#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ai5 h SER 4 N 0.00 0.00 0.10 -3.46 0.02 -2.02 -3.24 113.55 104.95 1ai5 h SER 4 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ai5 h SER 4 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ai5 h SER 4 CO 0.00 0.00 -0.79 -1.54 -1.14 0.00 0.00 176.83 173.36 1ai5 n SER 5 N -2.37 1.07 -4.74 3.07 3.41 -1.26 -4.80 113.62 108.00 1ai5 n SER 5 Ca 0.05 -0.93 -0.39 0.00 -0.26 0.00 0.00 58.87 57.33 1ai5 n SER 5 Cb 0.42 0.74 -0.05 0.00 -0.26 0.00 0.00 64.21 65.06 1ai5 n SER 5 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ai5 s GLU 6 N -2.90 4.40 -0.16 4.33 2.12 -1.22 -5.06 118.70 120.20 1ai5 s GLU 6 Ca 0.11 0.84 0.02 0.00 0.36 0.00 0.00 54.97 56.30 1ai5 s GLU 6 Cb 0.17 -3.39 0.01 0.00 0.26 0.00 0.00 34.13 31.18 1ai5 s GLU 6 CO 0.78 0.24 -0.20 0.42 -0.54 0.00 0.00 175.26 175.95 1ai5 s ILE 7 N 0.21 2.13 -0.22 -3.70 1.01 -1.26 -4.55 121.20 114.82 1ai5 s ILE 7 Ca 0.35 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 59.99 1ai5 s ILE 7 Cb -0.18 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 1ai5 s ILE 7 CO 0.18 0.54 0.07 -0.75 0.00 0.00 0.00 174.94 174.98 1ai5 s LYS 8 N 1.05 3.81 -0.28 2.79 2.20 -0.07 -4.96 119.74 124.27 1ai5 s LYS 8 Ca -0.01 -0.41 -0.06 0.00 -0.36 0.00 0.00 55.97 55.13 1ai5 s LYS 8 Cb -0.14 -3.28 0.01 0.00 -1.51 0.00 0.00 37.83 32.91 1ai5 s LYS 8 CO -0.07 0.03 0.05 0.42 -0.36 0.00 0.00 175.35 175.42 1ai5 s ILE 9 N 1.04 3.77 -0.17 5.43 1.01 -1.26 -1.12 121.20 129.89 1ai5 s ILE 9 Ca 0.04 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 1ai5 s ILE 9 Cb -0.14 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 1ai5 s ILE 9 CO 0.03 0.12 -0.06 -0.69 0.00 0.00 0.00 174.94 174.34 1ai5 s VAL 10 N 1.47 3.49 -0.09 2.92 1.01 -0.84 -4.95 120.40 123.41 1ai5 s VAL 10 Ca 0.02 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 1ai5 s VAL 10 Cb -0.17 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 1ai5 s VAL 10 CO 0.01 0.47 0.05 -0.13 0.00 0.00 0.00 175.10 175.50 1ai5 s ARG 11 N 0.78 3.11 0.00 2.72 0.52 -1.26 -0.77 118.95 124.05 1ai5 s ARG 11 Ca -0.02 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 54.85 1ai5 s ARG 11 Cb -0.15 -2.91 0.00 0.00 0.52 0.00 0.00 34.95 32.42 1ai5 s ARG 11 CO 0.02 0.72 0.00 -0.40 0.02 0.00 0.00 175.30 175.66 1ai5 n ASP 12 N 2.01 0.00 0.21 0.23 5.75 -0.48 -4.84 116.55 119.42 1ai5 n ASP 12 Ca -0.19 -0.98 0.14 0.00 -0.01 0.00 0.00 54.79 53.76 1ai5 n ASP 12 Cb 0.54 0.00 0.73 0.00 -1.03 0.00 0.00 41.12 41.36 1ai5 n ASP 12 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1ai5 h GLU 13 N 0.00 0.00 -0.48 0.11 3.07 -2.00 0.59 114.58 115.88 1ai5 h GLU 13 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ai5 h GLU 13 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1ai5 h GLU 13 CO 0.00 0.00 0.00 0.66 -1.40 0.00 0.00 179.01 178.27 1ai5 n TYR 14 N -2.50 0.70 -0.64 4.33 4.01 -1.26 -4.93 117.16 116.87 1ai5 n TYR 14 Ca -0.01 -0.53 0.00 0.00 -0.16 0.00 0.00 57.90 57.20 1ai5 n TYR 14 Cb 0.09 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 1ai5 n TYR 14 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ai5 n GLY 15 N 0.83 0.75 3.69 2.72 0.00 0.20 -5.00 105.19 108.38 1ai5 n GLY 15 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1ai5 n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ai5 s MET 16 N -0.36 4.38 0.28 1.61 0.00 -1.26 -4.61 119.30 119.34 1ai5 s MET 16 Ca 0.00 1.60 -0.28 0.00 0.00 0.00 0.00 55.69 57.01 1ai5 s MET 16 Cb 0.00 -3.53 -0.09 0.00 0.00 0.00 0.00 34.83 31.20 1ai5 s MET 16 CO 0.00 -0.38 0.98 -1.25 0.00 0.00 0.00 175.02 174.37 1ai5 s PRO 17 N 2.02 4.69 -0.10 4.11 0.04 -1.26 -1.38 135.00 143.12 1ai5 s PRO 17 Ca 0.54 1.52 0.03 0.00 0.04 0.00 0.00 61.00 63.14 1ai5 s PRO 17 Cb -0.23 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1ai5 s PRO 17 CO 0.22 0.34 -0.21 -1.01 0.04 0.00 0.00 177.00 176.38 1ai5 s HIS 18 N -1.32 2.30 -0.14 0.56 3.76 0.05 -4.98 115.29 115.53 1ai5 s HIS 18 Ca 0.45 -0.95 -0.02 0.00 -0.15 0.00 0.00 55.06 54.40 1ai5 s HIS 18 Cb -0.25 -1.57 -0.02 0.00 1.11 0.00 0.00 32.58 31.85 1ai5 s HIS 18 CO 0.32 -0.40 -0.09 0.42 -0.85 0.00 0.00 174.74 174.13 1ai5 s ILE 19 N 0.46 3.40 -0.16 0.60 -1.09 -1.26 -1.99 121.20 121.16 1ai5 s ILE 19 Ca -0.17 -0.54 0.01 0.00 -2.23 0.00 0.00 60.65 57.72 1ai5 s ILE 19 Cb -0.17 -2.46 0.02 0.00 -1.58 0.00 0.00 42.46 38.27 1ai5 s ILE 19 CO 0.07 0.51 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.82 1ai5 s TYR 20 N 0.36 2.39 0.24 3.97 1.51 -0.28 -5.01 117.35 120.52 1ai5 s TYR 20 Ca -0.08 -1.38 -0.19 0.00 -1.01 0.00 0.00 57.07 54.41 1ai5 s TYR 20 Cb -0.15 -1.71 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 1ai5 s TYR 20 CO 0.05 -0.72 0.60 0.00 -1.11 0.00 0.00 175.55 174.37 1ai5 s ALA 21 N 1.42 -1.00 -0.42 3.71 0.00 -1.26 -0.90 121.76 123.31 1ai5 s ALA 21 Ca 0.05 -0.30 0.08 0.00 0.00 0.00 0.00 51.96 51.79 1ai5 s ALA 21 Cb -0.13 0.89 -0.08 0.00 0.00 0.00 0.00 23.12 23.80 1ai5 s ALA 21 CO -0.11 -0.91 0.36 0.09 0.00 0.00 0.00 175.76 175.19 1ai5 n ASN 22 N -0.40 0.46 -4.28 0.00 4.13 -1.26 -4.88 115.26 109.02 1ai5 n ASN 22 Ca -0.07 -0.73 -0.15 0.00 1.68 0.00 0.00 54.58 55.31 1ai5 n ASN 22 Cb 0.61 0.94 -0.10 0.00 -1.54 0.00 0.00 39.78 39.69 1ai5 n ASN 22 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 1ai5 s ASP 23 N -1.70 0.91 0.09 6.41 1.47 -1.26 -5.05 116.67 117.55 1ai5 s ASP 23 Ca 0.03 -1.38 -0.29 0.00 1.18 0.00 0.00 52.55 52.10 1ai5 s ASP 23 Cb 0.06 0.22 -0.14 0.00 -0.34 0.00 0.00 42.92 42.72 1ai5 s ASP 23 CO 0.32 -0.76 1.65 0.74 0.68 0.00 0.00 175.17 177.80 1ai5 h THR 24 N 2.45 0.49 -0.90 2.11 2.02 -1.96 -1.11 112.91 116.01 1ai5 h THR 24 Ca -0.38 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.90 1ai5 h THR 24 Cb 1.25 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 68.07 1ai5 h THR 24 CO 0.59 0.00 0.54 -0.25 0.37 0.00 0.00 175.52 176.77 1ai5 h TRP 25 N -0.57 0.99 -0.31 3.16 7.01 -1.94 -0.89 115.95 123.41 1ai5 h TRP 25 Ca -0.02 0.03 -0.17 0.00 2.11 0.00 0.00 58.89 60.83 1ai5 h TRP 25 Cb 0.49 -0.31 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 1ai5 h TRP 25 CO -0.13 0.43 -0.48 0.45 -2.79 0.00 0.00 178.44 175.92 1ai5 h HIS 26 N 0.92 1.07 -0.00 2.65 3.86 -1.87 -1.76 115.15 120.02 1ai5 h HIS 26 Ca 0.42 -0.37 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 1ai5 h HIS 26 Cb 0.34 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.56 1ai5 h HIS 26 CO -0.03 1.19 -0.23 1.25 0.86 0.00 0.00 177.93 180.97 1ai5 h LEU 27 N 0.65 -0.67 -0.61 2.43 5.85 -0.56 -1.29 115.31 121.11 1ai5 h LEU 27 Ca 0.03 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1ai5 h LEU 27 Cb 1.08 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 1ai5 h LEU 27 CO 0.11 -0.30 -0.01 -0.26 -0.34 0.00 0.00 178.44 177.64 1ai5 h PHE 28 N -0.36 0.00 -0.40 1.25 0.04 -1.26 -2.03 116.94 114.18 1ai5 h PHE 28 Ca 0.06 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.71 1ai5 h PHE 28 Cb 0.44 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1ai5 h PHE 28 CO -0.27 0.01 -0.21 -0.92 -0.60 0.00 0.00 178.31 176.33 1ai5 h TYR 29 N 0.00 0.97 -0.70 -0.55 5.03 -1.08 -1.75 116.97 118.90 1ai5 h TYR 29 Ca -0.00 -0.25 0.05 0.00 2.58 0.00 0.00 58.73 61.11 1ai5 h TYR 29 Cb 0.80 -0.22 -0.05 0.00 1.55 0.00 0.00 36.73 38.81 1ai5 h TYR 29 CO 0.00 1.02 0.41 0.78 -1.32 0.00 0.00 178.16 179.05 1ai5 h GLY 30 N 0.65 1.03 0.96 1.82 0.00 -0.53 -2.12 103.07 104.88 1ai5 h GLY 30 Ca 0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1ai5 h GLY 30 CO 0.06 0.21 -0.19 -1.82 0.00 0.00 0.00 176.54 174.80 1ai5 h TYR 31 N 0.78 -0.50 -0.59 5.60 5.03 -1.36 -1.54 116.97 124.39 1ai5 h TYR 31 Ca 0.30 -0.01 0.11 0.00 2.58 0.00 0.00 58.73 61.71 1ai5 h TYR 31 Cb 0.13 0.17 -0.08 0.00 1.55 0.00 0.00 36.73 38.50 1ai5 h TYR 31 CO -0.06 -0.30 0.13 0.78 -1.32 0.00 0.00 178.16 177.39 1ai5 h GLY 32 N -0.51 0.76 0.94 1.82 0.00 -1.22 -1.37 103.07 103.49 1ai5 h GLY 32 Ca -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1ai5 h GLY 32 CO 0.06 -0.10 0.15 -1.82 0.00 0.00 0.00 176.54 174.83 1ai5 h TYR 33 N 0.27 0.61 -0.21 5.60 3.20 -1.01 -2.04 116.97 123.39 1ai5 h TYR 33 Ca 0.31 -0.05 -0.15 0.00 3.14 0.00 0.00 58.73 61.97 1ai5 h TYR 33 Cb 0.45 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1ai5 h TYR 33 CO -0.24 0.56 -0.50 -0.39 -1.64 0.00 0.00 178.16 175.94 1ai5 h VAL 34 N 0.49 1.31 -0.32 1.81 -1.51 -0.91 -1.60 116.25 115.53 1ai5 h VAL 34 Ca 0.13 -1.72 0.05 0.00 -1.23 0.00 0.00 66.70 63.93 1ai5 h VAL 34 Cb 0.21 1.69 -0.05 0.00 -2.13 0.00 0.00 31.29 31.01 1ai5 h VAL 34 CO -0.01 0.54 0.01 0.58 -1.23 0.00 0.00 177.57 177.46 1ai5 h VAL 35 N 0.46 0.77 -0.16 7.19 2.07 -1.26 0.12 116.25 125.44 1ai5 h VAL 35 Ca 0.02 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1ai5 h VAL 35 Cb 1.04 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1ai5 h VAL 35 CO 0.10 0.02 0.11 0.00 0.02 0.00 0.00 177.57 177.82 1ai5 h ALA 36 N 1.27 1.98 -0.21 1.67 0.00 -1.17 0.30 119.26 123.09 1ai5 h ALA 36 Ca 0.15 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1ai5 h ALA 36 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ai5 h ALA 36 CO -0.25 0.00 -0.40 1.96 0.00 0.00 0.00 179.25 180.56 1ai5 h GLN 37 N 0.15 0.65 0.12 0.00 4.20 0.18 -3.32 115.11 117.09 1ai5 h GLN 37 Ca 0.07 -0.41 -0.34 0.00 0.06 0.00 0.00 58.65 58.03 1ai5 h GLN 37 Cb 0.09 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1ai5 h GLN 37 CO -0.01 1.03 -1.78 -0.44 -0.67 0.00 0.00 178.83 176.95 1ai5 h ASP 38 N 0.34 0.40 -0.41 1.46 3.32 -0.66 -3.42 116.42 117.44 1ai5 h ASP 38 Ca 0.01 -0.72 -0.29 0.00 0.02 0.00 0.00 57.03 56.06 1ai5 h ASP 38 Cb 1.00 -0.13 -0.38 0.00 0.22 0.00 0.00 39.33 40.04 1ai5 h ASP 38 CO 0.09 1.62 -1.01 0.54 -1.72 0.00 0.00 179.24 178.76 1ai5 n ARG 39 N -3.44 1.89 -0.19 3.56 5.12 0.10 -4.95 116.66 118.75 1ai5 n ARG 39 Ca -0.24 -3.43 -0.09 0.00 -1.93 0.00 0.00 57.85 52.16 1ai5 n ARG 39 Cb 1.05 -1.53 0.01 0.00 -1.16 0.00 0.00 32.46 30.84 1ai5 n ARG 39 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1ai5 h LEU 40 N 2.19 0.87 -0.51 0.55 5.85 -1.65 -0.38 115.31 122.23 1ai5 h LEU 40 Ca -0.03 -0.27 -0.14 0.00 0.84 0.00 0.00 57.88 58.27 1ai5 h LEU 40 Cb 1.41 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 1ai5 h LEU 40 CO 0.29 0.93 -0.33 0.15 -0.34 0.00 0.00 178.44 179.13 1ai5 h PHE 41 N 0.78 1.00 -0.47 1.25 3.57 -1.92 -1.55 116.94 119.60 1ai5 h PHE 41 Ca 0.16 -0.28 0.00 0.00 3.53 0.00 0.00 57.97 61.39 1ai5 h PHE 41 Cb 0.44 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1ai5 h PHE 41 CO 0.03 1.06 0.30 0.37 -2.23 0.00 0.00 178.31 177.85 1ai5 h GLN 42 N 0.71 0.63 -0.49 1.11 4.15 -1.88 -0.10 115.11 119.24 1ai5 h GLN 42 Ca 0.07 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.38 1ai5 h GLN 42 Cb 0.90 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 1ai5 h GLN 42 CO 0.08 0.43 0.02 0.52 -1.93 0.00 0.00 178.83 177.96 1ai5 h MET 43 N 0.64 0.81 -0.01 1.69 2.86 -0.99 0.86 114.93 120.78 1ai5 h MET 43 Ca 0.17 -0.21 -0.15 0.00 -2.06 0.00 0.00 59.70 57.46 1ai5 h MET 43 Cb -0.05 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.49 1ai5 h MET 43 CO -0.04 0.80 -0.67 1.49 1.06 0.00 0.00 176.91 179.55 1ai5 h GLU 44 N 0.76 0.06 0.00 1.72 4.57 -0.55 -0.38 114.58 120.75 1ai5 h GLU 44 Ca 0.15 -0.05 -0.20 0.00 -1.18 0.00 0.00 59.36 58.08 1ai5 h GLU 44 Cb 0.43 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 1ai5 h GLU 44 CO 0.02 0.71 -1.01 0.52 -1.18 0.00 0.00 179.01 178.07 1ai5 h MET 45 N 0.04 0.00 -0.49 1.92 2.86 -0.41 -2.28 114.93 116.57 1ai5 h MET 45 Ca -0.01 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 1ai5 h MET 45 Cb 1.20 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 1ai5 h MET 45 CO 0.09 0.84 -0.17 0.00 1.06 0.00 0.00 176.91 178.74 1ai5 h ALA 46 N 1.09 0.76 -0.55 6.32 0.00 -0.74 0.10 119.26 126.25 1ai5 h ALA 46 Ca -0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1ai5 h ALA 46 Cb 1.73 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1ai5 h ALA 46 CO 0.11 0.67 0.21 -0.09 0.00 0.00 0.00 179.25 180.14 1ai5 h ARG 47 N 0.85 0.83 -0.01 0.00 2.43 -0.98 -0.66 114.38 116.84 1ai5 h ARG 47 Ca 0.12 -0.16 -0.11 0.00 -0.81 0.00 0.00 59.98 59.03 1ai5 h ARG 47 Cb 0.73 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 1ai5 h ARG 47 CO 0.06 0.73 -0.50 0.00 -1.51 0.00 0.00 179.97 178.75 1ai5 h ARG 48 N 0.75 0.03 -0.29 0.20 3.08 -1.16 -2.85 114.38 114.14 1ai5 h ARG 48 Ca 0.18 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.09 1ai5 h ARG 48 Cb 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1ai5 h ARG 48 CO -0.01 0.52 -0.29 0.77 -1.07 0.00 0.00 179.97 179.89 1ai5 h SER 49 N 0.03 0.76 0.85 7.04 0.02 -0.36 0.53 113.55 122.42 1ai5 h SER 49 Ca -0.00 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1ai5 h SER 49 Cb 0.89 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1ai5 h SER 49 CO 0.07 1.08 0.00 0.35 -1.14 0.00 0.00 176.83 177.18 1ai5 n THR 50 N -4.25 0.05 0.19 -2.27 -2.24 -0.29 -3.37 114.28 102.10 1ai5 n THR 50 Ca -0.04 0.01 0.02 0.00 -2.27 0.00 0.00 64.05 61.78 1ai5 n THR 50 Cb 0.47 -0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 1ai5 n THR 50 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ai5 n GLN 51 N -1.44 5.05 -2.29 -0.78 6.02 -1.08 -4.75 117.38 118.10 1ai5 n GLN 51 Ca 0.09 -0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.03 1ai5 n GLN 51 Cb 0.30 -0.75 0.02 0.00 1.02 0.00 0.00 30.24 30.84 1ai5 n GLN 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ai5 n GLY 52 N 1.21 0.24 1.58 1.08 0.00 0.00 -4.68 105.19 104.63 1ai5 n GLY 52 Ca 0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 46.02 45.77 1ai5 n GLY 52 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ai5 n THR 53 N -1.93 1.54 0.03 2.61 -2.24 -0.20 -4.78 114.28 109.32 1ai5 n THR 53 Ca -0.06 -2.84 -0.19 0.00 -2.27 0.00 0.00 64.05 58.68 1ai5 n THR 53 Cb 0.54 0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.84 1ai5 n THR 53 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ai5 h VAL 54 N 3.68 1.28 0.00 2.28 2.07 -1.91 -3.28 116.25 120.38 1ai5 h VAL 54 Ca 0.00 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1ai5 h VAL 54 Cb 1.41 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 33.50 1ai5 h VAL 54 CO 0.24 0.69 0.00 0.00 0.02 0.00 0.00 177.57 178.52 1ai5 h ALA 55 N 0.44 1.00 -0.15 1.67 0.00 -1.79 0.50 119.26 120.93 1ai5 h ALA 55 Ca -0.12 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1ai5 h ALA 55 Cb 1.65 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1ai5 h ALA 55 CO 0.20 0.00 -0.23 0.93 0.00 0.00 0.00 179.25 180.15 1ai5 h GLU 56 N 0.00 0.27 0.00 0.00 5.08 -1.88 0.83 114.58 118.88 1ai5 h GLU 56 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ai5 h GLU 56 Cb 0.29 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1ai5 h GLU 56 CO 0.00 0.49 -1.50 1.33 -1.00 0.00 0.00 179.01 178.33 1ai5 n VAL 57 N -4.18 0.00 0.09 3.13 0.24 -0.92 -4.71 118.33 111.98 1ai5 n VAL 57 Ca -0.01 -0.30 0.01 0.00 -2.04 0.00 0.00 64.34 62.00 1ai5 n VAL 57 Cb 0.35 0.29 -0.00 0.00 -1.47 0.00 0.00 33.84 33.00 1ai5 n VAL 57 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ai5 n LEU 58 N -1.89 0.42 0.00 1.34 4.77 0.12 -5.01 117.00 116.74 1ai5 n LEU 58 Ca -0.02 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1ai5 n LEU 58 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1ai5 n LEU 58 CO 0.29 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1ai5 n GLY 59 N 0.77 -1.78 0.39 -0.72 0.00 0.28 -4.63 105.19 99.50 1ai5 n GLY 59 Ca 0.01 -1.92 0.17 0.00 0.00 0.00 0.00 46.02 44.28 1ai5 n GLY 59 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ai5 h LYS 60 N 0.00 0.42 0.00 1.61 2.10 -1.98 -1.91 116.57 116.82 1ai5 h LYS 60 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1ai5 h LYS 60 Cb 0.00 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.24 1ai5 h LYS 60 CO 0.00 0.28 0.00 -0.25 -2.00 0.00 0.00 179.45 177.48 1ai5 n ASP 61 N -4.50 0.18 -0.76 7.07 8.00 -1.26 -2.50 116.55 122.79 1ai5 n ASP 61 Ca 0.17 0.56 0.07 0.00 0.71 0.00 0.00 54.79 56.31 1ai5 n ASP 61 Cb 0.62 -0.60 0.15 0.00 -0.02 0.00 0.00 41.12 41.28 1ai5 n ASP 61 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ai5 n PHE 62 N -1.72 0.41 -0.09 1.24 3.01 -0.72 -4.70 117.46 114.88 1ai5 n PHE 62 Ca 0.01 -0.33 -0.09 0.00 1.01 0.00 0.00 57.45 58.05 1ai5 n PHE 62 Cb 0.10 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.54 1ai5 n PHE 62 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1ai5 h VAL 63 N 2.74 1.13 -0.52 -4.37 2.07 -1.64 -1.44 116.25 114.23 1ai5 h VAL 63 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1ai5 h VAL 63 Cb 0.74 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1ai5 h VAL 63 CO 0.00 0.13 0.34 0.50 0.02 0.00 0.00 177.57 178.56 1ai5 h LYS 64 N 0.38 0.69 0.14 1.57 3.64 -1.84 -0.91 116.57 120.24 1ai5 h LYS 64 Ca 0.11 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1ai5 h LYS 64 Cb 0.06 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1ai5 h LYS 64 CO -0.02 0.47 -0.33 0.35 -2.27 0.00 0.00 179.45 177.66 1ai5 h PHE 65 N 0.70 -0.89 -0.51 1.91 3.57 -1.82 0.56 116.94 120.46 1ai5 h PHE 65 Ca 0.19 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.71 1ai5 h PHE 65 Cb -0.06 0.37 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 1ai5 h PHE 65 CO -0.04 -0.44 0.34 -0.44 -2.23 0.00 0.00 178.31 175.51 1ai5 h ASP 66 N -0.57 0.58 -0.84 0.41 3.32 -0.96 -1.22 116.42 117.14 1ai5 h ASP 66 Ca 0.02 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1ai5 h ASP 66 Cb 0.59 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 1ai5 h ASP 66 CO -0.18 0.42 0.50 0.11 -1.72 0.00 0.00 179.24 178.37 1ai5 h LYS 67 N 0.69 1.16 -0.64 3.56 1.57 -0.90 -1.60 116.57 120.40 1ai5 h LYS 67 Ca 0.19 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 1ai5 h LYS 67 Cb -0.07 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 31.97 1ai5 h LYS 67 CO -0.04 0.82 0.20 -0.44 -0.57 0.00 0.00 179.45 179.41 1ai5 h ASP 68 N 1.17 0.94 -0.35 0.86 3.32 -0.23 -1.67 116.42 120.47 1ai5 h ASP 68 Ca 0.30 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1ai5 h ASP 68 Cb -0.03 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1ai5 h ASP 68 CO -0.06 0.90 0.18 0.40 -1.72 0.00 0.00 179.24 178.94 1ai5 h ILE 69 N 0.93 1.15 -0.39 0.35 1.08 -0.92 -3.01 117.51 116.71 1ai5 h ILE 69 Ca 0.21 -0.41 -0.10 0.00 -0.39 0.00 0.00 64.86 64.16 1ai5 h ILE 69 Cb 0.30 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 1ai5 h ILE 69 CO -0.01 0.16 -0.17 0.03 -0.69 0.00 0.00 178.15 177.47 1ai5 h ARG 70 N 0.43 0.72 0.00 2.37 3.08 -1.06 -2.65 114.38 117.27 1ai5 h ARG 70 Ca 0.12 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1ai5 h ARG 70 Cb 0.09 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1ai5 h ARG 70 CO -0.02 0.85 0.00 0.00 -1.07 0.00 0.00 179.97 179.73 1ai5 h ARG 71 N 0.64 0.00 -0.33 0.04 3.08 -1.30 -3.10 114.38 113.41 1ai5 h ARG 71 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1ai5 h ARG 71 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1ai5 h ARG 71 CO 0.05 0.00 0.00 -1.71 -1.07 0.00 0.00 179.97 177.24 1ai5 n ASN 72 N -2.91 1.95 -3.39 7.04 5.15 -1.00 -4.95 115.26 117.16 1ai5 n ASN 72 Ca -0.00 -1.93 -0.12 0.00 -0.60 0.00 0.00 54.58 51.93 1ai5 n ASN 72 Cb 0.23 -0.22 -0.03 0.00 -0.53 0.00 0.00 39.78 39.23 1ai5 n ASN 72 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1ai5 s TYR 73 N -1.56 0.63 -0.39 1.20 1.13 -1.17 -5.05 117.35 112.14 1ai5 s TYR 73 Ca 0.27 -1.01 0.01 0.00 -1.41 0.00 0.00 57.07 54.93 1ai5 s TYR 73 Cb 0.14 0.22 0.13 0.00 -1.10 0.00 0.00 41.96 41.35 1ai5 s TYR 73 CO 0.19 -1.20 0.21 -0.46 -2.51 0.00 0.00 175.55 171.79 1ai5 s TRP 74 N -3.16 1.41 0.35 -3.49 -0.11 -1.26 -4.99 118.94 107.69 1ai5 s TRP 74 Ca 0.24 -2.00 0.08 0.00 1.22 0.00 0.00 56.10 55.64 1ai5 s TRP 74 Cb -0.02 -1.46 0.78 0.00 -1.50 0.00 0.00 33.47 31.27 1ai5 s TRP 74 CO 0.15 -0.81 1.88 -1.00 -4.62 0.00 0.00 176.95 172.55 1ai5 h PRO 75 N 7.02 0.71 -0.59 5.86 0.13 -2.00 -1.72 132.00 141.41 1ai5 h PRO 75 Ca -0.00 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 1ai5 h PRO 75 Cb 0.95 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.90 1ai5 h PRO 75 CO 0.39 0.47 0.30 -0.44 -0.23 0.00 0.00 178.00 178.49 1ai5 h ASP 76 N 0.73 0.73 -0.45 1.44 3.32 -1.99 -0.21 116.42 119.99 1ai5 h ASP 76 Ca 0.43 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 1ai5 h ASP 76 Cb 0.61 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1ai5 h ASP 76 CO -0.19 0.60 0.26 0.00 -1.72 0.00 0.00 179.24 178.19 1ai5 h ALA 77 N 1.51 1.55 -0.04 3.45 0.00 -1.75 -0.57 119.26 123.42 1ai5 h ALA 77 Ca 0.21 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ai5 h ALA 77 Cb 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1ai5 h ALA 77 CO -0.03 0.37 -0.15 0.82 0.00 0.00 0.00 179.25 180.26 1ai5 h ILE 78 N 0.66 1.47 -0.77 0.00 1.08 -1.06 -2.86 117.51 116.03 1ai5 h ILE 78 Ca 0.17 -1.60 0.11 0.00 -0.39 0.00 0.00 64.86 63.15 1ai5 h ILE 78 Cb 0.03 2.41 -0.05 0.00 -3.07 0.00 0.00 36.82 36.14 1ai5 h ILE 78 CO -0.03 0.44 0.51 0.03 -0.69 0.00 0.00 178.15 178.41 1ai5 h ARG 79 N -0.39 0.60 0.00 2.37 3.08 -1.11 0.35 114.38 119.28 1ai5 h ARG 79 Ca -0.01 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1ai5 h ARG 79 Cb 0.79 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1ai5 h ARG 79 CO 0.03 0.40 -0.28 0.00 -1.07 0.00 0.00 179.97 179.05 1ai5 h ALA 80 N 1.62 1.39 -0.02 0.04 0.00 -1.10 0.77 119.26 121.96 1ai5 h ALA 80 Ca 0.37 -0.26 -0.24 0.00 0.00 0.00 0.00 54.91 54.78 1ai5 h ALA 80 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1ai5 h ALA 80 CO -0.14 0.35 -0.95 1.96 0.00 0.00 0.00 179.25 180.48 1ai5 h GLN 81 N 0.00 0.58 -0.57 0.00 4.20 -0.72 -2.92 115.11 115.67 1ai5 h GLN 81 Ca -0.00 -0.59 -0.10 0.00 0.06 0.00 0.00 58.65 58.02 1ai5 h GLN 81 Cb 0.55 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 1ai5 h GLN 81 CO 0.04 1.21 -0.05 0.82 -0.67 0.00 0.00 178.83 180.17 1ai5 h ILE 82 N 0.34 1.27 0.00 2.54 2.04 -0.43 -2.79 117.51 120.48 1ai5 h ILE 82 Ca -0.09 -1.20 0.00 0.00 1.00 0.00 0.00 64.86 64.57 1ai5 h ILE 82 Cb 1.59 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1ai5 h ILE 82 CO 0.18 0.43 0.00 0.00 0.00 0.00 0.00 178.15 178.76 1ai5 h ALA 83 N 0.95 1.00 -0.11 1.87 0.00 -0.85 -2.01 119.26 120.11 1ai5 h ALA 83 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ai5 h ALA 83 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ai5 h ALA 83 CO 0.04 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1ai5 n ALA 84 N -1.87 2.53 -1.75 0.00 0.00 -1.05 -4.94 120.51 113.43 1ai5 n ALA 84 Ca 0.01 -0.55 -0.34 0.00 0.00 0.00 0.00 53.44 52.55 1ai5 n ALA 84 Cb 0.19 -1.07 -0.00 0.00 0.00 0.00 0.00 19.45 18.57 1ai5 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ai5 s LEU 85 N -1.77 3.73 0.86 0.00 1.43 -0.76 -5.03 118.68 117.15 1ai5 s LEU 85 Ca 0.35 2.07 -0.11 0.00 -1.03 0.00 0.00 54.13 55.40 1ai5 s LEU 85 Cb 0.20 -4.57 0.11 0.00 0.03 0.00 0.00 46.19 41.95 1ai5 s LEU 85 CO 0.30 -1.12 1.09 -0.94 0.23 0.00 0.00 176.35 175.91 1ai5 s SER 86 N -1.96 3.77 0.24 2.29 1.04 -1.26 -4.77 113.70 113.05 1ai5 s SER 86 Ca 0.70 1.57 -0.05 0.00 0.48 0.00 0.00 55.95 58.64 1ai5 s SER 86 Cb -0.21 -2.25 0.35 0.00 0.10 0.00 0.00 66.02 64.00 1ai5 s SER 86 CO 0.27 -2.46 1.83 -0.65 0.98 0.00 0.00 173.24 173.21 1ai5 h PRO 87 N -1.42 0.86 -0.23 4.02 0.11 -1.98 -0.46 132.00 132.89 1ai5 h PRO 87 Ca -0.48 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 1ai5 h PRO 87 Cb 1.27 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1ai5 h PRO 87 CO 0.54 0.57 0.08 1.49 -0.21 0.00 0.00 178.00 180.46 1ai5 h GLU 88 N 0.88 0.35 -0.59 1.05 4.57 -2.00 -2.08 114.58 116.77 1ai5 h GLU 88 Ca 0.37 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.39 1ai5 h GLU 88 Cb 0.24 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1ai5 h GLU 88 CO -0.20 0.43 0.00 -0.44 -1.18 0.00 0.00 179.01 177.63 1ai5 h ASP 89 N 0.21 0.99 -0.23 1.04 3.32 -1.81 -2.88 116.42 117.05 1ai5 h ASP 89 Ca 0.07 -0.27 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 1ai5 h ASP 89 Cb 0.22 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1ai5 h ASP 89 CO -0.00 1.04 -0.03 -0.03 -1.72 0.00 0.00 179.24 178.49 1ai5 h MET 90 N 0.93 0.56 -0.86 3.56 4.05 -0.95 -2.62 114.93 119.61 1ai5 h MET 90 Ca 0.17 -0.14 0.12 0.00 -0.28 0.00 0.00 59.70 59.57 1ai5 h MET 90 Cb 0.53 -0.07 -0.08 0.00 -0.80 0.00 0.00 31.60 31.18 1ai5 h MET 90 CO 0.03 0.61 0.48 0.77 0.23 0.00 0.00 176.91 179.03 1ai5 h SER 91 N 0.53 0.65 -0.23 1.39 0.02 -1.15 0.09 113.55 114.85 1ai5 h SER 91 Ca 0.11 0.07 0.06 0.00 -0.84 0.00 0.00 61.79 61.18 1ai5 h SER 91 Cb 0.39 -0.05 -0.07 0.00 0.14 0.00 0.00 62.40 62.81 1ai5 h SER 91 CO 0.02 0.33 -0.32 0.40 -1.14 0.00 0.00 176.83 176.12 1ai5 h ILE 92 N 0.74 0.28 -0.22 3.27 2.04 -1.47 0.55 117.51 122.70 1ai5 h ILE 92 Ca 0.44 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 66.13 1ai5 h ILE 92 Cb 0.51 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1ai5 h ILE 92 CO -0.30 0.00 -0.54 -0.07 0.00 0.00 0.00 178.15 177.24 1ai5 h LEU 93 N -0.34 0.72 0.16 1.44 3.38 -1.55 -2.12 115.31 117.00 1ai5 h LEU 93 Ca 0.12 -0.38 -0.31 0.00 0.09 0.00 0.00 57.88 57.40 1ai5 h LEU 93 Cb 0.53 -0.21 0.03 0.00 0.09 0.00 0.00 40.66 41.11 1ai5 h LEU 93 CO -0.42 1.12 -1.32 -0.61 0.09 0.00 0.00 178.44 177.31 1ai5 h GLN 94 N 0.50 0.60 -0.20 1.13 5.75 -0.80 -2.58 115.11 119.52 1ai5 h GLN 94 Ca 0.01 -0.86 0.05 0.00 -0.15 0.00 0.00 58.65 57.70 1ai5 h GLN 94 Cb 1.10 0.30 -0.05 0.00 1.07 0.00 0.00 27.48 29.90 1ai5 h GLN 94 CO 0.11 1.40 -0.13 0.78 -2.65 0.00 0.00 178.83 178.34 1ai5 h GLY 95 N 0.28 0.03 1.00 2.39 0.00 0.11 0.11 103.07 106.98 1ai5 h GLY 95 Ca -0.21 0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ai5 h GLY 95 CO 0.25 -0.14 -0.05 -1.82 0.00 0.00 0.00 176.54 174.78 1ai5 h TYR 96 N -0.12 -0.12 -0.46 5.60 5.03 -1.34 -0.52 116.97 125.03 1ai5 h TYR 96 Ca 0.12 -0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.44 1ai5 h TYR 96 Cb 0.29 0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.59 1ai5 h TYR 96 CO -0.28 -0.08 0.28 0.00 -1.32 0.00 0.00 178.16 176.76 1ai5 h ALA 97 N 0.76 0.59 -0.56 1.82 0.00 -1.08 -2.21 119.26 118.57 1ai5 h ALA 97 Ca -0.01 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1ai5 h ALA 97 Cb 0.11 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1ai5 h ALA 97 CO 0.02 -0.03 0.25 -0.44 0.00 0.00 0.00 179.25 179.05 1ai5 h ASP 98 N 0.56 0.31 -0.90 0.00 3.32 -0.50 -0.62 116.42 118.59 1ai5 h ASP 98 Ca 0.18 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.30 1ai5 h ASP 98 Cb -0.00 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.51 1ai5 h ASP 98 CO -0.08 0.20 0.59 1.23 -1.72 0.00 0.00 179.24 179.47 1ai5 h GLY 99 N 0.46 1.28 0.89 2.75 0.00 -0.86 -0.67 103.07 106.92 1ai5 h GLY 99 Ca 0.26 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1ai5 h GLY 99 CO -0.22 0.44 0.05 -0.33 0.00 0.00 0.00 176.54 176.47 1ai5 h MET 100 N 1.20 0.51 -0.87 4.80 2.86 -0.97 -2.71 114.93 119.75 1ai5 h MET 100 Ca 0.34 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1ai5 h MET 100 Cb -0.11 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.45 1ai5 h MET 100 CO -0.08 0.62 0.53 -0.91 1.06 0.00 0.00 176.91 178.12 1ai5 h ASN 101 N 0.34 1.05 -0.99 1.22 2.35 -0.63 0.12 115.58 119.03 1ai5 h ASN 101 Ca 0.09 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1ai5 h ASN 101 Cb 0.35 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.40 1ai5 h ASN 101 CO 0.01 0.81 0.65 0.00 -1.65 0.00 0.00 177.43 177.24 1ai5 h ALA 102 N 1.29 1.36 -0.03 -0.83 0.00 -0.83 0.39 119.26 120.61 1ai5 h ALA 102 Ca 0.31 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.96 1ai5 h ALA 102 Cb -0.05 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.40 1ai5 h ALA 102 CO -0.06 0.53 -0.89 2.35 0.00 0.00 0.00 179.25 181.19 1ai5 h TRP 103 N 1.24 0.69 -0.27 0.00 2.91 -1.14 -2.90 115.95 116.47 1ai5 h TRP 103 Ca 0.40 -0.35 -0.07 0.00 1.13 0.00 0.00 58.89 60.00 1ai5 h TRP 103 Cb 0.03 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 28.57 1ai5 h TRP 103 CO -0.00 1.16 -0.12 0.82 -1.03 0.00 0.00 178.44 179.27 1ai5 h ILE 104 N 0.29 1.22 0.09 2.65 2.04 -0.24 -0.84 117.51 122.71 1ai5 h ILE 104 Ca -0.07 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1ai5 h ILE 104 Cb 1.51 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1ai5 h ILE 104 CO 0.16 0.32 -0.07 0.44 0.00 0.00 0.00 178.15 179.00 1ai5 h ASP 105 N 0.42 -0.17 -0.66 1.72 3.32 -0.16 0.81 116.42 121.71 1ai5 h ASP 105 Ca 0.08 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.18 1ai5 h ASP 105 Cb 0.47 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.03 1ai5 h ASP 105 CO 0.03 -0.11 0.39 0.11 -1.72 0.00 0.00 179.24 177.94 1ai5 h LYS 106 N -0.16 0.74 -0.20 3.56 1.57 -1.26 -2.11 116.57 118.70 1ai5 h LYS 106 Ca -0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ai5 h LYS 106 Cb 0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1ai5 h LYS 106 CO -0.01 0.49 0.11 0.28 -0.57 0.00 0.00 179.45 179.75 1ai5 h VAL 107 N 0.76 1.10 0.00 0.50 2.07 -0.78 -1.79 116.25 118.11 1ai5 h VAL 107 Ca 0.28 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1ai5 h VAL 107 Cb 0.08 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1ai5 h VAL 107 CO -0.13 0.10 0.00 0.59 0.02 0.00 0.00 177.57 178.15 1ai5 n ASN 108 N -4.90 0.55 0.01 0.57 3.02 0.25 -2.65 115.26 112.11 1ai5 n ASN 108 Ca -0.04 0.64 -0.05 0.00 -0.03 0.00 0.00 54.58 55.10 1ai5 n ASN 108 Cb 0.07 -0.75 -0.11 0.00 -0.61 0.00 0.00 39.78 38.37 1ai5 n ASN 108 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1ai5 h THR 109 N 0.00 0.81 -2.08 3.41 2.02 -0.87 -3.40 112.91 112.80 1ai5 h THR 109 Ca 0.00 -2.50 -0.51 0.00 0.77 0.00 0.00 66.41 64.17 1ai5 h THR 109 Cb 0.35 2.32 -0.41 0.00 -1.74 0.00 0.00 68.15 68.67 1ai5 h THR 109 CO 0.00 0.46 -1.05 -3.20 0.37 0.00 0.00 175.52 172.10 1ai5 n ASN 110 N -3.03 1.83 0.24 4.18 4.05 -0.72 -4.96 115.26 116.86 1ai5 n ASN 110 Ca -0.12 -3.19 0.16 0.00 0.45 0.00 0.00 54.58 51.88 1ai5 n ASN 110 Cb 0.95 -0.60 0.67 0.00 1.23 0.00 0.00 39.78 42.03 1ai5 n ASN 110 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1ai5 h PRO 111 N 3.00 0.00 0.00 1.20 0.13 -1.73 -2.07 132.00 132.53 1ai5 h PRO 111 Ca 0.11 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.18 1ai5 h PRO 111 Cb 0.84 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 1ai5 h PRO 111 CO 0.59 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 179.02 1ai5 h GLU 112 N 0.00 0.00 0.00 0.86 3.07 -1.93 -2.94 114.58 113.65 1ai5 h GLU 112 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ai5 h GLU 112 Cb 0.44 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1ai5 h GLU 112 CO 0.00 0.27 -1.02 0.25 -1.40 0.00 0.00 179.01 177.11 1ai5 n THR 113 N -4.00 0.00 0.64 1.13 -2.24 -1.10 -4.85 114.28 103.86 1ai5 n THR 113 Ca -0.02 -0.01 0.07 0.00 -2.27 0.00 0.00 64.05 61.82 1ai5 n THR 113 Cb 0.34 0.34 -0.06 0.00 -2.10 0.00 0.00 70.33 68.85 1ai5 n THR 113 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ai5 n LEU 114 N -1.57 0.86 -4.71 3.22 4.77 -0.80 -4.97 117.00 113.81 1ai5 n LEU 114 Ca -0.00 -0.57 -0.41 0.00 -0.03 0.00 0.00 56.01 55.00 1ai5 n LEU 114 Cb 0.06 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1ai5 n LEU 114 CO 0.01 0.19 0.51 -0.22 -1.33 0.00 0.00 177.39 176.55 1ai5 s LEU 115 N -2.45 4.30 0.17 2.23 2.96 -1.11 -4.88 118.68 119.90 1ai5 s LEU 115 Ca 0.07 1.30 -0.33 0.00 -0.22 0.00 0.00 54.13 54.94 1ai5 s LEU 115 Cb 0.11 -3.23 -0.14 0.00 0.50 0.00 0.00 46.19 43.43 1ai5 s LEU 115 CO 0.51 -0.20 1.53 -2.65 -1.32 0.00 0.00 176.35 174.21 1ai5 n PRO 116 N 4.08 2.06 -0.33 0.98 -0.02 -1.26 -4.87 135.00 135.65 1ai5 n PRO 116 Ca 0.02 0.74 0.20 0.00 -2.02 0.00 0.00 63.50 62.44 1ai5 n PRO 116 Cb 0.51 -2.48 0.42 0.00 -0.02 0.00 0.00 33.50 31.93 1ai5 n PRO 116 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ai5 h LYS 117 N 5.46 0.39 -0.37 -0.52 3.64 -1.99 -1.89 116.57 121.28 1ai5 h LYS 117 Ca -0.45 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 58.99 1ai5 h LYS 117 Cb 1.26 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1ai5 h LYS 117 CO 0.85 0.26 0.26 1.96 -2.27 0.00 0.00 179.45 180.51 1ai5 h GLN 118 N 0.40 0.12 -0.94 1.90 7.50 -1.98 -0.50 115.11 121.60 1ai5 h GLN 118 Ca 0.68 -0.01 -0.00 0.00 0.50 0.00 0.00 58.65 59.82 1ai5 h GLN 118 Cb 1.43 -0.03 -0.05 0.00 0.05 0.00 0.00 27.48 28.89 1ai5 h GLN 118 CO -0.57 0.08 0.58 0.74 -1.50 0.00 0.00 178.83 178.16 1ai5 h PHE 119 N 0.12 1.23 0.10 2.96 0.04 -1.62 0.69 116.94 120.46 1ai5 h PHE 119 Ca 0.17 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.94 1ai5 h PHE 119 Cb 0.52 -0.41 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1ai5 h PHE 119 CO -0.00 0.81 -0.05 -0.91 -0.60 0.00 0.00 178.31 177.56 1ai5 h ASN 120 N 1.29 -0.11 -0.49 2.17 2.35 -1.26 0.71 115.58 120.24 1ai5 h ASN 120 Ca 0.34 -0.28 0.10 0.00 -0.55 0.00 0.00 56.30 55.90 1ai5 h ASN 120 Cb -0.08 0.03 -0.08 0.00 0.05 0.00 0.00 38.32 38.24 1ai5 h ASN 120 CO -0.07 0.23 -0.03 0.74 -1.65 0.00 0.00 177.43 176.66 1ai5 h THR 121 N -0.47 0.59 -0.05 2.81 2.02 -0.50 0.29 112.91 117.60 1ai5 h THR 121 Ca -0.01 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1ai5 h THR 121 Cb 0.39 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1ai5 h THR 121 CO 0.02 0.02 0.00 0.49 0.37 0.00 0.00 175.52 176.42 1ai5 n PHE 122 N -5.26 0.05 -2.74 3.16 3.72 0.23 -5.00 117.46 111.63 1ai5 n PHE 122 Ca 0.05 -0.02 -0.09 0.00 -0.05 0.00 0.00 57.45 57.34 1ai5 n PHE 122 Cb 0.26 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.85 1ai5 n PHE 122 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ai5 n GLY 123 N 1.15 0.07 3.70 1.37 0.00 0.16 -4.99 105.19 106.65 1ai5 n GLY 123 Ca 0.19 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 1ai5 n GLY 123 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ai5 s PHE 124 N -3.17 -0.22 0.17 1.61 -0.71 -0.73 -5.03 117.98 109.90 1ai5 s PHE 124 Ca 0.03 -0.07 0.07 0.00 -1.04 0.00 0.00 56.93 55.92 1ai5 s PHE 124 Cb -0.02 0.63 -0.04 0.00 -1.21 0.00 0.00 43.02 42.38 1ai5 s PHE 124 CO 0.35 -0.85 -0.14 0.95 -1.34 0.00 0.00 175.22 174.19 1ai5 s THR 125 N -3.41 1.56 0.43 -4.49 -4.23 -1.26 -4.53 115.64 99.71 1ai5 s THR 125 Ca 0.10 -2.02 -0.25 0.00 -1.18 0.00 0.00 61.69 58.33 1ai5 s THR 125 Cb -0.02 -1.85 -0.08 0.00 1.34 0.00 0.00 72.50 71.88 1ai5 s THR 125 CO -0.00 -0.53 1.36 -2.16 -0.54 0.00 0.00 174.62 172.75 1ai5 s PRO 126 N -3.28 3.79 0.53 3.99 0.04 -1.26 -5.05 135.00 133.76 1ai5 s PRO 126 Ca 0.17 2.28 0.06 0.00 0.04 0.00 0.00 61.00 63.55 1ai5 s PRO 126 Cb -0.02 -2.68 0.03 0.00 0.04 0.00 0.00 34.50 31.87 1ai5 s PRO 126 CO 0.05 -0.68 0.39 0.15 0.04 0.00 0.00 177.00 176.95 1ai5 s LYS 127 N -2.38 2.27 0.28 4.56 1.02 -1.26 -5.02 119.74 119.20 1ai5 s LYS 127 Ca 0.60 -1.99 -0.12 0.00 0.02 0.00 0.00 55.97 54.47 1ai5 s LYS 127 Cb -0.41 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 34.72 1ai5 s LYS 127 CO 0.52 -0.58 0.64 1.03 -0.92 0.00 0.00 175.35 176.05 1ai5 s ARG 128 N -4.26 3.90 0.18 1.68 0.52 -1.26 -5.05 118.95 114.67 1ai5 s ARG 128 Ca 0.35 0.47 0.04 0.00 -0.52 0.00 0.00 55.73 56.06 1ai5 s ARG 128 Cb -0.02 -2.54 -0.03 0.00 0.52 0.00 0.00 34.95 32.88 1ai5 s ARG 128 CO 0.21 0.23 0.28 -1.58 0.02 0.00 0.00 175.30 174.47 1ai5 s TRP 129 N -1.91 3.41 0.38 -0.53 0.52 -1.26 -5.11 118.94 114.44 1ai5 s TRP 129 Ca 0.51 0.05 0.04 0.00 0.02 0.00 0.00 56.10 56.72 1ai5 s TRP 129 Cb -0.11 -1.61 -0.06 0.00 -1.15 0.00 0.00 33.47 30.55 1ai5 s TRP 129 CO 0.19 0.50 0.05 -1.83 0.02 0.00 0.00 176.95 175.88 1ai5 s GLU 130 N -3.43 1.83 0.34 4.98 -1.05 -1.26 -4.77 118.70 115.33 1ai5 s GLU 130 Ca 0.34 -2.06 0.15 0.00 -0.15 0.00 0.00 54.97 53.25 1ai5 s GLU 130 Cb -0.10 -1.08 1.08 0.00 -0.44 0.00 0.00 34.13 33.59 1ai5 s GLU 130 CO 0.28 -0.22 1.67 -1.35 0.95 0.00 0.00 175.26 176.59 1ai5 h PRO 131 N 1.90 0.33 -0.63 -4.83 0.11 -1.93 -1.12 132.00 125.84 1ai5 h PRO 131 Ca -0.41 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ai5 h PRO 131 Cb 1.26 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1ai5 h PRO 131 CO 0.71 0.22 0.39 0.35 -0.21 0.00 0.00 178.00 179.45 1ai5 h PHE 132 N 0.34 0.82 -0.57 0.65 3.57 -1.96 -1.32 116.94 118.47 1ai5 h PHE 132 Ca 0.73 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 62.23 1ai5 h PHE 132 Cb 1.66 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 40.10 1ai5 h PHE 132 CO -0.01 0.55 0.35 -0.44 -2.23 0.00 0.00 178.31 176.53 1ai5 h ASP 133 N 0.85 0.67 -0.11 0.41 3.32 -1.60 -0.05 116.42 119.91 1ai5 h ASP 133 Ca 0.23 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.12 1ai5 h ASP 133 Cb -0.04 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1ai5 h ASP 133 CO -0.04 0.51 -0.40 0.58 -1.72 0.00 0.00 179.24 178.17 1ai5 h VAL 134 N 0.78 1.38 -0.66 -1.35 2.07 -1.24 -3.11 116.25 114.12 1ai5 h VAL 134 Ca 0.21 -1.72 0.03 0.00 0.82 0.00 0.00 66.70 66.03 1ai5 h VAL 134 Cb -0.04 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 1ai5 h VAL 134 CO -0.04 0.51 0.41 0.00 0.02 0.00 0.00 177.57 178.47 1ai5 h ALA 135 N 0.49 0.85 0.00 1.67 0.00 -1.15 -3.04 119.26 118.09 1ai5 h ALA 135 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ai5 h ALA 135 Cb 1.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1ai5 h ALA 135 CO 0.09 0.17 -0.07 0.52 0.00 0.00 0.00 179.25 179.95 1ai5 h MET 136 N 0.80 0.00 0.14 0.00 2.07 -1.03 -2.04 114.93 114.88 1ai5 h MET 136 Ca 0.26 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.89 1ai5 h MET 136 Cb 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.75 1ai5 h MET 136 CO -0.10 0.07 -0.07 0.82 1.07 0.00 0.00 176.91 178.70 1ai5 h ILE 137 N 0.00 0.87 -0.42 -1.22 1.08 -1.46 0.97 117.51 117.33 1ai5 h ILE 137 Ca -0.00 -0.06 -0.11 0.00 -0.39 0.00 0.00 64.86 64.30 1ai5 h ILE 137 Cb 0.41 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 1ai5 h ILE 137 CO 0.01 0.01 -0.16 0.15 -0.69 0.00 0.00 178.15 177.48 1ai5 h PHE 138 N -0.22 0.98 -0.39 1.37 3.04 -1.45 -3.11 116.94 117.15 1ai5 h PHE 138 Ca -0.02 -0.23 -0.10 0.00 3.98 0.00 0.00 57.97 61.60 1ai5 h PHE 138 Cb 0.17 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.44 1ai5 h PHE 138 CO -0.06 0.99 -0.14 0.28 -2.02 0.00 0.00 178.31 177.36 1ai5 h VAL 139 N 0.68 1.28 0.00 1.41 2.07 -1.29 -2.82 116.25 117.58 1ai5 h VAL 139 Ca 0.10 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1ai5 h VAL 139 Cb 0.71 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1ai5 h VAL 139 CO 0.05 0.42 -0.05 1.23 0.02 0.00 0.00 177.57 179.24 1ai5 h GLY 140 N 0.59 0.00 -1.13 2.17 0.00 -0.93 0.49 103.07 104.26 1ai5 h GLY 140 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 1ai5 h GLY 140 CO 0.05 0.00 -0.53 -1.30 0.00 0.00 0.00 176.54 174.76 1ai5 n THR 141 N -3.21 2.09 0.00 4.70 -2.24 -1.16 -3.96 114.28 110.50 1ai5 n THR 141 Ca -0.00 -3.13 0.00 0.00 -2.27 0.00 0.00 64.05 58.64 1ai5 n THR 141 Cb 0.28 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1ai5 n THR 141 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1ai5 n MET 142 N -1.03 0.00 -0.08 -0.78 0.00 -1.07 -4.59 117.12 109.57 1ai5 n MET 142 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 57.70 57.82 1ai5 n MET 142 Cb 0.72 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.91 1ai5 n MET 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ai5 n ALA 143 N -1.18 0.54 0.26 -5.12 0.00 -1.04 -2.09 120.51 111.88 1ai5 n ALA 143 Ca 0.00 -0.48 0.14 0.00 0.00 0.00 0.00 53.44 53.10 1ai5 n ALA 143 Cb 0.00 -0.02 0.67 0.00 0.00 0.00 0.00 19.45 20.09 1ai5 n ALA 143 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1ai5 h ASN 144 N -1.00 0.00 0.00 0.00 2.35 -0.26 -2.37 115.58 114.31 1ai5 h ASN 144 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1ai5 h ASN 144 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1ai5 h ASN 144 CO -0.02 0.11 0.00 -2.11 -1.65 0.00 0.00 177.43 173.76 1ai5 n ARG 145 N -3.34 0.00 0.00 0.81 1.85 -1.25 -4.65 116.66 110.08 1ai5 n ARG 145 Ca -0.01 -0.26 0.10 0.00 -1.00 0.00 0.00 57.85 56.68 1ai5 n ARG 145 Cb 0.31 -0.47 0.06 0.00 -1.05 0.00 0.00 32.46 31.31 1ai5 n ARG 145 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1ai5 n PHE 146 N 0.00 0.00 -1.97 2.89 3.72 -1.12 -4.33 117.46 116.65 1ai5 n PHE 146 Ca 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 1ai5 n PHE 146 Cb 0.39 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.99 1ai5 n PHE 146 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ai5 n SER 147 N 0.79 0.99 -2.38 4.37 2.88 -0.89 -4.85 113.62 114.53 1ai5 n SER 147 Ca 0.11 -2.48 -0.25 0.00 -1.33 0.00 0.00 58.87 54.92 1ai5 n SER 147 Cb 0.48 -0.32 0.01 0.00 -0.75 0.00 0.00 64.21 63.62 1ai5 n SER 147 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1ai5 n ASP 148 N -0.23 4.50 -4.66 -3.46 2.03 -1.14 -4.93 116.55 108.67 1ai5 n ASP 148 Ca 0.08 -3.63 -0.39 0.00 0.52 0.00 0.00 54.79 51.37 1ai5 n ASP 148 Cb 0.85 -0.43 -0.07 0.00 -0.72 0.00 0.00 41.12 40.74 1ai5 n ASP 148 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1ai5 s SER 149 N -3.54 6.46 0.08 1.67 0.01 -1.26 -4.97 113.70 112.16 1ai5 s SER 149 Ca 0.47 0.55 -0.16 0.00 1.31 0.00 0.00 55.95 58.13 1ai5 s SER 149 Cb 0.40 -2.26 0.03 0.00 0.21 0.00 0.00 66.02 64.41 1ai5 s SER 149 CO -0.11 -0.14 0.37 0.28 0.41 0.00 0.00 173.24 174.04 1ai5 s THR 150 N 1.59 0.07 0.00 1.44 -1.32 -1.26 -5.05 115.64 111.12 1ai5 s THR 150 Ca 0.21 -0.61 0.19 0.00 -1.21 0.00 0.00 61.69 60.26 1ai5 s THR 150 Cb -0.15 -1.08 0.31 0.00 -1.51 0.00 0.00 72.50 70.07 1ai5 s THR 150 CO 0.09 -0.34 1.12 -1.54 -2.21 0.00 0.00 174.62 171.74 1ai5 n SER 151 N 0.15 0.52 -0.24 8.08 3.41 -1.26 -4.95 113.62 119.33 1ai5 n SER 151 Ca -0.17 -1.99 0.05 0.00 -0.26 0.00 0.00 58.87 56.50 1ai5 n SER 151 Cb 0.62 -0.16 0.29 0.00 -0.26 0.00 0.00 64.21 64.70 1ai5 n SER 151 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ai5 h GLU 152 N 0.73 0.87 -0.21 4.33 5.08 -1.99 0.10 114.58 123.49 1ai5 h GLU 152 Ca -0.29 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 1ai5 h GLU 152 Cb 1.76 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 1ai5 h GLU 152 CO 0.01 0.58 -0.10 0.82 -1.00 0.00 0.00 179.01 179.32 1ai5 h ILE 153 N 0.90 1.31 -0.36 3.13 2.04 -2.00 -2.07 117.51 120.45 1ai5 h ILE 153 Ca 0.35 -1.17 -0.11 0.00 1.00 0.00 0.00 64.86 64.93 1ai5 h ILE 153 Cb 0.21 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1ai5 h ILE 153 CO -0.12 0.36 -0.24 0.44 0.00 0.00 0.00 178.15 178.59 1ai5 h ASP 154 N 0.15 0.72 -1.01 1.72 3.32 -1.33 -2.15 116.42 117.85 1ai5 h ASP 154 Ca 0.05 -0.26 0.07 0.00 0.02 0.00 0.00 57.03 56.91 1ai5 h ASP 154 Cb 0.59 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 1ai5 h ASP 154 CO 0.03 0.94 0.65 0.78 -1.72 0.00 0.00 179.24 179.92 1ai5 h ASN 155 N 0.62 1.03 -0.09 6.45 -0.26 -0.73 -0.88 115.58 121.72 1ai5 h ASN 155 Ca 0.09 0.01 -0.16 0.00 -0.56 0.00 0.00 56.30 55.68 1ai5 h ASN 155 Cb 0.73 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.78 1ai5 h ASN 155 CO 0.06 0.64 -0.49 0.25 -1.06 0.00 0.00 177.43 176.83 1ai5 h LEU 156 N 1.16 0.71 -0.85 1.61 5.85 -0.95 -0.08 115.31 122.76 1ai5 h LEU 156 Ca 0.44 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1ai5 h LEU 156 Cb 0.20 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1ai5 h LEU 156 CO -0.18 1.08 0.11 0.00 -0.34 0.00 0.00 178.44 179.11 1ai5 h ALA 157 N 0.94 1.06 -0.30 1.25 0.00 -0.95 -1.45 119.26 119.81 1ai5 h ALA 157 Ca 0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1ai5 h ALA 157 Cb 1.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1ai5 h ALA 157 CO 0.10 0.61 0.02 1.25 0.00 0.00 0.00 179.25 181.23 1ai5 h LEU 158 N 0.92 0.51 -0.74 0.00 5.85 -0.56 -2.29 115.31 118.99 1ai5 h LEU 158 Ca 0.19 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.64 1ai5 h LEU 158 Cb 0.38 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1ai5 h LEU 158 CO 0.01 0.68 0.48 0.25 -0.34 0.00 0.00 178.44 179.51 1ai5 h LEU 159 N 0.32 0.79 -0.38 2.25 5.85 -0.76 -0.11 115.31 123.27 1ai5 h LEU 159 Ca 0.09 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1ai5 h LEU 159 Cb 0.41 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1ai5 h LEU 159 CO 0.01 0.55 0.05 0.74 -0.34 0.00 0.00 178.44 179.46 1ai5 h THR 160 N 0.94 1.24 -0.10 1.05 2.02 -1.17 -1.48 112.91 115.40 1ai5 h THR 160 Ca 0.29 -0.87 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 1ai5 h THR 160 Cb -0.02 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1ai5 h THR 160 CO -0.10 0.30 -0.12 0.00 0.37 0.00 0.00 175.52 175.97 1ai5 h ALA 161 N 0.91 1.61 0.00 6.16 0.00 -0.80 -1.66 119.26 125.48 1ai5 h ALA 161 Ca 0.12 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1ai5 h ALA 161 Cb 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ai5 h ALA 161 CO 0.01 0.29 -0.29 -0.07 0.00 0.00 0.00 179.25 179.19 1ai5 h LEU 162 N 0.15 0.00 -0.14 0.00 3.38 -0.41 -2.61 115.31 115.68 1ai5 h LEU 162 Ca 0.03 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.77 1ai5 h LEU 162 Cb 0.32 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1ai5 h LEU 162 CO 0.02 0.29 -0.84 0.11 0.09 0.00 0.00 178.44 178.11 1ai5 h LYS 163 N 0.00 0.74 -0.30 1.13 1.57 -0.38 -1.11 116.57 118.22 1ai5 h LYS 163 Ca -0.00 -0.65 -0.07 0.00 -1.87 0.00 0.00 60.65 58.06 1ai5 h LYS 163 Cb 1.07 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1ai5 h LYS 163 CO 0.04 1.25 -0.07 -0.44 -0.57 0.00 0.00 179.45 179.65 1ai5 h ASP 164 N 0.48 0.58 0.05 0.86 5.19 -1.32 0.34 116.42 122.60 1ai5 h ASP 164 Ca -0.07 -0.37 -0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1ai5 h ASP 164 Cb 1.47 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.83 1ai5 h ASP 164 CO 0.17 0.81 -0.03 0.50 -3.12 0.00 0.00 179.24 177.58 1ai5 h LYS 165 N 0.34 -0.07 -0.24 3.56 3.64 -1.47 -3.36 116.57 118.98 1ai5 h LYS 165 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1ai5 h LYS 165 Cb 0.56 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1ai5 h LYS 165 CO 0.03 0.29 0.00 0.66 -2.27 0.00 0.00 179.45 178.16 1ai5 n TYR 166 N -4.95 0.31 0.00 1.91 4.01 -0.42 -5.08 117.16 112.95 1ai5 n TYR 166 Ca -0.08 -0.35 0.00 0.00 -0.16 0.00 0.00 57.90 57.31 1ai5 n TYR 166 Cb 0.21 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 1ai5 n TYR 166 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ai5 n GLY 167 N 0.53 -1.21 0.33 2.72 0.00 0.12 -4.13 105.19 103.54 1ai5 n GLY 167 Ca 0.10 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.43 1ai5 n GLY 167 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ai5 h VAL 168 N 0.00 0.28 -0.01 1.61 2.07 -1.90 0.16 116.25 118.46 1ai5 h VAL 168 Ca 0.00 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 1ai5 h VAL 168 Cb 0.00 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 1ai5 h VAL 168 CO 0.00 0.00 -0.72 0.28 0.02 0.00 0.00 177.57 177.15 1ai5 h SER 169 N -0.37 0.09 0.60 0.57 0.02 -1.94 -3.27 113.55 109.24 1ai5 h SER 169 Ca 0.11 -0.06 -0.28 0.00 -0.84 0.00 0.00 61.79 60.72 1ai5 h SER 169 Cb 0.54 -0.03 0.01 0.00 0.14 0.00 0.00 62.40 63.06 1ai5 h SER 169 CO -0.38 0.78 -1.28 -0.61 -1.14 0.00 0.00 176.83 174.19 1ai5 h GLN 170 N 0.05 0.29 -0.57 3.45 5.75 -1.70 -2.96 115.11 119.41 1ai5 h GLN 170 Ca -0.01 -0.49 -0.03 0.00 -0.15 0.00 0.00 58.65 57.96 1ai5 h GLN 170 Cb 1.27 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 29.98 1ai5 h GLN 170 CO 0.10 1.23 0.21 0.78 -2.65 0.00 0.00 178.83 178.50 1ai5 h GLY 171 N 1.51 0.88 1.23 2.39 0.00 -0.76 -1.71 103.07 106.61 1ai5 h GLY 171 Ca -0.15 -0.45 -0.17 0.00 0.00 0.00 0.00 47.33 46.56 1ai5 h GLY 171 CO 0.21 0.43 -0.47 1.98 0.00 0.00 0.00 176.54 178.69 1ai5 h MET 172 N 0.81 0.82 0.00 4.80 1.85 -1.62 -2.44 114.93 119.15 1ai5 h MET 172 Ca 0.19 -0.47 -0.14 0.00 -0.61 0.00 0.00 59.70 58.67 1ai5 h MET 172 Cb 0.18 0.04 -0.02 0.00 0.43 0.00 0.00 31.60 32.22 1ai5 h MET 172 CO -0.02 1.11 -0.66 0.00 -0.40 0.00 0.00 176.91 176.95 1ai5 h ALA 173 N 0.81 0.85 -0.19 0.39 0.00 -1.27 -2.14 119.26 117.71 1ai5 h ALA 173 Ca 0.04 -0.60 -0.21 0.00 0.00 0.00 0.00 54.91 54.14 1ai5 h ALA 173 Cb 1.05 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.74 1ai5 h ALA 173 CO 0.10 0.82 -0.71 0.28 0.00 0.00 0.00 179.25 179.74 1ai5 h VAL 174 N 0.00 1.27 -0.93 0.00 2.07 -1.20 -2.42 116.25 115.04 1ai5 h VAL 174 Ca -0.01 -1.90 0.16 0.00 0.82 0.00 0.00 66.70 65.78 1ai5 h VAL 174 Cb 1.21 1.88 -0.10 0.00 -1.52 0.00 0.00 31.29 32.76 1ai5 h VAL 174 CO 0.09 0.61 0.54 0.15 0.02 0.00 0.00 177.57 178.97 1ai5 h PHE 175 N 0.58 0.94 0.00 1.57 3.57 -1.40 0.85 116.94 123.05 1ai5 h PHE 175 Ca -0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1ai5 h PHE 175 Cb 1.34 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.80 1ai5 h PHE 175 CO 0.08 0.24 0.00 -0.91 -2.23 0.00 0.00 178.31 175.50 1ai5 h ASN 176 N 0.73 0.00 0.43 0.41 2.35 -1.16 -0.12 115.58 118.22 1ai5 h ASN 176 Ca 0.52 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.96 1ai5 h ASN 176 Cb 0.73 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.11 1ai5 h ASN 176 CO -0.36 0.00 -1.44 -0.61 -1.65 0.00 0.00 177.43 173.38 1ai5 h GLN 177 N 0.00 0.37 0.02 0.81 4.15 0.11 -3.24 115.11 117.33 1ai5 h GLN 177 Ca 0.00 -0.63 -0.27 0.00 0.77 0.00 0.00 58.65 58.52 1ai5 h GLN 177 Cb 0.54 0.23 -0.04 0.00 0.21 0.00 0.00 27.48 28.43 1ai5 h GLN 177 CO 0.00 1.28 -1.50 -0.07 -1.93 0.00 0.00 178.83 176.61 1ai5 h LEU 178 N 0.10 0.08 -5.99 -2.39 3.38 -0.63 -3.41 115.31 106.46 1ai5 h LEU 178 Ca -0.22 -0.12 -0.54 0.00 0.09 0.00 0.00 57.88 57.09 1ai5 h LEU 178 Cb 2.06 -0.02 -0.40 0.00 0.09 0.00 0.00 40.66 42.39 1ai5 h LEU 178 CO 0.22 1.11 -1.07 1.17 0.09 0.00 0.00 178.44 179.95 1ai5 n LYS 179 N -3.21 1.05 -1.45 1.13 3.00 -0.09 -5.09 118.16 113.50 1ai5 n LYS 179 Ca -0.13 -3.46 -0.33 0.00 -0.00 0.00 0.00 58.31 54.39 1ai5 n LYS 179 Cb 1.02 -1.49 0.08 0.00 0.00 0.00 0.00 35.03 34.64 1ai5 n LYS 179 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.40 179.07 1ai5 s TRP 180 N -1.76 2.24 -0.09 5.64 -2.14 -1.22 -4.56 118.94 117.04 1ai5 s TRP 180 Ca 0.38 1.60 -0.25 0.00 2.66 0.00 0.00 56.10 60.48 1ai5 s TRP 180 Cb 0.23 -3.33 -0.21 0.00 -3.10 0.00 0.00 33.47 27.06 1ai5 s TRP 180 CO -0.09 -2.26 0.88 1.25 -2.66 0.00 0.00 176.95 174.07 1ai5 h LEU 181 N -0.40 -0.03 -8.30 -4.66 5.85 -1.95 -3.46 115.31 102.35 1ai5 h LEU 181 Ca -0.47 -0.70 -0.22 0.00 0.84 0.00 0.00 57.88 57.33 1ai5 h LEU 181 Cb 1.27 0.01 -0.17 0.00 0.37 0.00 0.00 40.66 42.14 1ai5 h LEU 181 CO 0.50 0.73 -0.71 0.68 -0.34 0.00 0.00 178.44 179.31 1ai5 s VAL 182 N -2.94 0.55 -0.17 1.05 -7.23 -1.26 -5.13 120.40 105.27 1ai5 s VAL 182 Ca -0.16 -1.58 -0.03 0.00 -1.81 0.00 0.00 61.98 58.40 1ai5 s VAL 182 Cb -0.01 -1.23 0.05 0.00 0.56 0.00 0.00 36.38 35.76 1ai5 s VAL 182 CO 0.61 -0.71 0.03 0.21 -0.31 0.00 0.00 175.10 174.94 1ai5 s ASN 183 N -2.46 2.60 0.54 4.85 3.84 -1.26 -5.02 114.94 118.02 1ai5 s ASN 183 Ca 0.02 -0.66 0.36 0.00 0.21 0.00 0.00 52.86 52.79 1ai5 s ASN 183 Cb -0.00 -0.53 1.75 0.00 -0.55 0.00 0.00 41.25 41.91 1ai5 s ASN 183 CO -0.03 -0.29 2.07 1.55 -2.79 0.00 0.00 177.10 177.61 1ai5 h PRO 184 N 8.28 0.00 -0.22 0.43 0.13 -2.04 -2.46 132.00 136.12 1ai5 h PRO 184 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1ai5 h PRO 184 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ai5 h PRO 184 CO 0.32 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.96 1ai5 n SER 185 N -2.87 1.71 -4.73 1.44 3.41 -1.26 -4.95 113.62 106.37 1ai5 n SER 185 Ca -0.01 -1.78 -0.42 0.00 -0.26 0.00 0.00 58.87 56.40 1ai5 n SER 185 Cb 0.16 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 1ai5 n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ai5 s ALA 186 N -1.72 3.73 0.13 7.33 0.00 -0.93 -4.94 121.76 125.36 1ai5 s ALA 186 Ca 0.30 1.38 -0.32 0.00 0.00 0.00 0.00 51.96 53.32 1ai5 s ALA 186 Cb 0.16 -3.60 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 1ai5 s ALA 186 CO 0.23 -0.79 1.81 -2.30 0.00 0.00 0.00 175.76 174.72 1ai5 n PRO 187 N 3.33 2.75 -4.27 0.00 -0.02 -1.26 -4.99 135.00 130.53 1ai5 n PRO 187 Ca 0.11 1.00 -0.30 0.00 -2.02 0.00 0.00 63.50 62.29 1ai5 n PRO 187 Cb 0.39 -2.88 -0.11 0.00 -0.02 0.00 0.00 33.50 30.88 1ai5 n PRO 187 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ai5 s THR 188 N 2.47 3.08 0.27 3.45 -4.23 -1.26 -5.04 115.64 114.38 1ai5 s THR 188 Ca 0.81 -1.39 0.02 0.00 -1.18 0.00 0.00 61.69 59.95 1ai5 s THR 188 Cb -0.50 -2.43 0.04 0.00 1.34 0.00 0.00 72.50 70.96 1ai5 s THR 188 CO 0.37 0.11 1.68 0.74 -0.54 0.00 0.00 174.62 176.98 1ai5 h THR 189 N 3.42 1.28 -3.66 3.99 2.02 -2.04 -3.41 112.91 114.51 1ai5 h THR 189 Ca -0.49 -1.40 -0.62 0.00 0.77 0.00 0.00 66.41 64.67 1ai5 h THR 189 Cb 1.17 1.46 -0.15 0.00 -1.74 0.00 0.00 68.15 68.89 1ai5 h THR 189 CO 0.49 0.44 -0.46 -0.63 0.37 0.00 0.00 175.52 175.72 1ai5 s ILE 190 N -4.37 5.32 0.52 3.11 1.01 -1.26 -5.08 121.20 120.46 1ai5 s ILE 190 Ca -0.07 0.25 -0.22 0.00 0.00 0.00 0.00 60.65 60.61 1ai5 s ILE 190 Cb 0.13 -3.54 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 1ai5 s ILE 190 CO 0.80 0.30 1.33 0.00 0.00 0.00 0.00 174.94 177.37 1ai5 s ALA 191 N 1.32 2.88 0.44 9.38 0.00 -1.26 -4.90 121.76 129.61 1ai5 s ALA 191 Ca 0.09 1.28 0.13 0.00 0.00 0.00 0.00 51.96 53.46 1ai5 s ALA 191 Cb -0.14 -3.54 0.97 0.00 0.00 0.00 0.00 23.12 20.41 1ai5 s ALA 191 CO 0.07 -1.24 1.99 -0.39 0.00 0.00 0.00 175.76 176.19 1ai5 h VAL 192 N 1.58 1.13 0.00 0.00 -1.51 -1.96 -1.27 116.25 114.22 1ai5 h VAL 192 Ca -0.51 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.39 1ai5 h VAL 192 Cb 1.29 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 1ai5 h VAL 192 CO 0.58 0.17 0.00 1.56 -1.23 0.00 0.00 177.57 178.65 1ai5 h GLN 193 N 0.08 0.00 0.02 5.19 7.50 -2.05 -3.07 115.11 122.77 1ai5 h GLN 193 Ca 0.02 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 58.85 1ai5 h GLN 193 Cb 0.28 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.77 1ai5 h GLN 193 CO 0.02 0.00 -1.72 0.39 -1.50 0.00 0.00 178.83 176.02 1ai5 n GLU 194 N -2.94 0.60 -3.61 1.46 -0.58 -0.48 -5.07 120.64 110.01 1ai5 n GLU 194 Ca -0.03 0.44 -0.02 0.00 -0.42 0.00 0.00 57.16 57.14 1ai5 n GLU 194 Cb 0.07 -1.67 -0.01 0.00 -0.57 0.00 0.00 31.44 29.26 1ai5 n GLU 194 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1ai5 s SER 195 N -7.02 -0.12 0.21 1.62 1.04 -1.16 -5.10 113.70 103.16 1ai5 s SER 195 Ca -0.31 -0.09 0.02 0.00 0.48 0.00 0.00 55.95 56.06 1ai5 s SER 195 Cb 0.08 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 1ai5 s SER 195 CO 0.59 -0.35 0.01 0.54 0.98 0.00 0.00 173.24 175.02 1ai5 s ASN 196 N -2.60 1.47 0.03 7.02 4.22 -1.26 -4.53 114.94 119.29 1ai5 s ASN 196 Ca 0.11 -1.21 -0.29 0.00 -2.14 0.00 0.00 52.86 49.33 1ai5 s ASN 196 Cb 0.01 0.08 -0.04 0.00 1.28 0.00 0.00 41.25 42.58 1ai5 s ASN 196 CO -0.04 -0.56 0.93 -0.47 -2.04 0.00 0.00 177.10 174.92 1ai5 s TYR 197 N -3.57 3.70 -0.30 1.54 5.04 -1.26 -4.97 117.35 117.54 1ai5 s TYR 197 Ca 0.27 1.68 0.21 0.00 -2.44 0.00 0.00 57.07 56.79 1ai5 s TYR 197 Cb 0.06 -3.05 0.30 0.00 0.35 0.00 0.00 41.96 39.62 1ai5 s TYR 197 CO 0.07 0.08 1.57 -1.00 -1.34 0.00 0.00 175.55 174.94 1ai5 h PRO 198 N 6.34 0.00 -6.89 4.97 0.13 -2.08 -3.46 132.00 131.02 1ai5 h PRO 198 Ca -0.42 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.24 1ai5 h PRO 198 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1ai5 h PRO 198 CO 0.74 0.18 0.21 -0.51 -0.23 0.00 0.00 178.00 178.39 1ai5 s LEU 199 N -6.32 4.00 0.02 1.56 1.43 -1.26 -5.08 118.68 113.04 1ai5 s LEU 199 Ca 0.06 1.47 0.07 0.00 -1.03 0.00 0.00 54.13 54.70 1ai5 s LEU 199 Cb 0.06 -4.30 -0.02 0.00 0.03 0.00 0.00 46.19 41.96 1ai5 s LEU 199 CO 0.69 -0.28 -0.22 -0.75 0.23 0.00 0.00 176.35 176.01 1ai5 s LYS 200 N -3.09 1.64 0.17 1.70 2.47 -1.26 -5.14 119.74 116.22 1ai5 s LYS 200 Ca 0.58 -0.91 0.11 0.00 -1.56 0.00 0.00 55.97 54.18 1ai5 s LYS 200 Cb -0.10 -1.70 -0.04 0.00 -1.46 0.00 0.00 37.83 34.54 1ai5 s LYS 200 CO 0.15 0.45 -0.23 -0.06 0.16 0.00 0.00 175.35 175.82 1ai5 s PHE 201 N -0.68 2.35 0.28 4.03 0.40 -1.26 -5.11 117.98 117.98 1ai5 s PHE 201 Ca 0.09 -0.35 -0.29 0.00 -0.60 0.00 0.00 56.93 55.77 1ai5 s PHE 201 Cb -0.09 -1.20 -0.10 0.00 0.51 0.00 0.00 43.02 42.14 1ai5 s PHE 201 CO 0.01 0.44 1.40 1.21 0.70 0.00 0.00 175.22 178.98 1ai5 s ASN 202 N -2.45 6.67 -0.32 1.36 3.84 -1.26 -4.95 114.94 117.83 1ai5 s ASN 202 Ca 0.19 2.70 0.14 0.00 0.21 0.00 0.00 52.86 56.10 1ai5 s ASN 202 Cb -0.09 -2.63 0.47 0.00 -0.55 0.00 0.00 41.25 38.45 1ai5 s ASN 202 CO 0.09 -0.66 1.10 0.00 -2.79 0.00 0.00 177.10 174.83 1ai5 n GLN 203 N 1.72 2.43 0.00 0.43 10.64 -1.26 -4.67 117.38 126.67 1ai5 n GLN 203 Ca 0.04 -3.82 0.00 0.00 -1.83 0.00 0.00 57.00 51.39 1ai5 n GLN 203 Cb 0.41 -1.83 0.00 0.00 -0.86 0.00 0.00 30.24 27.96 1ai5 n GLN 203 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1ai5 n GLN 204 N -0.48 0.16 -3.59 2.61 1.13 -1.26 -4.99 117.38 110.96 1ai5 n GLN 204 Ca 0.24 -0.49 -0.21 0.00 -1.94 0.00 0.00 57.00 54.59 1ai5 n GLN 204 Cb 0.82 -0.74 0.07 0.00 0.11 0.00 0.00 30.24 30.50 1ai5 n GLN 204 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1ai5 n ASN 205 N -0.08 -3.58 0.18 1.08 4.05 -1.26 -4.85 115.26 110.80 1ai5 n ASN 205 Ca 0.00 -0.65 0.12 0.00 0.45 0.00 0.00 54.58 54.51 1ai5 n ASN 205 Cb 0.21 -4.77 0.64 0.00 1.23 0.00 0.00 39.78 37.09 1ai5 n ASN 205 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1ai5 h SER 206 N -2.17 0.00 0.27 1.20 0.02 -1.94 -2.69 113.55 108.24 1ai5 h SER 206 Ca -0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1ai5 h SER 206 Cb 1.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1ai5 h SER 206 CO 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.24 1ai5 n GLN 207 N -2.34 0.25 0.00 3.45 0.00 -1.26 -5.23 117.38 112.25 1ai5 n GLN 207 Ca -0.01 0.13 0.09 0.00 0.00 0.00 0.00 57.00 57.20 1ai5 n GLN 207 Cb 0.06 -1.50 0.08 0.00 0.00 0.00 0.00 30.24 28.87 1ai5 n GLN 207 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31