.00 0.00 60.65 59.15 1ai7 s ILE 9 Cb -0.12 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 1ai7 s ILE 9 CO -0.00 -0.07 0.06 -0.69 0.00 0.00 0.00 174.94 174.24 1ai7 s VAL 10 N 1.20 4.49 -0.11 2.92 1.01 -0.80 -4.93 120.40 124.18 1ai7 s VAL 10 Ca -0.07 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 1ai7 s VAL 10 Cb -0.20 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1ai7 s VAL 10 CO -0.03 0.40 0.12 -0.13 0.00 0.00 0.00 175.10 175.46 1ai7 s ARG 11 N 0.98 3.37 0.03 2.72 0.52 -1.26 -0.02 118.95 125.29 1ai7 s ARG 11 Ca 0.04 -0.18 -0.00 0.00 -0.52 0.00 0.00 55.73 55.06 1ai7 s ARG 11 Cb -0.14 -3.12 0.01 0.00 0.52 0.00 0.00 34.95 32.21 1ai7 s ARG 11 CO 0.03 0.76 0.04 -0.40 0.02 0.00 0.00 175.30 175.75 1ai7 n ASP 12 N 2.03 0.02 0.29 0.23 5.75 -0.48 -4.84 116.55 119.55 1ai7 n ASP 12 Ca -0.20 -1.02 0.19 0.00 -0.01 0.00 0.00 54.79 53.75 1ai7 n ASP 12 Cb 0.55 -0.03 0.98 0.00 -1.03 0.00 0.00 41.12 41.59 1ai7 n ASP 12 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1ai7 h GLU 13 N 0.00 0.00 -0.49 0.11 3.07 -2.00 0.84 114.58 116.11 1ai7 h GLU 13 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1ai7 h GLU 13 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1ai7 h GLU 13 CO 0.01 0.00 0.00 0.66 -1.40 0.00 0.00 179.01 178.28 1ai7 n TYR 14 N -2.88 0.64 -0.55 4.33 4.01 -1.26 -4.93 117.16 116.52 1ai7 n TYR 14 Ca -0.02 -0.36 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1ai7 n TYR 14 Cb 0.11 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1ai7 n TYR 14 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ai7 n GLY 15 N 1.38 0.75 3.67 2.72 0.00 0.29 -5.00 105.19 109.00 1ai7 n GLY 15 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1ai7 n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ai7 s MET 16 N -0.45 4.28 0.13 1.61 0.00 -1.26 -4.62 119.30 118.99 1ai7 s MET 16 Ca 0.00 1.75 -0.30 0.00 0.00 0.00 0.00 55.69 57.14 1ai7 s MET 16 Cb 0.00 -3.68 -0.06 0.00 0.00 0.00 0.00 34.83 31.09 1ai7 s MET 16 CO 0.00 -0.60 0.98 -1.25 0.00 0.00 0.00 175.02 174.15 1ai7 s PRO 17 N 2.91 4.69 -0.13 4.11 0.04 -1.26 -1.38 135.00 143.97 1ai7 s PRO 17 Ca 0.58 1.50 0.01 0.00 0.04 0.00 0.00 61.00 63.12 1ai7 s PRO 17 Cb -0.25 -3.36 -0.01 0.00 0.04 0.00 0.00 34.50 30.92 1ai7 s PRO 17 CO 0.20 0.20 -0.16 -1.01 0.04 0.00 0.00 177.00 176.27 1ai7 s HIS 18 N -0.07 2.76 -0.19 0.56 3.76 0.97 -4.99 115.29 118.09 1ai7 s HIS 18 Ca 0.47 -0.83 -0.06 0.00 -0.15 0.00 0.00 55.06 54.48 1ai7 s HIS 18 Cb -0.24 -1.83 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 1ai7 s HIS 18 CO 0.31 -0.33 0.04 0.42 -0.85 0.00 0.00 174.74 174.33 1ai7 s ILE 19 N 0.49 4.46 -0.20 0.60 -1.09 -1.26 -1.90 121.20 122.30 1ai7 s ILE 19 Ca -0.11 -0.15 -0.01 0.00 -2.23 0.00 0.00 60.65 58.15 1ai7 s ILE 19 Cb -0.16 -3.01 0.01 0.00 -1.58 0.00 0.00 42.46 37.72 1ai7 s ILE 19 CO 0.05 0.45 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.77 1ai7 s TYR 20 N 0.60 2.88 0.20 3.97 2.02 -0.40 -5.01 117.35 121.60 1ai7 s TYR 20 Ca 0.02 -1.32 -0.16 0.00 -0.37 0.00 0.00 57.07 55.24 1ai7 s TYR 20 Cb -0.13 -2.01 0.02 0.00 -0.40 0.00 0.00 41.96 39.43 1ai7 s TYR 20 CO 0.02 -0.68 0.49 0.00 -1.57 0.00 0.00 175.55 173.80 1ai7 s ALA 21 N 1.38 -0.74 -0.42 3.71 0.00 -1.26 -1.31 121.76 123.12 1ai7 s ALA 21 Ca 0.05 -0.39 0.11 0.00 0.00 0.00 0.00 51.96 51.73 1ai7 s ALA 21 Cb -0.14 0.87 -0.12 0.00 0.00 0.00 0.00 23.12 23.73 1ai7 s ALA 21 CO -0.08 -0.79 0.42 0.09 0.00 0.00 0.00 175.76 175.39 1ai7 n ASN 22 N -0.33 0.81 -4.10 0.00 4.13 -1.26 -4.91 115.26 109.61 1ai7 n ASN 22 Ca -0.09 -0.63 -0.11 0.00 1.68 0.00 0.00 54.58 55.43 1ai7 n ASN 22 Cb 0.62 1.08 -0.08 0.00 -1.54 0.00 0.00 39.78 39.86 1ai7 n ASN 22 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 1ai7 s ASP 23 N -2.20 0.12 0.11 6.41 1.47 -1.26 -5.07 116.67 116.25 1ai7 s ASP 23 Ca 0.03 -1.25 -0.29 0.00 1.18 0.00 0.00 52.55 52.22 1ai7 s ASP 23 Cb 0.08 0.46 -0.09 0.00 -0.34 0.00 0.00 42.92 43.02 1ai7 s ASP 23 CO 0.44 -0.95 1.62 0.74 0.68 0.00 0.00 175.17 177.70 1ai7 h THR 24 N 2.48 0.34 -0.93 2.11 2.02 -1.96 -0.13 112.91 116.84 1ai7 h THR 24 Ca -0.32 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.91 1ai7 h THR 24 Cb 1.25 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.94 1ai7 h THR 24 CO 0.47 0.00 0.60 -0.25 0.37 0.00 0.00 175.52 176.71 1ai7 h TRP 25 N -0.56 1.09 -0.27 3.16 7.01 -1.94 -1.59 115.95 122.85 1ai7 h TRP 25 Ca 0.02 0.03 -0.16 0.00 2.11 0.00 0.00 58.89 60.89 1ai7 h TRP 25 Cb 0.57 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 27.26 1ai7 h TRP 25 CO -0.26 0.59 -0.47 0.45 -2.79 0.00 0.00 178.44 175.96 1ai7 h HIS 26 N 1.09 0.88 0.58 2.65 3.86 -1.84 -1.94 115.15 120.43 1ai7 h HIS 26 Ca 0.39 -0.28 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1ai7 h HIS 26 Cb 0.14 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1ai7 h HIS 26 CO -0.00 1.05 -0.36 1.25 0.86 0.00 0.00 177.93 180.73 1ai7 h LEU 27 N 0.57 -0.90 -0.22 2.43 5.85 -0.20 -1.56 115.31 121.27 1ai7 h LEU 27 Ca 0.03 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1ai7 h LEU 27 Cb 1.03 0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1ai7 h LEU 27 CO 0.10 -0.56 0.00 0.49 -0.34 0.00 0.00 178.44 178.13 1ai7 n PHE 28 N -5.50 0.61 -0.06 1.25 3.72 -0.68 -2.04 117.46 114.77 1ai7 n PHE 28 Ca -0.12 0.20 -0.14 0.00 -0.05 0.00 0.00 57.45 57.34 1ai7 n PHE 28 Cb 0.39 -0.83 -0.07 0.00 -0.94 0.00 0.00 39.48 38.03 1ai7 n PHE 28 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 1ai7 h TYR 29 N 0.00 0.61 -0.48 1.38 5.03 -1.16 -1.80 116.97 120.55 1ai7 h TYR 29 Ca 0.00 -0.20 0.07 0.00 2.58 0.00 0.00 58.73 61.18 1ai7 h TYR 29 Cb 0.51 -0.12 -0.06 0.00 1.55 0.00 0.00 36.73 38.61 1ai7 h TYR 29 CO 0.00 0.90 0.14 0.78 -1.32 0.00 0.00 178.16 178.67 1ai7 h GLY 30 N 0.14 0.62 0.88 1.82 0.00 -0.68 -1.62 103.07 104.23 1ai7 h GLY 30 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ai7 h GLY 30 CO 0.06 -0.02 -0.11 -1.82 0.00 0.00 0.00 176.54 174.65 1ai7 h TYR 31 N 0.30 -0.29 -0.74 5.60 5.03 -1.36 -2.00 116.97 123.52 1ai7 h TYR 31 Ca 0.23 0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.58 1ai7 h TYR 31 Cb 0.27 0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.62 1ai7 h TYR 31 CO -0.18 -0.18 0.49 0.78 -1.32 0.00 0.00 178.16 177.75 1ai7 h GLY 32 N -0.26 1.03 1.00 1.82 0.00 -1.20 -1.62 103.07 103.83 1ai7 h GLY 32 Ca -0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.88 1ai7 h GLY 32 CO -0.02 0.32 -0.09 -1.82 0.00 0.00 0.00 176.54 174.92 1ai7 h TYR 33 N 0.91 0.92 0.00 5.60 3.20 -0.88 -2.04 116.97 124.68 1ai7 h TYR 33 Ca 0.29 -0.20 -0.10 0.00 3.14 0.00 0.00 58.73 61.87 1ai7 h TYR 33 Cb 0.04 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 1ai7 h TYR 33 CO -0.00 0.93 -0.45 -0.39 -1.64 0.00 0.00 178.16 176.60 1ai7 h VAL 34 N 0.65 0.99 -0.38 1.81 -1.51 -1.02 -1.93 116.25 114.86 1ai7 h VAL 34 Ca 0.11 -1.79 -0.08 0.00 -1.23 0.00 0.00 66.70 63.71 1ai7 h VAL 34 Cb 0.63 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 31.85 1ai7 h VAL 34 CO 0.04 0.44 -0.08 0.58 -1.23 0.00 0.00 177.57 177.32 1ai7 h VAL 35 N 0.00 1.28 -0.31 7.19 2.07 -1.21 -0.01 116.25 125.25 1ai7 h VAL 35 Ca -0.00 -1.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1ai7 h VAL 35 Cb 1.04 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1ai7 h VAL 35 CO 0.06 0.38 0.05 0.00 0.02 0.00 0.00 177.57 178.08 1ai7 h ALA 36 N 0.84 1.51 -0.12 1.67 0.00 -1.24 0.13 119.26 122.05 1ai7 h ALA 36 Ca 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ai7 h ALA 36 Cb 0.59 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ai7 h ALA 36 CO 0.04 0.36 -0.08 1.96 0.00 0.00 0.00 179.25 181.52 1ai7 h GLN 37 N 0.44 0.26 0.14 0.00 4.20 -0.54 -3.27 115.11 116.34 1ai7 h GLN 37 Ca 0.10 -0.12 -0.31 0.00 0.06 0.00 0.00 58.65 58.38 1ai7 h GLN 37 Cb 0.22 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1ai7 h GLN 37 CO 0.00 0.63 -1.48 -0.44 -0.67 0.00 0.00 178.83 176.87 1ai7 h ASP 38 N -0.11 0.45 -0.29 1.46 3.32 -0.86 -3.42 116.42 116.97 1ai7 h ASP 38 Ca 0.02 -0.58 -0.23 0.00 0.02 0.00 0.00 57.03 56.26 1ai7 h ASP 38 Cb 0.57 -0.15 -0.38 0.00 0.22 0.00 0.00 39.33 39.59 1ai7 h ASP 38 CO 0.02 1.47 -1.04 0.54 -1.72 0.00 0.00 179.24 178.51 1ai7 n ARG 39 N -3.50 1.30 0.21 3.56 5.12 0.45 -4.96 116.66 118.85 1ai7 n ARG 39 Ca -0.15 -3.06 -0.15 0.00 -1.93 0.00 0.00 57.85 52.56 1ai7 n ARG 39 Cb 1.05 -1.14 -0.07 0.00 -1.16 0.00 0.00 32.46 31.14 1ai7 n ARG 39 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1ai7 h LEU 40 N 1.98 -0.77 -0.57 0.55 5.85 -1.62 -0.58 115.31 120.15 1ai7 h LEU 40 Ca -0.12 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1ai7 h LEU 40 Cb 1.48 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.74 1ai7 h LEU 40 CO 0.19 -0.42 0.37 0.15 -0.34 0.00 0.00 178.44 178.39 1ai7 h PHE 41 N -0.63 0.72 -0.72 1.25 3.57 -1.92 -1.05 116.94 118.16 1ai7 h PHE 41 Ca -0.02 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1ai7 h PHE 41 Cb 0.57 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 1ai7 h PHE 41 CO -0.16 0.47 0.43 0.37 -2.23 0.00 0.00 178.31 177.18 1ai7 h GLN 42 N 0.77 0.78 -0.46 1.11 4.15 -1.91 -0.66 115.11 118.89 1ai7 h GLN 42 Ca 0.21 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.48 1ai7 h GLN 42 Cb -0.08 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.42 1ai7 h GLN 42 CO -0.04 0.51 -0.13 0.52 -1.93 0.00 0.00 178.83 177.76 1ai7 h MET 43 N 0.80 0.84 -0.18 1.69 2.86 -0.93 0.12 114.93 120.14 1ai7 h MET 43 Ca 0.31 -0.30 -0.14 0.00 -2.06 0.00 0.00 59.70 57.52 1ai7 h MET 43 Cb 0.14 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1ai7 h MET 43 CO -0.16 0.92 -0.47 1.49 1.06 0.00 0.00 176.91 179.76 1ai7 h GLU 44 N 0.76 0.46 0.00 1.72 4.57 -0.73 0.36 114.58 121.71 1ai7 h GLU 44 Ca 0.12 -0.25 -0.18 0.00 -1.18 0.00 0.00 59.36 57.87 1ai7 h GLU 44 Cb 0.64 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 1ai7 h GLU 44 CO 0.04 0.83 -0.85 0.52 -1.18 0.00 0.00 179.01 178.38 1ai7 h MET 45 N 0.37 0.04 -0.21 1.92 2.86 -0.69 -1.94 114.93 117.28 1ai7 h MET 45 Ca 0.02 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.46 1ai7 h MET 45 Cb 0.97 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.63 1ai7 h MET 45 CO 0.08 0.86 -0.51 0.00 1.06 0.00 0.00 176.91 178.40 1ai7 h ALA 46 N 1.12 0.71 -0.77 6.32 0.00 -0.59 -0.33 119.26 125.72 1ai7 h ALA 46 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1ai7 h ALA 46 Cb 1.49 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 1ai7 h ALA 46 CO 0.11 0.68 0.50 -0.09 0.00 0.00 0.00 179.25 180.45 1ai7 h ARG 47 N 0.46 1.03 -0.03 0.00 2.43 -0.73 -0.96 114.38 116.58 1ai7 h ARG 47 Ca 0.02 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1ai7 h ARG 47 Cb 1.06 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 1ai7 h ARG 47 CO 0.10 0.70 -0.57 0.00 -1.51 0.00 0.00 179.97 178.68 1ai7 h ARG 48 N 1.05 0.09 -0.19 0.20 3.08 -1.04 -2.77 114.38 114.79 1ai7 h ARG 48 Ca 0.28 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 1ai7 h ARG 48 Cb -0.09 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 1ai7 h ARG 48 CO -0.06 0.63 -0.28 0.77 -1.07 0.00 0.00 179.97 179.97 1ai7 h SER 49 N 0.06 0.57 1.30 7.04 0.02 -0.68 0.12 113.55 121.99 1ai7 h SER 49 Ca -0.00 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 1ai7 h SER 49 Cb 1.03 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1ai7 h SER 49 CO 0.08 0.98 0.00 0.71 -1.14 0.00 0.00 176.83 177.46 1ai7 h THR 50 N 0.18 0.00 -0.01 -2.27 1.35 -1.11 -3.14 112.91 107.91 1ai7 h THR 50 Ca 0.02 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1ai7 h THR 50 Cb 0.85 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1ai7 h THR 50 CO 0.06 0.00 -0.19 0.00 -0.25 0.00 0.00 175.52 175.14 1ai7 n GLN 51 N -2.68 2.20 -2.60 4.72 6.02 -1.05 -4.82 117.38 119.17 1ai7 n GLN 51 Ca 0.03 -0.55 -0.08 0.00 -0.01 0.00 0.00 57.00 56.39 1ai7 n GLN 51 Cb 0.37 -1.04 0.04 0.00 1.02 0.00 0.00 30.24 30.63 1ai7 n GLN 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ai7 n GLY 52 N 0.86 0.03 1.53 1.08 0.00 0.22 -4.73 105.19 104.18 1ai7 n GLY 52 Ca 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 1ai7 n GLY 52 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ai7 n THR 53 N -2.45 1.61 0.06 2.61 -2.24 -0.07 -4.76 114.28 109.03 1ai7 n THR 53 Ca -0.12 -2.90 -0.18 0.00 -2.27 0.00 0.00 64.05 58.59 1ai7 n THR 53 Cb 0.58 0.09 -0.08 0.00 -2.10 0.00 0.00 70.33 68.81 1ai7 n THR 53 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ai7 h VAL 54 N 3.48 1.33 0.00 2.28 2.07 -1.90 -3.24 116.25 120.27 1ai7 h VAL 54 Ca 0.01 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.15 1ai7 h VAL 54 Cb 1.39 2.44 -0.00 0.00 -1.52 0.00 0.00 31.29 33.60 1ai7 h VAL 54 CO 0.24 0.72 -0.06 0.00 0.02 0.00 0.00 177.57 178.49 1ai7 h ALA 55 N 0.53 1.12 -0.32 1.67 0.00 -1.79 0.11 119.26 120.58 1ai7 h ALA 55 Ca -0.12 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1ai7 h ALA 55 Cb 1.68 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 1ai7 h ALA 55 CO 0.19 0.07 -0.06 0.93 0.00 0.00 0.00 179.25 180.39 1ai7 h GLU 56 N 0.00 0.51 0.00 0.00 5.08 -1.87 0.17 114.58 118.47 1ai7 h GLU 56 Ca -0.00 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1ai7 h GLU 56 Cb 0.32 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1ai7 h GLU 56 CO 0.01 0.58 -0.94 1.33 -1.00 0.00 0.00 179.01 178.99 1ai7 n VAL 57 N -4.24 0.00 -0.00 3.13 0.24 -0.93 -4.69 118.33 111.83 1ai7 n VAL 57 Ca 0.01 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1ai7 n VAL 57 Cb 0.28 0.73 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 1ai7 n VAL 57 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ai7 n LEU 58 N -1.52 0.06 0.00 1.34 4.77 -0.02 -5.00 117.00 116.62 1ai7 n LEU 58 Ca 0.01 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1ai7 n LEU 58 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1ai7 n LEU 58 CO 0.26 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1ai7 n GLY 59 N 0.93 -1.63 0.27 -0.72 0.00 0.57 -4.67 105.19 99.95 1ai7 n GLY 59 Ca 0.00 -2.06 0.09 0.00 0.00 0.00 0.00 46.02 44.04 1ai7 n GLY 59 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ai7 h LYS 60 N 0.28 0.01 0.00 1.61 2.10 -1.98 -2.10 116.57 116.51 1ai7 h LYS 60 Ca 0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1ai7 h LYS 60 Cb 0.00 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1ai7 h LYS 60 CO 0.00 0.01 0.00 -0.44 -2.00 0.00 0.00 179.45 177.02 1ai7 h ASP 61 N 0.01 0.00 -0.52 7.07 3.32 -1.97 -3.02 116.42 121.31 1ai7 h ASP 61 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ai7 h ASP 61 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1ai7 h ASP 61 CO -0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 1ai7 n PHE 62 N -2.99 0.69 -0.18 4.55 3.01 -0.79 -4.60 117.46 117.16 1ai7 n PHE 62 Ca -0.01 -0.42 -0.10 0.00 1.01 0.00 0.00 57.45 57.93 1ai7 n PHE 62 Cb 0.18 -0.01 0.01 0.00 -0.01 0.00 0.00 39.48 39.64 1ai7 n PHE 62 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1ai7 h VAL 63 N 3.64 1.27 -0.33 -4.37 2.07 -1.68 -1.11 116.25 115.73 1ai7 h VAL 63 Ca 0.00 -1.18 -0.09 0.00 0.82 0.00 0.00 66.70 66.25 1ai7 h VAL 63 Cb 0.90 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1ai7 h VAL 63 CO 0.00 0.42 -0.13 0.50 0.02 0.00 0.00 177.57 178.37 1ai7 h LYS 64 N 0.81 0.68 -0.19 1.57 3.64 -1.83 -1.73 116.57 119.53 1ai7 h LYS 64 Ca 0.14 -0.29 0.05 0.00 -1.27 0.00 0.00 60.65 59.28 1ai7 h LYS 64 Cb 0.60 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.35 1ai7 h LYS 64 CO 0.04 0.88 -0.13 0.35 -2.27 0.00 0.00 179.45 178.31 1ai7 h PHE 65 N 0.46 -0.32 -0.21 1.91 3.57 -1.84 0.44 116.94 120.96 1ai7 h PHE 65 Ca 0.08 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1ai7 h PHE 65 Cb 0.66 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 1ai7 h PHE 65 CO 0.06 -0.19 0.12 -0.44 -2.23 0.00 0.00 178.31 175.63 1ai7 h ASP 66 N -0.13 0.20 -0.96 0.41 3.32 -1.06 -1.65 116.42 116.56 1ai7 h ASP 66 Ca 0.11 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1ai7 h ASP 66 Cb 0.29 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 1ai7 h ASP 66 CO -0.27 0.15 0.61 0.11 -1.72 0.00 0.00 179.24 178.12 1ai7 h LYS 67 N 0.25 1.28 -0.71 3.56 1.57 -0.93 -2.21 116.57 119.39 1ai7 h LYS 67 Ca 0.08 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1ai7 h LYS 67 Cb -0.01 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 31.99 1ai7 h LYS 67 CO -0.03 0.87 0.19 -0.44 -0.57 0.00 0.00 179.45 179.47 1ai7 h ASP 68 N 1.31 1.06 -0.23 0.86 3.32 -0.22 -1.63 116.42 120.88 1ai7 h ASP 68 Ca 0.35 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1ai7 h ASP 68 Cb -0.11 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.15 1ai7 h ASP 68 CO -0.07 1.01 0.10 0.40 -1.72 0.00 0.00 179.24 178.96 1ai7 h ILE 69 N 1.06 1.16 -0.12 0.35 1.08 -0.91 -2.98 117.51 117.15 1ai7 h ILE 69 Ca 0.22 -0.46 -0.10 0.00 -0.39 0.00 0.00 64.86 64.13 1ai7 h ILE 69 Cb 0.35 1.03 -0.01 0.00 -3.07 0.00 0.00 36.82 35.12 1ai7 h ILE 69 CO -0.00 0.16 -0.37 0.03 -0.69 0.00 0.00 178.15 177.27 1ai7 h ARG 70 N 0.23 0.25 -0.04 2.37 3.08 -1.28 -1.94 114.38 117.04 1ai7 h ARG 70 Ca 0.08 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.03 1ai7 h ARG 70 Cb 0.15 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1ai7 h ARG 70 CO -0.01 0.59 0.04 0.00 -1.07 0.00 0.00 179.97 179.52 1ai7 h ARG 71 N 0.21 0.00 -0.62 0.04 3.08 -1.20 -3.17 114.38 112.72 1ai7 h ARG 71 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ai7 h ARG 71 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1ai7 h ARG 71 CO 0.06 0.00 0.00 -1.71 -1.07 0.00 0.00 179.97 177.25 1ai7 n ASN 72 N -4.14 3.52 -3.45 7.04 5.15 -0.73 -4.93 115.26 117.72 1ai7 n ASN 72 Ca -0.02 -2.13 -0.09 0.00 -0.60 0.00 0.00 54.58 51.75 1ai7 n ASN 72 Cb 0.14 -0.45 -0.01 0.00 -0.53 0.00 0.00 39.78 38.93 1ai7 n ASN 72 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1ai7 s TYR 73 N -1.40 0.12 -0.32 1.20 1.13 -1.20 -5.11 117.35 111.77 1ai7 s TYR 73 Ca 0.41 -0.63 0.00 0.00 -1.41 0.00 0.00 57.07 55.44 1ai7 s TYR 73 Cb 0.23 0.62 0.10 0.00 -1.10 0.00 0.00 41.96 41.82 1ai7 s TYR 73 CO 0.25 -1.33 0.10 -0.46 -2.51 0.00 0.00 175.55 171.60 1ai7 s TRP 74 N -3.22 1.99 0.23 -3.49 -0.11 -1.26 -4.96 118.94 108.13 1ai7 s TRP 74 Ca 0.16 -1.96 -0.06 0.00 1.22 0.00 0.00 56.10 55.47 1ai7 s TRP 74 Cb -0.04 -1.89 0.34 0.00 -1.50 0.00 0.00 33.47 30.38 1ai7 s TRP 74 CO 0.10 -0.88 1.81 -1.00 -4.62 0.00 0.00 176.95 172.37 1ai7 h PRO 75 N 7.92 0.76 -0.95 5.86 0.13 -2.00 -2.08 132.00 141.63 1ai7 h PRO 75 Ca -0.11 -0.05 0.08 0.00 -0.87 0.00 0.00 66.00 65.05 1ai7 h PRO 75 Cb 1.01 -0.17 -0.07 0.00 0.13 0.00 0.00 31.00 31.90 1ai7 h PRO 75 CO 0.48 0.50 0.61 -0.44 -0.23 0.00 0.00 178.00 178.92 1ai7 h ASP 76 N 0.78 0.94 -0.38 1.44 3.32 -1.99 -0.37 116.42 120.15 1ai7 h ASP 76 Ca 0.37 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 1ai7 h ASP 76 Cb 0.29 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1ai7 h ASP 76 CO -0.22 0.58 0.22 0.00 -1.72 0.00 0.00 179.24 178.10 1ai7 h ALA 77 N 1.50 1.62 -0.14 3.45 0.00 -1.81 -0.15 119.26 123.73 1ai7 h ALA 77 Ca 0.42 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.13 1ai7 h ALA 77 Cb 0.25 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ai7 h ALA 77 CO -0.17 0.32 -0.43 0.82 0.00 0.00 0.00 179.25 179.79 1ai7 h ILE 78 N 0.56 1.35 -0.75 0.00 1.08 -1.10 -2.80 117.51 115.85 1ai7 h ILE 78 Ca 0.15 -1.71 -0.02 0.00 -0.39 0.00 0.00 64.86 62.89 1ai7 h ILE 78 Cb 0.02 2.05 -0.04 0.00 -3.07 0.00 0.00 36.82 35.78 1ai7 h ILE 78 CO -0.02 0.52 0.39 0.03 -0.69 0.00 0.00 178.15 178.37 1ai7 h ARG 79 N 0.17 1.05 -0.09 2.37 3.08 -0.97 -0.72 114.38 119.27 1ai7 h ARG 79 Ca -0.01 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 59.86 1ai7 h ARG 79 Cb 1.05 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 1ai7 h ARG 79 CO 0.09 0.79 -0.19 0.00 -1.07 0.00 0.00 179.97 179.60 1ai7 h ALA 80 N 1.37 1.53 -0.04 0.04 0.00 -1.03 0.72 119.26 121.85 1ai7 h ALA 80 Ca 0.26 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1ai7 h ALA 80 Cb 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ai7 h ALA 80 CO -0.04 0.34 -0.64 1.96 0.00 0.00 0.00 179.25 180.87 1ai7 h GLN 81 N 0.13 0.17 -0.08 0.00 4.20 -0.88 -2.88 115.11 115.77 1ai7 h GLN 81 Ca 0.03 -0.13 -0.24 0.00 0.06 0.00 0.00 58.65 58.36 1ai7 h GLN 81 Cb 0.41 0.02 0.02 0.00 0.30 0.00 0.00 27.48 28.23 1ai7 h GLN 81 CO 0.03 0.76 -0.90 0.82 -0.67 0.00 0.00 178.83 178.86 1ai7 h ILE 82 N 0.12 1.28 0.00 2.54 2.04 -0.61 -3.02 117.51 119.85 1ai7 h ILE 82 Ca -0.01 -2.10 -0.01 0.00 1.00 0.00 0.00 64.86 63.74 1ai7 h ILE 82 Cb 1.16 2.16 -0.00 0.00 -0.74 0.00 0.00 36.82 39.40 1ai7 h ILE 82 CO 0.10 0.66 -0.03 0.00 0.00 0.00 0.00 178.15 178.87 1ai7 h ALA 83 N 0.49 1.21 -0.07 1.87 0.00 -0.88 -1.98 119.26 119.90 1ai7 h ALA 83 Ca -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ai7 h ALA 83 Cb 1.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1ai7 h ALA 83 CO 0.18 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.47 1ai7 n ALA 84 N -2.20 2.55 -1.55 0.00 0.00 -1.09 -4.93 120.51 113.29 1ai7 n ALA 84 Ca -0.02 -0.48 -0.33 0.00 0.00 0.00 0.00 53.44 52.61 1ai7 n ALA 84 Cb 0.15 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.50 1ai7 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ai7 s LEU 85 N -1.84 3.44 0.69 0.00 1.43 -0.75 -5.02 118.68 116.64 1ai7 s LEU 85 Ca 0.36 2.02 -0.11 0.00 -1.03 0.00 0.00 54.13 55.36 1ai7 s LEU 85 Cb 0.20 -4.55 0.01 0.00 0.03 0.00 0.00 46.19 41.87 1ai7 s LEU 85 CO 0.31 -1.56 1.06 -0.94 0.23 0.00 0.00 176.35 175.45 1ai7 s SER 86 N -2.48 5.37 0.37 2.29 1.04 -1.26 -4.77 113.70 114.26 1ai7 s SER 86 Ca 0.68 1.64 0.08 0.00 0.48 0.00 0.00 55.95 58.82 1ai7 s SER 86 Cb -0.21 -2.50 0.79 0.00 0.10 0.00 0.00 66.02 64.21 1ai7 s SER 86 CO 0.39 -1.45 1.94 -0.65 0.98 0.00 0.00 173.24 174.46 1ai7 h PRO 87 N -0.65 0.68 -0.36 4.02 0.11 -1.98 0.11 132.00 133.93 1ai7 h PRO 87 Ca -0.44 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 1ai7 h PRO 87 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1ai7 h PRO 87 CO 0.57 0.45 -0.20 1.49 -0.21 0.00 0.00 178.00 180.09 1ai7 h GLU 88 N 0.70 0.76 -0.08 1.05 4.57 -2.00 -2.60 114.58 116.98 1ai7 h GLU 88 Ca 0.34 -0.35 -0.17 0.00 -1.18 0.00 0.00 59.36 58.00 1ai7 h GLU 88 Cb 0.39 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1ai7 h GLU 88 CO -0.12 0.96 -0.68 -0.44 -1.18 0.00 0.00 179.01 177.56 1ai7 h ASP 89 N 0.55 0.39 -0.09 1.04 3.32 -1.63 -2.93 116.42 117.06 1ai7 h ASP 89 Ca 0.08 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.82 1ai7 h ASP 89 Cb 0.75 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1ai7 h ASP 89 CO 0.06 0.96 -0.11 -0.03 -1.72 0.00 0.00 179.24 178.39 1ai7 h MET 90 N 0.24 0.42 -0.75 3.56 4.05 -0.98 -2.87 114.93 118.60 1ai7 h MET 90 Ca -0.02 -0.11 -0.00 0.00 -0.28 0.00 0.00 59.70 59.29 1ai7 h MET 90 Cb 1.23 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.94 1ai7 h MET 90 CO 0.11 0.54 0.45 0.77 0.23 0.00 0.00 176.91 179.01 1ai7 h SER 91 N 0.39 0.89 0.12 1.39 0.02 -1.27 0.39 113.55 115.48 1ai7 h SER 91 Ca 0.08 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1ai7 h SER 91 Cb 0.44 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1ai7 h SER 91 CO 0.02 0.68 -0.45 0.40 -1.14 0.00 0.00 176.83 176.35 1ai7 h ILE 92 N 1.03 0.12 -0.39 3.27 2.04 -1.54 0.45 117.51 122.48 1ai7 h ILE 92 Ca 0.27 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.08 1ai7 h ILE 92 Cb -0.05 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.14 1ai7 h ILE 92 CO -0.05 0.00 0.06 -0.07 0.00 0.00 0.00 178.15 178.09 1ai7 h LEU 93 N -0.68 0.63 0.03 1.44 3.38 -1.55 -2.39 115.31 116.17 1ai7 h LEU 93 Ca 0.02 -0.26 -0.24 0.00 0.09 0.00 0.00 57.88 57.48 1ai7 h LEU 93 Cb 0.70 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1ai7 h LEU 93 CO -0.26 0.73 -1.18 -0.61 0.09 0.00 0.00 178.44 177.21 1ai7 h GLN 94 N 0.50 0.07 -0.28 1.13 5.75 -0.88 -2.24 115.11 119.15 1ai7 h GLN 94 Ca 0.12 -0.12 0.07 0.00 -0.15 0.00 0.00 58.65 58.57 1ai7 h GLN 94 Cb 0.37 0.04 -0.07 0.00 1.07 0.00 0.00 27.48 28.90 1ai7 h GLN 94 CO 0.01 0.98 -0.17 0.78 -2.65 0.00 0.00 178.83 177.78 1ai7 h GLY 95 N 2.71 0.02 0.59 2.39 0.00 -0.09 0.45 103.07 109.14 1ai7 h GLY 95 Ca -0.09 0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.51 1ai7 h GLY 95 CO 0.14 -0.17 0.01 -1.82 0.00 0.00 0.00 176.54 174.69 1ai7 h TYR 96 N -0.15 0.00 -0.56 5.60 5.03 -1.29 -0.06 116.97 125.54 1ai7 h TYR 96 Ca 0.15 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.39 1ai7 h TYR 96 Cb 0.38 0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 1ai7 h TYR 96 CO -0.36 -0.04 -0.01 0.00 -1.32 0.00 0.00 178.16 176.43 1ai7 h ALA 97 N 1.23 0.92 -0.65 1.82 0.00 -1.07 -2.41 119.26 119.10 1ai7 h ALA 97 Ca 0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ai7 h ALA 97 Cb 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ai7 h ALA 97 CO -0.21 0.64 0.27 -0.44 0.00 0.00 0.00 179.25 179.51 1ai7 h ASP 98 N 0.90 0.88 -0.49 0.00 3.32 -0.41 -1.14 116.42 119.48 1ai7 h ASP 98 Ca 0.16 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1ai7 h ASP 98 Cb 0.54 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 1ai7 h ASP 98 CO 0.03 0.81 0.16 1.23 -1.72 0.00 0.00 179.24 179.74 1ai7 h GLY 99 N 0.91 0.89 0.91 2.75 0.00 -0.93 0.52 103.07 108.12 1ai7 h GLY 99 Ca 0.22 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 1ai7 h GLY 99 CO -0.02 0.46 -0.01 -0.33 0.00 0.00 0.00 176.54 176.65 1ai7 h MET 100 N 0.80 0.60 -0.65 4.80 2.86 -1.15 -2.87 114.93 119.33 1ai7 h MET 100 Ca 0.18 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1ai7 h MET 100 Cb 0.26 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1ai7 h MET 100 CO -0.01 0.73 0.37 -0.91 1.06 0.00 0.00 176.91 178.15 1ai7 h ASN 101 N 0.40 0.81 -0.35 1.22 2.35 -0.73 0.59 115.58 119.88 1ai7 h ASN 101 Ca 0.09 -0.08 0.05 0.00 -0.55 0.00 0.00 56.30 55.81 1ai7 h ASN 101 Cb 0.46 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.58 1ai7 h ASN 101 CO 0.02 0.66 0.08 0.00 -1.65 0.00 0.00 177.43 176.54 1ai7 h ALA 102 N 1.18 0.38 -0.10 -0.83 0.00 -0.70 0.11 119.26 119.30 1ai7 h ALA 102 Ca 0.23 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1ai7 h ALA 102 Cb 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ai7 h ALA 102 CO -0.04 -0.32 -0.47 2.35 0.00 0.00 0.00 179.25 180.77 1ai7 h TRP 103 N 0.20 0.29 -0.42 0.00 2.91 -1.28 -2.86 115.95 114.79 1ai7 h TRP 103 Ca 0.16 -0.09 -0.10 0.00 1.13 0.00 0.00 58.89 60.00 1ai7 h TRP 103 Cb 0.18 -0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 28.75 1ai7 h TRP 103 CO -0.18 0.67 -0.13 0.82 -1.03 0.00 0.00 178.44 178.59 1ai7 h ILE 104 N 0.20 1.26 0.05 2.65 2.04 0.12 -1.13 117.51 122.69 1ai7 h ILE 104 Ca 0.01 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.69 1ai7 h ILE 104 Cb 0.90 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1ai7 h ILE 104 CO 0.07 0.40 -0.11 0.44 0.00 0.00 0.00 178.15 178.95 1ai7 h ASP 105 N 0.69 -0.32 -0.65 1.72 3.32 -0.75 -0.18 116.42 120.27 1ai7 h ASP 105 Ca 0.11 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.23 1ai7 h ASP 105 Cb 0.61 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 1ai7 h ASP 105 CO 0.04 -0.17 0.43 0.11 -1.72 0.00 0.00 179.24 177.93 1ai7 h LYS 106 N -0.22 0.79 -0.30 3.56 1.57 -1.27 -2.52 116.57 118.18 1ai7 h LYS 106 Ca 0.03 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1ai7 h LYS 106 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1ai7 h LYS 106 CO -0.08 0.52 -0.11 0.28 -0.57 0.00 0.00 179.45 179.49 1ai7 h VAL 107 N 0.81 1.29 0.00 0.50 2.07 -0.68 -1.34 116.25 118.90 1ai7 h VAL 107 Ca 0.25 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.59 1ai7 h VAL 107 Cb 0.00 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1ai7 h VAL 107 CO -0.06 0.38 0.00 0.59 0.02 0.00 0.00 177.57 178.49 1ai7 n ASN 108 N -4.44 0.00 -0.05 0.57 5.03 -0.13 -2.22 115.26 114.02 1ai7 n ASN 108 Ca -0.03 -1.00 -0.02 0.00 0.87 0.00 0.00 54.58 54.39 1ai7 n ASN 108 Cb 0.35 0.00 -0.12 0.00 -1.02 0.00 0.00 39.78 38.99 1ai7 n ASN 108 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1ai7 n THR 109 N -0.90 0.66 -2.94 3.41 -1.04 -0.97 -4.68 114.28 107.82 1ai7 n THR 109 Ca 0.16 -0.53 -0.23 0.00 -2.04 0.00 0.00 64.05 61.42 1ai7 n THR 109 Cb 0.07 -0.36 -0.03 0.00 -1.82 0.00 0.00 70.33 68.19 1ai7 n THR 109 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1ai7 n ASN 110 N -2.37 3.19 0.23 8.00 2.85 -0.54 -4.95 115.26 121.67 1ai7 n ASN 110 Ca -0.17 -3.42 0.08 0.00 -0.11 0.00 0.00 54.58 50.97 1ai7 n ASN 110 Cb 0.78 -0.56 0.58 0.00 1.24 0.00 0.00 39.78 41.81 1ai7 n ASN 110 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ai7 h PRO 111 N 2.94 0.00 -0.49 1.20 0.14 -1.71 -2.08 132.00 131.99 1ai7 h PRO 111 Ca 0.12 0.00 0.10 0.00 0.14 0.00 0.00 66.00 66.37 1ai7 h PRO 111 Cb 0.74 0.00 -0.03 0.00 0.14 0.00 0.00 31.00 31.85 1ai7 h PRO 111 CO 0.70 0.20 0.34 0.93 0.14 0.00 0.00 178.00 180.31 1ai7 h GLU 112 N 0.00 0.20 0.00 0.86 3.07 -1.92 -2.66 114.58 114.13 1ai7 h GLU 112 Ca -0.00 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 1ai7 h GLU 112 Cb 0.43 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1ai7 h GLU 112 CO 0.03 0.13 -1.19 0.25 -1.40 0.00 0.00 179.01 176.83 1ai7 n THR 113 N -4.45 0.10 0.38 1.13 -2.24 -1.03 -4.84 114.28 103.33 1ai7 n THR 113 Ca 0.08 -0.11 0.08 0.00 -2.27 0.00 0.00 64.05 61.84 1ai7 n THR 113 Cb 0.42 -0.19 -0.12 0.00 -2.10 0.00 0.00 70.33 68.34 1ai7 n THR 113 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ai7 n LEU 114 N -1.85 0.38 -4.68 3.22 4.77 -0.81 -4.95 117.00 113.07 1ai7 n LEU 114 Ca -0.03 -0.24 -0.43 0.00 -0.03 0.00 0.00 56.01 55.29 1ai7 n LEU 114 Cb 0.33 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 1ai7 n LEU 114 CO 0.07 0.10 0.88 -0.22 -1.33 0.00 0.00 177.39 176.89 1ai7 s LEU 115 N -3.54 4.21 0.17 2.23 2.96 -1.01 -4.94 118.68 118.77 1ai7 s LEU 115 Ca -0.00 1.57 -0.33 0.00 -0.22 0.00 0.00 54.13 55.15 1ai7 s LEU 115 Cb 0.12 -3.55 -0.15 0.00 0.50 0.00 0.00 46.19 43.10 1ai7 s LEU 115 CO 0.71 -0.55 1.22 -2.65 -1.32 0.00 0.00 176.35 173.76 1ai7 n PRO 116 N 5.48 1.29 -0.31 0.98 -0.02 -1.26 -4.82 135.00 136.34 1ai7 n PRO 116 Ca 0.10 0.46 0.15 0.00 -2.02 0.00 0.00 63.50 62.19 1ai7 n PRO 116 Cb 0.47 -2.00 0.33 0.00 -0.02 0.00 0.00 33.50 32.29 1ai7 n PRO 116 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ai7 h LYS 117 N 3.65 0.38 -0.99 -0.52 3.64 -1.99 -1.02 116.57 119.72 1ai7 h LYS 117 Ca -0.44 -0.02 0.27 0.00 -1.27 0.00 0.00 60.65 59.19 1ai7 h LYS 117 Cb 1.33 -0.09 -0.13 0.00 -0.41 0.00 0.00 32.23 32.93 1ai7 h LYS 117 CO 0.72 0.25 0.56 1.96 -2.27 0.00 0.00 179.45 180.67 1ai7 h GLN 118 N 0.39 0.46 -0.77 1.90 7.50 -1.99 0.02 115.11 122.63 1ai7 h GLN 118 Ca 0.59 -0.03 -0.04 0.00 0.50 0.00 0.00 58.65 59.67 1ai7 h GLN 118 Cb 1.16 -0.10 -0.03 0.00 0.05 0.00 0.00 27.48 28.55 1ai7 h GLN 118 CO -0.54 0.31 0.33 0.74 -1.50 0.00 0.00 178.83 178.17 1ai7 h PHE 119 N 0.48 1.14 -0.39 2.96 0.04 -1.45 0.14 116.94 119.85 1ai7 h PHE 119 Ca 0.66 -0.07 -0.08 0.00 2.80 0.00 0.00 57.97 61.28 1ai7 h PHE 119 Cb 1.35 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 39.14 1ai7 h PHE 119 CO -0.02 0.85 -0.08 -0.91 -0.60 0.00 0.00 178.31 177.55 1ai7 h ASN 120 N 1.09 0.74 -0.46 2.17 -0.26 -1.15 0.20 115.58 117.92 1ai7 h ASN 120 Ca 0.26 -0.36 0.08 0.00 -0.56 0.00 0.00 56.30 55.72 1ai7 h ASN 120 Cb 0.17 -0.20 -0.06 0.00 -1.06 0.00 0.00 38.32 37.17 1ai7 h ASN 120 CO -0.03 0.93 0.08 0.74 -1.06 0.00 0.00 177.43 178.09 1ai7 h THR 121 N 0.55 0.74 -0.01 2.81 2.02 -0.99 -0.93 112.91 117.10 1ai7 h THR 121 Ca 0.10 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1ai7 h THR 121 Cb 0.59 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1ai7 h THR 121 CO 0.04 0.04 -0.15 0.49 0.37 0.00 0.00 175.52 176.30 1ai7 n PHE 122 N -5.12 0.00 -2.54 3.16 3.72 0.44 -4.99 117.46 112.14 1ai7 n PHE 122 Ca 0.04 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.40 1ai7 n PHE 122 Cb 0.22 -0.08 0.02 0.00 -0.94 0.00 0.00 39.48 38.70 1ai7 n PHE 122 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ai7 n GLY 123 N 1.27 0.47 3.65 1.37 0.00 0.58 -4.99 105.19 107.55 1ai7 n GLY 123 Ca 0.15 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 1ai7 n GLY 123 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ai7 s PHE 124 N -3.07 -0.32 0.24 1.61 -0.71 -0.50 -5.03 117.98 110.20 1ai7 s PHE 124 Ca 0.07 0.01 0.09 0.00 -1.04 0.00 0.00 56.93 56.06 1ai7 s PHE 124 Cb -0.03 0.63 -0.05 0.00 -1.21 0.00 0.00 43.02 42.36 1ai7 s PHE 124 CO 0.16 -0.96 -0.15 0.95 -1.34 0.00 0.00 175.22 173.88 1ai7 s THR 125 N -3.67 1.99 0.44 -4.49 -4.23 -1.26 -4.48 115.64 99.93 1ai7 s THR 125 Ca 0.07 -2.26 -0.24 0.00 -1.18 0.00 0.00 61.69 58.08 1ai7 s THR 125 Cb -0.03 -2.21 -0.08 0.00 1.34 0.00 0.00 72.50 71.53 1ai7 s THR 125 CO -0.03 -0.48 1.18 -2.16 -0.54 0.00 0.00 174.62 172.60 1ai7 s PRO 126 N -3.61 3.86 0.31 3.99 0.04 -1.26 -5.07 135.00 133.26 1ai7 s PRO 126 Ca 0.26 1.83 0.08 0.00 0.04 0.00 0.00 61.00 63.22 1ai7 s PRO 126 Cb -0.01 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 1ai7 s PRO 126 CO 0.11 -0.48 0.12 0.15 0.04 0.00 0.00 177.00 176.94 1ai7 s LYS 127 N -2.53 2.45 0.47 4.56 1.02 -1.26 -5.03 119.74 119.42 1ai7 s LYS 127 Ca 0.61 -1.43 -0.20 0.00 0.02 0.00 0.00 55.97 54.97 1ai7 s LYS 127 Cb -0.30 -2.25 -0.09 0.00 -0.52 0.00 0.00 37.83 34.67 1ai7 s LYS 127 CO 0.37 0.22 1.01 1.03 -0.92 0.00 0.00 175.35 177.06 1ai7 s ARG 128 N -3.81 3.93 0.16 1.68 0.52 -1.26 -5.04 118.95 115.12 1ai7 s ARG 128 Ca 0.36 1.27 0.03 0.00 -0.52 0.00 0.00 55.73 56.86 1ai7 s ARG 128 Cb -0.05 -2.12 -0.03 0.00 0.52 0.00 0.00 34.95 33.27 1ai7 s ARG 128 CO 0.22 -0.31 0.28 -1.58 0.02 0.00 0.00 175.30 173.93 1ai7 s TRP 129 N -2.08 3.46 0.24 -0.53 0.52 -1.26 -5.11 118.94 114.17 1ai7 s TRP 129 Ca 0.65 0.10 0.03 0.00 0.02 0.00 0.00 56.10 56.90 1ai7 s TRP 129 Cb -0.14 -1.65 -0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1ai7 s TRP 129 CO 0.19 0.51 0.02 -1.83 0.02 0.00 0.00 176.95 175.85 1ai7 s GLU 130 N -3.28 1.35 0.37 4.98 -1.05 -1.26 -4.78 118.70 115.03 1ai7 s GLU 130 Ca 0.34 -1.69 0.18 0.00 -0.15 0.00 0.00 54.97 53.65 1ai7 s GLU 130 Cb -0.11 -0.55 1.12 0.00 -0.44 0.00 0.00 34.13 34.15 1ai7 s GLU 130 CO 0.28 -0.13 1.70 -1.35 0.95 0.00 0.00 175.26 176.71 1ai7 h PRO 131 N 2.45 0.34 -0.72 -4.83 0.11 -1.93 -1.00 132.00 126.43 1ai7 h PRO 131 Ca -0.38 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.72 1ai7 h PRO 131 Cb 1.23 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1ai7 h PRO 131 CO 0.64 0.23 0.47 0.35 -0.21 0.00 0.00 178.00 179.47 1ai7 h PHE 132 N 0.35 0.88 -0.73 0.65 3.57 -1.96 -2.00 116.94 117.70 1ai7 h PHE 132 Ca 0.69 0.02 0.00 0.00 3.53 0.00 0.00 57.97 62.21 1ai7 h PHE 132 Cb 1.70 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 40.11 1ai7 h PHE 132 CO -0.01 0.53 0.46 -0.44 -2.23 0.00 0.00 178.31 176.63 1ai7 h ASP 133 N 0.94 0.85 -0.70 0.41 3.32 -1.58 -1.49 116.42 118.17 1ai7 h ASP 133 Ca 0.27 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 1ai7 h ASP 133 Cb -0.06 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 1ai7 h ASP 133 CO -0.08 0.64 0.38 0.58 -1.72 0.00 0.00 179.24 179.04 1ai7 h VAL 134 N 0.99 1.22 -0.48 -1.35 2.07 -1.35 -2.60 116.25 114.74 1ai7 h VAL 134 Ca 0.26 -0.56 -0.12 0.00 0.82 0.00 0.00 66.70 67.11 1ai7 h VAL 134 Cb -0.08 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1ai7 h VAL 134 CO -0.05 0.24 -0.15 0.00 0.02 0.00 0.00 177.57 177.63 1ai7 h ALA 135 N 1.19 0.67 0.00 1.67 0.00 -1.23 -3.00 119.26 118.55 1ai7 h ALA 135 Ca 0.24 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1ai7 h ALA 135 Cb 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ai7 h ALA 135 CO -0.04 0.61 -0.32 0.52 0.00 0.00 0.00 179.25 180.02 1ai7 h MET 136 N 0.81 0.00 0.15 0.00 2.07 -1.17 -1.86 114.93 114.93 1ai7 h MET 136 Ca 0.12 0.00 0.02 0.00 -2.07 0.00 0.00 59.70 57.76 1ai7 h MET 136 Cb 0.72 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 30.41 1ai7 h MET 136 CO 0.06 0.32 -0.32 0.82 1.07 0.00 0.00 176.91 178.86 1ai7 h ILE 137 N 0.00 0.33 -0.59 -1.22 1.08 -1.32 0.10 117.51 115.89 1ai7 h ILE 137 Ca -0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.44 1ai7 h ILE 137 Cb 0.63 0.33 -0.03 0.00 -3.07 0.00 0.00 36.82 34.68 1ai7 h ILE 137 CO 0.04 0.00 0.27 0.15 -0.69 0.00 0.00 178.15 177.92 1ai7 h PHE 138 N -0.56 0.87 -0.02 1.37 3.57 -1.52 -2.13 116.94 118.52 1ai7 h PHE 138 Ca 0.02 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1ai7 h PHE 138 Cb 0.57 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 1ai7 h PHE 138 CO -0.27 0.68 0.01 0.28 -2.23 0.00 0.00 178.31 176.78 1ai7 h VAL 139 N 0.81 1.07 -0.39 1.41 2.07 -1.12 -0.66 116.25 119.44 1ai7 h VAL 139 Ca 0.20 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1ai7 h VAL 139 Cb 0.15 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1ai7 h VAL 139 CO -0.02 0.05 -0.03 1.23 0.02 0.00 0.00 177.57 178.83 1ai7 h GLY 140 N -0.05 0.68 0.00 2.17 0.00 -0.95 -0.63 103.07 104.29 1ai7 h GLY 140 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1ai7 h GLY 140 CO -0.00 0.41 -1.01 -1.30 0.00 0.00 0.00 176.54 174.63 1ai7 n THR 141 N -4.24 0.00 -0.00 4.70 -2.24 -0.81 -4.04 114.28 107.66 1ai7 n THR 141 Ca 0.02 -0.25 -0.04 0.00 -2.27 0.00 0.00 64.05 61.51 1ai7 n THR 141 Cb 0.28 0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 1ai7 n THR 141 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1ai7 n MET 142 N -1.57 0.18 -0.16 -0.78 0.00 -0.27 -4.35 117.12 110.16 1ai7 n MET 142 Ca 0.00 0.07 -0.10 0.00 0.00 0.00 0.00 57.70 57.67 1ai7 n MET 142 Cb 0.23 -0.82 0.03 0.00 0.00 0.00 0.00 33.22 32.66 1ai7 n MET 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ai7 h ALA 143 N -0.34 0.77 0.00 -5.12 0.00 -1.31 -2.26 119.26 111.00 1ai7 h ALA 143 Ca -0.02 -0.36 -0.21 0.00 0.00 0.00 0.00 54.91 54.32 1ai7 h ALA 143 Cb 0.40 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ai7 h ALA 143 CO -0.01 0.67 -1.02 -0.91 0.00 0.00 0.00 179.25 177.97 1ai7 h ASN 144 N 0.87 0.00 0.52 0.00 4.21 -1.29 -0.85 115.58 119.03 1ai7 h ASN 144 Ca 0.13 0.00 -0.29 0.00 1.21 0.00 0.00 56.30 57.35 1ai7 h ASN 144 Cb 0.71 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.89 1ai7 h ASN 144 CO 0.05 1.00 -1.50 -0.09 -1.29 0.00 0.00 177.43 175.60 1ai7 h ARG 145 N 0.00 0.18 -0.01 0.81 2.43 -1.69 -3.39 114.38 112.71 1ai7 h ARG 145 Ca -0.02 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1ai7 h ARG 145 Cb 1.78 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 31.44 1ai7 h ARG 145 CO 0.13 1.02 0.00 1.19 -1.51 0.00 0.00 179.97 180.80 1ai7 n PHE 146 N -3.39 0.01 -2.21 2.20 3.72 -0.85 -4.72 117.46 112.23 1ai7 n PHE 146 Ca -0.15 -0.13 0.01 0.00 -0.05 0.00 0.00 57.45 57.14 1ai7 n PHE 146 Cb 1.03 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.56 1ai7 n PHE 146 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ai7 n SER 147 N -0.05 0.36 -1.22 4.37 2.88 -0.34 -4.83 113.62 114.78 1ai7 n SER 147 Ca 0.01 -1.94 0.00 0.00 -1.33 0.00 0.00 58.87 55.61 1ai7 n SER 147 Cb 0.09 -0.20 0.12 0.00 -0.75 0.00 0.00 64.21 63.47 1ai7 n SER 147 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1ai7 n ASP 148 N 0.21 2.05 -4.74 -3.46 2.03 -1.13 -4.94 116.55 106.57 1ai7 n ASP 148 Ca 0.01 -3.27 -0.39 0.00 0.52 0.00 0.00 54.79 51.66 1ai7 n ASP 148 Cb 0.87 -0.44 -0.05 0.00 -0.72 0.00 0.00 41.12 40.78 1ai7 n ASP 148 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1ai7 s SER 149 N -3.04 6.90 0.01 1.67 0.01 -1.26 -5.05 113.70 112.94 1ai7 s SER 149 Ca 0.38 1.07 -0.24 0.00 1.31 0.00 0.00 55.95 58.48 1ai7 s SER 149 Cb 0.38 -2.35 0.05 0.00 0.21 0.00 0.00 66.02 64.31 1ai7 s SER 149 CO -0.07 0.03 0.54 0.28 0.41 0.00 0.00 173.24 174.42 1ai7 s THR 150 N 0.24 0.02 -0.06 1.44 -1.32 -1.26 -5.04 115.64 109.67 1ai7 s THR 150 Ca 0.31 -0.20 0.25 0.00 -1.21 0.00 0.00 61.69 60.84 1ai7 s THR 150 Cb -0.17 -0.93 0.44 0.00 -1.51 0.00 0.00 72.50 70.33 1ai7 s THR 150 CO 0.15 -0.11 1.16 -1.54 -2.21 0.00 0.00 174.62 172.07 1ai7 n SER 151 N 0.68 1.07 -0.05 8.08 3.41 -1.26 -4.93 113.62 120.62 1ai7 n SER 151 Ca -0.19 -2.01 0.07 0.00 -0.26 0.00 0.00 58.87 56.49 1ai7 n SER 151 Cb 0.59 -0.32 0.45 0.00 -0.26 0.00 0.00 64.21 64.66 1ai7 n SER 151 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ai7 h GLU 152 N 1.33 0.50 -0.17 4.33 5.08 -1.99 0.18 114.58 123.84 1ai7 h GLU 152 Ca -0.22 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.00 1ai7 h GLU 152 Cb 1.75 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.88 1ai7 h GLU 152 CO 0.11 0.33 -0.31 0.82 -1.00 0.00 0.00 179.01 178.96 1ai7 h ILE 153 N 0.52 1.35 -0.62 3.13 2.04 -2.00 -1.98 117.51 119.94 1ai7 h ILE 153 Ca 0.22 -1.55 -0.03 0.00 1.00 0.00 0.00 64.86 64.50 1ai7 h ILE 153 Cb 0.22 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 1ai7 h ILE 153 CO -0.06 0.47 0.26 0.44 0.00 0.00 0.00 178.15 179.26 1ai7 h ASP 154 N 0.17 0.85 -0.64 1.72 3.32 -1.62 -2.49 116.42 117.72 1ai7 h ASP 154 Ca 0.01 -0.16 0.13 0.00 0.02 0.00 0.00 57.03 57.03 1ai7 h ASP 154 Cb 0.90 -0.22 -0.12 0.00 0.22 0.00 0.00 39.33 40.12 1ai7 h ASP 154 CO 0.07 0.77 -0.08 0.78 -1.72 0.00 0.00 179.24 179.07 1ai7 h ASN 155 N 0.86 -0.44 -0.66 6.45 -0.26 -0.55 -0.21 115.58 120.78 1ai7 h ASN 155 Ca 0.21 0.18 -0.03 0.00 -0.56 0.00 0.00 56.30 56.09 1ai7 h ASN 155 Cb 0.18 0.34 -0.03 0.00 -1.06 0.00 0.00 38.32 37.75 1ai7 h ASN 155 CO -0.02 -0.17 0.28 0.25 -1.06 0.00 0.00 177.43 176.71 1ai7 h LEU 156 N 0.05 0.89 -1.36 1.61 5.85 -1.08 -0.75 115.31 120.52 1ai7 h LEU 156 Ca 0.33 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 1ai7 h LEU 156 Cb 0.53 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1ai7 h LEU 156 CO -0.61 0.80 0.04 0.00 -0.34 0.00 0.00 178.44 178.33 1ai7 h ALA 157 N 1.12 1.49 -0.17 1.25 0.00 -0.95 -0.39 119.26 121.61 1ai7 h ALA 157 Ca 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1ai7 h ALA 157 Cb 0.17 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ai7 h ALA 157 CO -0.02 0.37 -0.07 1.25 0.00 0.00 0.00 179.25 180.79 1ai7 h LEU 158 N 0.46 0.35 -0.50 0.00 5.85 -0.48 -2.75 115.31 118.23 1ai7 h LEU 158 Ca 0.10 -0.40 0.03 0.00 0.84 0.00 0.00 57.88 58.46 1ai7 h LEU 158 Cb 0.24 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1ai7 h LEU 158 CO 0.00 0.67 0.29 0.25 -0.34 0.00 0.00 178.44 179.31 1ai7 h LEU 159 N 0.03 0.45 -0.19 2.25 5.85 -0.68 0.14 115.31 123.17 1ai7 h LEU 159 Ca 0.04 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1ai7 h LEU 159 Cb 0.53 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1ai7 h LEU 159 CO 0.02 0.32 0.11 0.74 -0.34 0.00 0.00 178.44 179.28 1ai7 h THR 160 N 0.57 1.09 -0.82 1.05 2.02 -1.12 -1.22 112.91 114.48 1ai7 h THR 160 Ca 0.21 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 1ai7 h THR 160 Cb 0.05 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 1ai7 h THR 160 CO -0.11 0.09 0.40 0.00 0.37 0.00 0.00 175.52 176.27 1ai7 h ALA 161 N 1.01 1.17 -0.10 6.16 0.00 -1.16 -1.39 119.26 124.95 1ai7 h ALA 161 Ca 0.07 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1ai7 h ALA 161 Cb 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ai7 h ALA 161 CO -0.01 0.64 -0.27 -0.07 0.00 0.00 0.00 179.25 179.53 1ai7 h LEU 162 N 1.16 0.18 -0.43 0.00 3.38 -0.47 -2.30 115.31 116.83 1ai7 h LEU 162 Ca 0.28 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 58.05 1ai7 h LEU 162 Cb 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ai7 h LEU 162 CO -0.04 0.46 -0.32 0.11 0.09 0.00 0.00 178.44 178.73 1ai7 h LYS 163 N 0.16 0.96 -0.57 1.13 1.57 -0.17 -0.51 116.57 119.15 1ai7 h LYS 163 Ca 0.03 -0.47 -0.10 0.00 -1.87 0.00 0.00 60.65 58.23 1ai7 h LYS 163 Cb 0.58 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 1ai7 h LYS 163 CO 0.04 1.14 -0.04 -0.44 -0.57 0.00 0.00 179.45 179.58 1ai7 h ASP 164 N 0.80 1.01 0.01 0.86 5.19 -1.22 0.17 116.42 123.25 1ai7 h ASP 164 Ca 0.08 -0.30 -0.00 0.00 -0.62 0.00 0.00 57.03 56.19 1ai7 h ASP 164 Cb 0.92 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.15 1ai7 h ASP 164 CO 0.09 1.08 -0.01 0.50 -3.12 0.00 0.00 179.24 177.78 1ai7 h LYS 165 N 0.93 -0.01 -0.19 3.56 3.64 -1.29 -3.38 116.57 119.83 1ai7 h LYS 165 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1ai7 h LYS 165 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1ai7 h LYS 165 CO 0.04 0.73 0.00 0.66 -2.27 0.00 0.00 179.45 178.60 1ai7 n TYR 166 N -4.73 0.24 0.00 1.91 4.01 -0.21 -5.09 117.16 113.29 1ai7 n TYR 166 Ca -0.09 -0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 1ai7 n TYR 166 Cb 0.37 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 1ai7 n TYR 166 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ai7 n GLY 167 N 0.74 -0.77 0.35 2.72 0.00 0.60 -4.26 105.19 104.57 1ai7 n GLY 167 Ca 0.10 -1.58 -0.11 0.00 0.00 0.00 0.00 46.02 44.43 1ai7 n GLY 167 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ai7 h VAL 168 N 0.00 0.00 -0.16 1.61 2.07 -1.90 0.12 116.25 117.99 1ai7 h VAL 168 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1ai7 h VAL 168 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1ai7 h VAL 168 CO 0.00 0.00 -0.03 0.28 0.02 0.00 0.00 177.57 177.84 1ai7 h SER 169 N -0.36 0.30 1.03 0.57 0.02 -1.94 -3.20 113.55 109.98 1ai7 h SER 169 Ca 0.04 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 1ai7 h SER 169 Cb 0.48 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 1ai7 h SER 169 CO -0.41 0.59 -0.12 -0.61 -1.14 0.00 0.00 176.83 175.13 1ai7 h GLN 170 N 0.01 0.00 -0.67 3.45 5.75 -1.75 -2.48 115.11 119.42 1ai7 h GLN 170 Ca 0.04 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1ai7 h GLN 170 Cb 0.45 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.97 1ai7 h GLN 170 CO 0.01 0.12 0.25 0.78 -2.65 0.00 0.00 178.83 177.35 1ai7 h GLY 171 N 2.18 1.09 0.99 2.39 0.00 -0.74 -1.04 103.07 107.95 1ai7 h GLY 171 Ca -0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.69 1ai7 h GLY 171 CO 0.02 0.58 0.29 1.98 0.00 0.00 0.00 176.54 179.40 1ai7 h MET 172 N 0.96 0.83 0.00 4.80 1.85 -1.54 -1.34 114.93 120.48 1ai7 h MET 172 Ca 0.22 -0.12 -0.09 0.00 -0.61 0.00 0.00 59.70 59.10 1ai7 h MET 172 Cb 0.24 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.10 1ai7 h MET 172 CO -0.01 0.66 -0.44 0.00 -0.40 0.00 0.00 176.91 176.72 1ai7 h ALA 173 N 1.12 1.09 -0.07 0.39 0.00 -1.00 -1.47 119.26 119.32 1ai7 h ALA 173 Ca 0.20 -0.40 -0.23 0.00 0.00 0.00 0.00 54.91 54.48 1ai7 h ALA 173 Cb 0.10 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ai7 h ALA 173 CO -0.03 0.55 -0.87 0.28 0.00 0.00 0.00 179.25 179.19 1ai7 h VAL 174 N 0.00 1.29 -0.90 0.00 2.07 -0.60 -2.45 116.25 115.66 1ai7 h VAL 174 Ca -0.00 -2.09 0.19 0.00 0.82 0.00 0.00 66.70 65.62 1ai7 h VAL 174 Cb 0.88 2.21 -0.11 0.00 -1.52 0.00 0.00 31.29 32.74 1ai7 h VAL 174 CO 0.06 0.65 0.45 0.15 0.02 0.00 0.00 177.57 178.90 1ai7 h PHE 175 N 0.41 0.78 0.00 1.57 3.57 -1.23 0.59 116.94 122.64 1ai7 h PHE 175 Ca -0.09 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1ai7 h PHE 175 Cb 1.51 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.05 1ai7 h PHE 175 CO 0.10 0.09 0.00 -0.91 -2.23 0.00 0.00 178.31 175.36 1ai7 h ASN 176 N 0.55 0.00 0.90 0.41 2.35 -1.01 -0.71 115.58 118.07 1ai7 h ASN 176 Ca 0.53 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 56.06 1ai7 h ASN 176 Cb 0.90 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.25 1ai7 h ASN 176 CO -0.44 0.00 -1.06 -0.61 -1.65 0.00 0.00 177.43 173.67 1ai7 h GLN 177 N 0.00 0.07 0.11 0.81 4.15 0.62 -3.25 115.11 117.62 1ai7 h GLN 177 Ca 0.00 -0.11 -0.35 0.00 0.77 0.00 0.00 58.65 58.96 1ai7 h GLN 177 Cb 0.69 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.40 1ai7 h GLN 177 CO 0.00 1.05 -1.89 1.28 -1.93 0.00 0.00 178.83 177.34 1ai7 n LEU 178 N -3.40 2.52 -3.45 -2.39 4.77 -0.51 -4.62 117.00 109.93 1ai7 n LEU 178 Ca -0.02 0.25 -0.26 0.00 -0.03 0.00 0.00 56.01 55.94 1ai7 n LEU 178 Cb 0.96 -1.10 -0.09 0.00 -2.33 0.00 0.00 43.42 40.86 1ai7 n LEU 178 CO 0.49 0.77 -0.08 1.17 -1.33 0.00 0.00 177.39 178.41 1ai7 n LYS 179 N -3.63 1.70 -1.73 3.23 3.00 -0.30 -5.10 118.16 115.32 1ai7 n LYS 179 Ca -0.32 -4.11 -0.34 0.00 -0.00 0.00 0.00 58.31 53.54 1ai7 n LYS 179 Cb 1.00 -1.93 0.06 0.00 0.00 0.00 0.00 35.03 34.15 1ai7 n LYS 179 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.40 179.07 1ai7 s TRP 180 N -1.70 2.43 -0.07 5.64 -2.14 -1.23 -4.57 118.94 117.30 1ai7 s TRP 180 Ca 0.35 1.56 -0.27 0.00 2.66 0.00 0.00 56.10 60.41 1ai7 s TRP 180 Cb 0.11 -3.30 -0.22 0.00 -3.10 0.00 0.00 33.47 26.96 1ai7 s TRP 180 CO -0.08 -2.01 1.07 1.25 -2.66 0.00 0.00 176.95 174.52 1ai7 h LEU 181 N 0.12 -0.01 -8.22 -4.66 5.85 -1.95 -3.46 115.31 102.98 1ai7 h LEU 181 Ca -0.48 -0.66 -0.16 0.00 0.84 0.00 0.00 57.88 57.41 1ai7 h LEU 181 Cb 1.27 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.13 1ai7 h LEU 181 CO 0.53 0.67 -0.69 0.68 -0.34 0.00 0.00 178.44 179.28 1ai7 s VAL 182 N -3.48 0.32 -0.11 1.05 -7.23 -1.26 -5.15 120.40 104.54 1ai7 s VAL 182 Ca -0.17 -1.58 -0.03 0.00 -1.81 0.00 0.00 61.98 58.38 1ai7 s VAL 182 Cb -0.00 -1.21 0.05 0.00 0.56 0.00 0.00 36.38 35.77 1ai7 s VAL 182 CO 0.67 -0.82 0.07 0.21 -0.31 0.00 0.00 175.10 174.92 1ai7 s ASN 183 N -2.52 1.86 0.47 4.85 3.84 -1.26 -5.01 114.94 117.17 1ai7 s ASN 183 Ca 0.02 -0.32 0.31 0.00 0.21 0.00 0.00 52.86 53.08 1ai7 s ASN 183 Cb 0.02 -0.24 1.38 0.00 -0.55 0.00 0.00 41.25 41.86 1ai7 s ASN 183 CO -0.06 -0.30 1.94 1.55 -2.79 0.00 0.00 177.10 177.44 1ai7 h PRO 184 N 8.41 0.00 -0.02 0.43 0.13 -2.04 -2.53 132.00 136.38 1ai7 h PRO 184 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1ai7 h PRO 184 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1ai7 h PRO 184 CO 0.24 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.88 1ai7 n SER 185 N -2.79 1.39 -4.71 1.44 3.41 -1.26 -4.94 113.62 106.16 1ai7 n SER 185 Ca 0.00 -1.47 -0.43 0.00 -0.26 0.00 0.00 58.87 56.71 1ai7 n SER 185 Cb 0.24 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.15 1ai7 n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ai7 n ALA 186 N 0.09 2.59 -1.66 7.33 0.00 -0.96 -4.95 120.51 122.95 1ai7 n ALA 186 Ca 0.19 0.41 -0.46 0.00 0.00 0.00 0.00 53.44 53.58 1ai7 n ALA 186 Cb 0.33 -2.49 -0.04 0.00 0.00 0.00 0.00 19.45 17.25 1ai7 n ALA 186 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ai7 n PRO 187 N 3.76 2.09 -4.37 0.00 -0.02 -1.26 -4.99 135.00 130.22 1ai7 n PRO 187 Ca 0.16 0.76 -0.29 0.00 -2.02 0.00 0.00 63.50 62.11 1ai7 n PRO 187 Cb 0.34 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.18 1ai7 n PRO 187 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ai7 s THR 188 N 0.94 2.46 0.28 3.45 -4.23 -1.26 -5.03 115.64 112.25 1ai7 s THR 188 Ca 0.79 -1.73 0.04 0.00 -1.18 0.00 0.00 61.69 59.61 1ai7 s THR 188 Cb -0.69 -2.12 0.03 0.00 1.34 0.00 0.00 72.50 71.05 1ai7 s THR 188 CO 0.39 0.05 1.68 0.74 -0.54 0.00 0.00 174.62 176.94 1ai7 h THR 189 N 3.64 1.30 -3.37 3.99 2.02 -2.04 -3.41 112.91 115.05 1ai7 h THR 189 Ca -0.50 -1.51 -0.60 0.00 0.77 0.00 0.00 66.41 64.57 1ai7 h THR 189 Cb 1.18 1.63 -0.12 0.00 -1.74 0.00 0.00 68.15 69.09 1ai7 h THR 189 CO 0.43 0.46 -0.45 -0.63 0.37 0.00 0.00 175.52 175.70 1ai7 s ILE 190 N -4.19 5.37 0.56 3.11 1.01 -1.26 -5.08 121.20 120.72 1ai7 s ILE 190 Ca -0.05 0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.68 1ai7 s ILE 190 Cb 0.13 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.04 1ai7 s ILE 190 CO 0.79 0.39 1.24 0.00 0.00 0.00 0.00 174.94 177.36 1ai7 s ALA 191 N 0.62 2.67 0.52 9.38 0.00 -1.26 -4.89 121.76 128.80 1ai7 s ALA 191 Ca 0.10 1.09 0.17 0.00 0.00 0.00 0.00 51.96 53.32 1ai7 s ALA 191 Cb -0.12 -3.47 1.28 0.00 0.00 0.00 0.00 23.12 20.80 1ai7 s ALA 191 CO 0.01 -1.15 2.12 -0.39 0.00 0.00 0.00 175.76 176.35 1ai7 h VAL 192 N 1.16 0.96 -0.28 0.00 -1.51 -1.96 -2.16 116.25 112.45 1ai7 h VAL 192 Ca -0.50 -0.01 0.08 0.00 -1.23 0.00 0.00 66.70 65.04 1ai7 h VAL 192 Cb 1.29 0.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.37 1ai7 h VAL 192 CO 0.56 0.00 0.20 1.56 -1.23 0.00 0.00 177.57 178.67 1ai7 h GLN 193 N 0.02 0.00 0.00 5.19 7.50 -2.05 -2.99 115.11 122.79 1ai7 h GLN 193 Ca 0.05 -0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.13 1ai7 h GLN 193 Cb 0.18 -0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 1ai7 h GLN 193 CO -0.00 0.00 -0.40 0.93 -1.50 0.00 0.00 178.83 177.85 1ai7 h GLU 194 N 0.00 0.00 -1.59 1.46 4.39 -1.75 -3.49 114.58 113.59 1ai7 h GLU 194 Ca 0.13 0.00 0.30 0.00 0.34 0.00 0.00 59.36 60.13 1ai7 h GLU 194 Cb 0.54 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.07 1ai7 h GLU 194 CO -0.00 0.96 0.77 -1.54 -1.16 0.00 0.00 179.01 178.04 1ai7 s SER 195 N -6.40 -0.08 0.10 1.42 1.04 -1.13 -5.10 113.70 103.55 1ai7 s SER 195 Ca -0.22 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.08 1ai7 s SER 195 Cb -0.00 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1ai7 s SER 195 CO 0.64 -0.39 -0.10 0.54 0.98 0.00 0.00 173.24 174.90 1ai7 s ASN 196 N -2.93 1.49 0.21 7.02 4.22 -1.26 -4.52 114.94 119.17 1ai7 s ASN 196 Ca 0.14 -0.84 -0.32 0.00 -2.14 0.00 0.00 52.86 49.70 1ai7 s ASN 196 Cb 0.04 0.01 -0.13 0.00 1.28 0.00 0.00 41.25 42.45 1ai7 s ASN 196 CO -0.03 -0.27 1.63 0.00 -2.04 0.00 0.00 177.10 176.39 1ai7 n TYR 197 N 0.47 2.58 0.16 1.54 9.36 -1.26 -4.93 117.16 125.09 1ai7 n TYR 197 Ca -0.15 0.18 0.05 0.00 3.32 0.00 0.00 57.90 61.29 1ai7 n TYR 197 Cb 0.58 -2.60 0.07 0.00 -0.63 0.00 0.00 39.34 36.76 1ai7 n TYR 197 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1ai7 h PRO 198 N 5.97 0.00 -6.99 2.98 0.13 -2.07 -3.46 132.00 128.55 1ai7 h PRO 198 Ca -0.44 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.22 1ai7 h PRO 198 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1ai7 h PRO 198 CO 0.89 0.37 0.27 -0.51 -0.23 0.00 0.00 178.00 178.79 1ai7 s LEU 199 N -6.41 3.90 0.00 1.56 1.43 -1.26 -5.07 118.68 112.83 1ai7 s LEU 199 Ca 0.05 1.53 0.07 0.00 -1.03 0.00 0.00 54.13 54.74 1ai7 s LEU 199 Cb 0.07 -4.39 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 1ai7 s LEU 199 CO 0.72 -0.37 -0.21 -0.75 0.23 0.00 0.00 176.35 175.97 1ai7 s LYS 200 N -3.37 1.64 0.28 1.70 2.47 -1.26 -5.15 119.74 116.05 1ai7 s LYS 200 Ca 0.59 -0.83 0.11 0.00 -1.56 0.00 0.00 55.97 54.28 1ai7 s LYS 200 Cb -0.10 -1.65 -0.05 0.00 -1.46 0.00 0.00 37.83 34.58 1ai7 s LYS 200 CO 0.19 0.44 -0.14 -0.06 0.16 0.00 0.00 175.35 175.94 1ai7 s PHE 201 N -0.60 2.41 0.10 4.03 0.40 -1.26 -5.12 117.98 117.95 1ai7 s PHE 201 Ca 0.08 -0.30 -0.30 0.00 -0.60 0.00 0.00 56.93 55.81 1ai7 s PHE 201 Cb -0.08 -1.06 -0.06 0.00 0.51 0.00 0.00 43.02 42.33 1ai7 s PHE 201 CO 0.00 0.69 1.09 1.21 0.70 0.00 0.00 175.22 178.90 1ai7 s ASN 202 N -3.56 7.27 -0.33 1.36 3.84 -1.26 -4.96 114.94 117.30 1ai7 s ASN 202 Ca 0.30 1.95 0.12 0.00 0.21 0.00 0.00 52.86 55.44 1ai7 s ASN 202 Cb -0.05 -2.59 0.46 0.00 -0.55 0.00 0.00 41.25 38.52 1ai7 s ASN 202 CO 0.16 -0.27 1.10 0.00 -2.79 0.00 0.00 177.10 175.30 1ai7 n GLN 203 N 3.14 2.69 -0.00 0.43 10.64 -1.26 -4.67 117.38 128.35 1ai7 n GLN 203 Ca 0.05 -3.95 0.00 0.00 -1.83 0.00 0.00 57.00 51.27 1ai7 n GLN 203 Cb 0.47 -1.93 0.00 0.00 -0.86 0.00 0.00 30.24 27.93 1ai7 n GLN 203 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1ai7 n GLN 204 N -0.49 1.64 -3.71 2.61 1.13 -1.26 -5.00 117.38 112.30 1ai7 n GLN 204 Ca 0.28 -1.06 -0.22 0.00 -1.94 0.00 0.00 57.00 54.06 1ai7 n GLN 204 Cb 0.81 -0.78 0.03 0.00 0.11 0.00 0.00 30.24 30.42 1ai7 n GLN 204 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1ai7 n ASN 205 N -0.28 -1.61 0.03 1.08 5.15 -1.26 -4.88 115.26 113.49 1ai7 n ASN 205 Ca 0.00 -0.81 0.03 0.00 -0.60 0.00 0.00 54.58 53.20 1ai7 n ASN 205 Cb 0.37 -4.08 0.13 0.00 -0.53 0.00 0.00 39.78 35.67 1ai7 n ASN 205 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1ai7 n SER 206 N -3.04 0.10 0.00 1.20 7.64 -1.26 -2.59 113.62 115.68 1ai7 n SER 206 Ca -0.26 0.55 0.08 0.00 1.01 0.00 0.00 58.87 60.25 1ai7 n SER 206 Cb 0.66 -0.56 0.50 0.00 -1.01 0.00 0.00 64.21 63.80 1ai7 n SER 206 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ai7 n GLN 207 N -1.64 0.77 0.00 1.43 0.00 -1.26 -5.23 117.38 111.46 1ai7 n GLN 207 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 57.00 57.08 1ai7 n GLN 207 Cb 0.03 -1.34 0.07 0.00 0.00 0.00 0.00 30.24 29.00 1ai7 n GLN 207 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31