#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lo9 n ARG 3 N 0.00 1.71 -5.18 0.00 0.63 -1.26 -4.96 116.66 107.59 1lo9 n ARG 3 Ca 0.00 0.52 -0.31 0.00 -0.92 0.00 0.00 57.85 57.14 1lo9 n ARG 3 Cb 0.00 -2.82 -0.17 0.00 0.45 0.00 0.00 32.46 29.93 1lo9 n ARG 3 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1lo9 s SER 4 N 6.92 2.93 0.08 6.15 0.15 -1.26 -4.12 113.70 124.54 1lo9 s SER 4 Ca 1.02 -0.50 0.03 0.00 0.70 0.00 0.00 55.95 57.20 1lo9 s SER 4 Cb -0.61 -0.96 -0.04 0.00 -1.71 0.00 0.00 66.02 62.70 1lo9 s SER 4 CO 0.44 0.21 0.05 -0.63 1.20 0.00 0.00 173.24 174.51 1lo9 s ILE 5 N 0.02 4.38 -0.06 6.45 -1.09 0.08 -4.92 121.20 126.06 1lo9 s ILE 5 Ca -0.08 -0.81 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 1lo9 s ILE 5 Cb -0.15 -3.10 0.02 0.00 -1.58 0.00 0.00 42.46 37.66 1lo9 s ILE 5 CO 0.05 0.14 -0.03 -0.89 -1.23 0.00 0.00 174.94 172.99 1lo9 s THR 6 N -1.35 0.49 0.06 2.92 2.01 -1.26 -0.20 115.64 118.30 1lo9 s THR 6 Ca 0.28 -0.03 0.04 0.00 0.31 0.00 0.00 61.69 62.29 1lo9 s THR 6 Cb -0.12 -0.57 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1lo9 s THR 6 CO 0.20 0.24 -0.13 0.00 -0.69 0.00 0.00 174.62 174.25 1lo9 s MET 7 N 1.37 0.79 0.14 4.92 0.23 -0.78 -4.99 119.30 120.98 1lo9 s MET 7 Ca -0.04 -0.84 0.03 0.00 -1.03 0.00 0.00 55.69 53.81 1lo9 s MET 7 Cb -0.13 -0.77 -0.04 0.00 -1.53 0.00 0.00 34.83 32.36 1lo9 s MET 7 CO -0.03 0.17 0.21 -0.65 -2.03 0.00 0.00 175.02 172.69 1lo9 s GLN 8 N -1.49 3.20 -0.11 3.16 -0.21 -1.26 -0.45 119.66 122.50 1lo9 s GLN 8 Ca -0.02 -0.68 -0.04 0.00 0.02 0.00 0.00 55.36 54.64 1lo9 s GLN 8 Cb -0.09 -2.84 0.06 0.00 1.00 0.00 0.00 33.01 31.13 1lo9 s GLN 8 CO 0.02 0.52 0.22 -1.14 -2.12 0.00 0.00 175.29 172.79 1lo9 s GLN 9 N -3.02 0.10 -0.06 2.91 2.00 0.30 -4.94 119.66 116.95 1lo9 s GLN 9 Ca 0.33 0.66 -0.25 0.00 -2.00 0.00 0.00 55.36 54.10 1lo9 s GLN 9 Cb -0.11 -0.14 -0.03 0.00 0.80 0.00 0.00 33.01 33.53 1lo9 s GLN 9 CO 0.26 -0.29 0.76 0.50 -0.50 0.00 0.00 175.29 176.02 1lo9 s ARG 10 N 2.30 4.45 -0.16 1.67 3.52 -1.26 0.17 118.95 129.65 1lo9 s ARG 10 Ca 0.01 0.98 -0.29 0.00 -0.13 0.00 0.00 55.73 56.30 1lo9 s ARG 10 Cb -0.12 -3.45 -0.00 0.00 -1.56 0.00 0.00 34.95 29.81 1lo9 s ARG 10 CO -0.07 0.03 1.05 0.42 -0.81 0.00 0.00 175.30 175.91 1lo9 s ILE 11 N 0.89 4.68 0.04 4.11 1.01 -0.30 -4.94 121.20 126.68 1lo9 s ILE 11 Ca 0.40 1.99 0.00 0.00 0.00 0.00 0.00 60.65 63.04 1lo9 s ILE 11 Cb -0.18 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 1lo9 s ILE 11 CO 0.20 -0.08 0.14 -1.61 0.00 0.00 0.00 174.94 173.58 1lo9 s GLU 12 N 2.60 3.19 0.30 2.79 0.41 -1.26 -0.35 118.70 126.38 1lo9 s GLU 12 Ca 0.47 -0.50 0.01 0.00 -0.41 0.00 0.00 54.97 54.54 1lo9 s GLU 12 Cb -0.17 -2.92 0.72 0.00 -1.78 0.00 0.00 34.13 29.98 1lo9 s GLU 12 CO 0.13 0.62 1.59 0.35 -0.49 0.00 0.00 175.26 177.46 1lo9 h PHE 13 N 3.51 0.05 -0.95 1.61 3.57 -1.94 0.66 116.94 123.46 1lo9 h PHE 13 Ca -0.47 0.06 0.18 0.00 3.53 0.00 0.00 57.97 61.27 1lo9 h PHE 13 Cb 1.17 0.13 -0.10 0.00 2.79 0.00 0.00 35.95 39.94 1lo9 h PHE 13 CO 0.63 -0.37 0.54 0.78 -2.23 0.00 0.00 178.31 177.66 1lo9 h GLY 14 N 0.06 1.64 2.00 2.40 0.00 -2.01 -2.28 103.07 104.87 1lo9 h GLY 14 Ca 0.57 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1lo9 h GLY 14 CO -0.83 -0.07 0.00 -0.55 0.00 0.00 0.00 176.54 175.09 1lo9 h ASP 15 N 0.70 0.00 -2.85 0.19 3.32 -0.03 -3.44 116.42 114.30 1lo9 h ASP 15 Ca 0.54 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.99 1lo9 h ASP 15 Cb 0.82 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.33 1lo9 h ASP 15 CO -0.39 0.00 -0.51 0.00 -1.72 0.00 0.00 179.24 176.62 1lo9 n ASN 17 N 0.05 0.65 0.27 0.00 0.23 -0.80 -4.82 115.26 110.85 1lo9 n ASN 17 Ca -0.06 -1.70 0.11 0.00 -0.53 0.00 0.00 54.58 52.40 1lo9 n ASN 17 Cb 0.52 -0.68 0.76 0.00 -2.08 0.00 0.00 39.78 38.31 1lo9 n ASN 17 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 1lo9 h PRO 18 N 0.00 0.00 0.00 -0.53 0.11 -2.00 0.18 132.00 129.76 1lo9 h PRO 18 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1lo9 h PRO 18 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1lo9 h PRO 18 CO 0.28 0.03 0.00 0.00 -0.21 0.00 0.00 178.00 178.10 1lo9 n ALA 19 N -2.41 2.11 -2.32 -0.75 0.00 -1.26 -4.89 120.51 110.99 1lo9 n ALA 19 Ca -0.03 -0.10 -0.07 0.00 0.00 0.00 0.00 53.44 53.24 1lo9 n ALA 19 Cb 0.12 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1lo9 n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lo9 n GLY 20 N 0.58 0.21 3.09 0.00 0.00 0.62 -5.06 105.19 104.63 1lo9 n GLY 20 Ca 0.10 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.49 1lo9 n GLY 20 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1lo9 s ILE 21 N -2.53 0.21 0.16 -0.61 -5.25 -1.26 -4.81 121.20 107.11 1lo9 s ILE 21 Ca 0.05 -1.74 -0.31 0.00 -0.99 0.00 0.00 60.65 57.67 1lo9 s ILE 21 Cb -0.02 -1.44 -0.17 0.00 2.95 0.00 0.00 42.46 43.77 1lo9 s ILE 21 CO 0.06 -0.96 0.71 0.52 -1.79 0.00 0.00 174.94 173.48 1lo9 n VAL 22 N 0.19 1.52 -3.10 8.37 0.31 -0.36 -1.89 118.33 123.36 1lo9 n VAL 22 Ca -0.15 -0.38 -0.40 0.00 -0.01 0.00 0.00 64.34 63.41 1lo9 n VAL 22 Cb 0.61 -0.13 -0.06 0.00 -0.91 0.00 0.00 33.84 33.35 1lo9 n VAL 22 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1lo9 s TRP 23 N -0.75 3.42 0.30 3.52 -0.00 0.70 -4.71 118.94 121.42 1lo9 s TRP 23 Ca 0.70 1.00 0.06 0.00 -0.00 0.00 0.00 56.10 57.85 1lo9 s TRP 23 Cb -0.98 -2.80 0.80 0.00 -0.00 0.00 0.00 33.47 30.49 1lo9 s TRP 23 CO 0.56 -0.11 1.69 0.10 -0.00 0.00 0.00 176.95 179.19 1lo9 h TYR 24 N 7.30 0.72 -0.73 5.86 -0.00 -1.90 -1.73 116.97 126.49 1lo9 h TYR 24 Ca -0.33 0.04 0.16 0.00 0.00 0.00 0.00 58.73 58.60 1lo9 h TYR 24 Cb 1.15 -0.17 -0.05 0.00 0.00 0.00 0.00 36.73 37.67 1lo9 h TYR 24 CO 0.70 -0.06 0.50 -1.35 -0.00 0.00 0.00 178.16 177.94 1lo9 h PRO 25 N 0.40 0.30 -0.80 0.10 0.11 -1.96 0.03 132.00 130.19 1lo9 h PRO 25 Ca 0.59 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 66.80 1lo9 h PRO 25 Cb 1.17 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.16 1lo9 h PRO 25 CO -0.54 0.20 0.52 -0.91 -0.21 0.00 0.00 178.00 177.06 1lo9 h ASN 26 N 0.31 0.58 0.11 -2.05 2.35 -1.65 -0.37 115.58 114.86 1lo9 h ASN 26 Ca 0.36 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 56.14 1lo9 h ASN 26 Cb 0.97 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.22 1lo9 h ASN 26 CO -0.09 0.33 -0.14 1.88 -1.65 0.00 0.00 177.43 177.76 1lo9 h TYR 27 N 0.64 -0.36 -0.47 1.19 0.05 -1.14 0.18 116.97 117.06 1lo9 h TYR 27 Ca 0.38 0.00 0.10 0.00 0.05 0.00 0.00 58.73 59.26 1lo9 h TYR 27 Cb 0.60 0.14 -0.09 0.00 1.01 0.00 0.00 36.73 38.39 1lo9 h TYR 27 CO -0.00 -0.21 -0.17 0.45 -1.05 0.00 0.00 178.16 177.18 1lo9 h HIS 28 N -0.29 -0.41 -0.34 4.88 3.86 -1.08 0.27 115.15 122.04 1lo9 h HIS 28 Ca 0.01 0.05 0.07 0.00 -1.16 0.00 0.00 60.37 59.34 1lo9 h HIS 28 Cb 0.29 0.25 -0.08 0.00 1.06 0.00 0.00 27.41 28.93 1lo9 h HIS 28 CO -0.14 -0.26 -0.20 0.00 0.86 0.00 0.00 177.93 178.19 1lo9 h ARG 29 N -0.07 -0.14 -0.25 2.45 3.08 -0.53 0.14 114.38 119.07 1lo9 h ARG 29 Ca 0.23 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 1lo9 h ARG 29 Cb 0.41 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1lo9 h ARG 29 CO -0.52 -0.10 0.01 -1.49 -1.07 0.00 0.00 179.97 176.81 1lo9 h TRP 30 N -0.15 0.37 -0.32 3.04 6.55 0.19 -2.28 115.95 123.34 1lo9 h TRP 30 Ca 0.17 -0.02 -0.03 0.00 0.95 0.00 0.00 58.89 59.96 1lo9 h TRP 30 Cb 0.41 -0.11 -0.01 0.00 -0.86 0.00 0.00 29.16 28.59 1lo9 h TRP 30 CO -0.40 0.37 0.09 -0.07 -1.05 0.00 0.00 178.44 177.38 1lo9 h LEU 31 N 0.36 0.48 -1.50 -4.49 4.07 0.75 0.31 115.31 115.28 1lo9 h LEU 31 Ca 0.08 -0.21 -0.02 0.00 0.08 0.00 0.00 57.88 57.81 1lo9 h LEU 31 Cb 0.22 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 1lo9 h LEU 31 CO 0.00 0.56 0.14 -0.78 -1.08 0.00 0.00 178.44 177.29 1lo9 h ASP 32 N 0.37 0.42 0.52 -0.43 3.58 -0.60 0.63 116.42 120.91 1lo9 h ASP 32 Ca 0.10 -0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 1lo9 h ASP 32 Cb 0.26 -0.11 0.01 0.00 1.72 0.00 0.00 39.33 41.21 1lo9 h ASP 32 CO -0.00 0.38 -0.25 0.00 -2.88 0.00 0.00 179.24 176.49 1lo9 h ALA 33 N 1.68 -0.70 -0.87 -0.78 0.00 -0.77 -2.17 119.26 115.66 1lo9 h ALA 33 Ca 0.12 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1lo9 h ALA 33 Cb 0.09 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 1lo9 h ALA 33 CO -0.01 -0.77 0.56 0.00 0.00 0.00 0.00 179.25 179.03 1lo9 h ALA 34 N -0.63 1.79 0.40 0.00 0.00 -0.04 0.18 119.26 120.96 1lo9 h ALA 34 Ca -0.07 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1lo9 h ALA 34 Cb 0.62 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1lo9 h ALA 34 CO 0.12 -0.00 -0.34 1.03 0.00 0.00 0.00 179.25 180.06 1lo9 h SER 35 N 0.73 -0.91 -0.35 0.00 0.87 0.57 -0.36 113.55 114.11 1lo9 h SER 35 Ca 0.42 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 61.04 1lo9 h SER 35 Cb 0.61 0.30 -0.02 0.00 -0.44 0.00 0.00 62.40 62.85 1lo9 h SER 35 CO -0.19 -0.49 0.16 -0.09 -0.53 0.00 0.00 176.83 175.69 1lo9 h ARG 36 N -0.75 0.51 -0.97 2.24 2.43 -0.76 -2.50 114.38 114.57 1lo9 h ARG 36 Ca -0.03 -0.08 0.27 0.00 -0.81 0.00 0.00 59.98 59.33 1lo9 h ARG 36 Cb 0.65 -0.09 -0.14 0.00 -0.42 0.00 0.00 29.97 29.98 1lo9 h ARG 36 CO -0.03 0.47 0.52 -0.97 -1.51 0.00 0.00 179.97 178.45 1lo9 h ASN 37 N 0.42 0.48 0.09 -3.80 -1.24 -0.41 0.17 115.58 111.29 1lo9 h ASN 37 Ca 0.12 0.17 0.02 0.00 0.71 0.00 0.00 56.30 57.32 1lo9 h ASN 37 Cb 0.14 0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.27 1lo9 h ASN 37 CO -0.01 -0.04 -0.25 0.22 -1.29 0.00 0.00 177.43 176.05 1lo9 h TYR 38 N 0.40 -0.68 -0.11 0.67 3.20 -0.59 -0.61 116.97 119.25 1lo9 h TYR 38 Ca 0.66 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.45 1lo9 h TYR 38 Cb 1.39 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.93 1lo9 h TYR 38 CO -0.05 -0.35 -0.39 0.74 -1.64 0.00 0.00 178.16 176.47 1lo9 h PHE 39 N -0.44 0.28 -0.10 -3.82 0.04 -1.08 -1.29 116.94 110.53 1lo9 h PHE 39 Ca 0.04 -0.07 -0.03 0.00 2.80 0.00 0.00 57.97 60.71 1lo9 h PHE 39 Cb 0.48 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.57 1lo9 h PHE 39 CO -0.25 0.60 -0.05 0.82 -0.60 0.00 0.00 178.31 178.83 1lo9 h ILE 40 N 0.21 1.33 0.00 -0.55 1.08 -0.36 0.42 117.51 119.64 1lo9 h ILE 40 Ca 0.02 -1.09 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 1lo9 h ILE 40 Cb 0.78 1.85 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 1lo9 h ILE 40 CO 0.06 0.31 0.00 0.29 -0.69 0.00 0.00 178.15 178.12 1lo9 n LYS 41 N -4.72 0.05 0.00 2.37 4.76 -0.27 -0.57 118.16 119.77 1lo9 n LYS 41 Ca -0.07 0.27 0.11 0.00 -2.87 0.00 0.00 58.31 55.75 1lo9 n LYS 41 Cb 0.28 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.95 1lo9 n LYS 41 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1lo9 n GLY 43 N 1.49 1.13 3.82 0.00 0.00 0.26 -4.59 105.19 107.30 1lo9 n GLY 43 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1lo9 n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lo9 s LEU 44 N 0.00 4.52 1.08 0.99 1.02 0.10 -5.02 118.68 121.37 1lo9 s LEU 44 Ca 0.00 1.20 -0.12 0.00 0.02 0.00 0.00 54.13 55.22 1lo9 s LEU 44 Cb 0.00 -2.83 0.24 0.00 0.02 0.00 0.00 46.19 43.62 1lo9 s LEU 44 CO 0.00 0.29 1.06 -2.84 0.02 0.00 0.00 176.35 174.87 1lo9 s PRO 45 N -1.11 -0.27 0.70 1.29 0.02 -1.26 -4.38 135.00 129.99 1lo9 s PRO 45 Ca 0.28 0.83 -0.16 0.00 0.02 0.00 0.00 61.00 61.97 1lo9 s PRO 45 Cb -0.19 -1.63 0.02 0.00 0.02 0.00 0.00 34.50 32.72 1lo9 s PRO 45 CO 0.18 -3.29 1.21 -1.25 -0.33 0.00 0.00 177.00 173.52 1lo9 s PRO 46 N -4.63 2.34 0.13 5.54 0.05 -1.26 -4.77 135.00 132.40 1lo9 s PRO 46 Ca 0.67 1.77 -0.20 0.00 0.05 0.00 0.00 61.00 63.29 1lo9 s PRO 46 Cb -0.23 -1.86 -0.01 0.00 0.05 0.00 0.00 34.50 32.45 1lo9 s PRO 46 CO 0.62 -1.69 1.70 -1.49 0.05 0.00 0.00 177.00 176.19 1lo9 h TRP 47 N -0.03 -0.15 -0.65 0.56 -0.00 -1.90 -1.43 115.95 112.35 1lo9 h TRP 47 Ca -0.48 0.02 0.12 0.00 -0.00 0.00 0.00 58.89 58.55 1lo9 h TRP 47 Cb 1.30 0.10 -0.12 0.00 -0.00 0.00 0.00 29.16 30.44 1lo9 h TRP 47 CO 0.47 -0.11 -0.18 -2.13 -0.00 0.00 0.00 178.44 176.48 1lo9 n ARG 48 N -5.22 -0.08 0.06 0.49 0.63 -1.26 0.67 116.66 111.95 1lo9 n ARG 48 Ca -0.02 1.01 -0.11 0.00 -0.92 0.00 0.00 57.85 57.81 1lo9 n ARG 48 Cb 0.15 -1.50 -0.08 0.00 0.45 0.00 0.00 32.46 31.47 1lo9 n ARG 48 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 1lo9 h GLN 49 N 0.00 -0.21 -0.81 -0.14 4.15 -1.75 -3.33 115.11 113.02 1lo9 h GLN 49 Ca 0.29 0.01 0.18 0.00 0.77 0.00 0.00 58.65 59.91 1lo9 h GLN 49 Cb 0.45 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.14 1lo9 h GLN 49 CO -0.66 0.22 0.54 1.79 -1.93 0.00 0.00 178.83 178.79 1lo9 h THR 50 N -0.82 0.72 0.00 2.39 1.35 0.13 0.95 112.91 117.63 1lo9 h THR 50 Ca -0.02 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1lo9 h THR 50 Cb 0.53 0.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.31 1lo9 h THR 50 CO 0.04 0.06 0.00 1.62 -0.25 0.00 0.00 175.52 176.99 1lo9 h VAL 51 N 0.33 0.00 0.01 6.82 3.04 0.78 0.12 116.25 127.35 1lo9 h VAL 51 Ca 0.40 -0.47 -0.35 0.00 -1.01 0.00 0.00 66.70 65.28 1lo9 h VAL 51 Cb 1.08 1.45 -0.06 0.00 -2.01 0.00 0.00 31.29 31.74 1lo9 h VAL 51 CO -0.12 0.00 -2.14 0.52 -1.01 0.00 0.00 177.57 174.82 1lo9 n VAL 52 N -3.03 1.50 0.04 1.51 0.31 0.19 -3.12 118.33 115.74 1lo9 n VAL 52 Ca 0.01 -0.79 -0.20 0.00 -0.01 0.00 0.00 64.34 63.34 1lo9 n VAL 52 Cb 0.29 -0.84 -0.14 0.00 -0.91 0.00 0.00 33.84 32.23 1lo9 n VAL 52 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1lo9 h GLU 53 N 0.01 0.30 0.00 5.55 4.81 -0.93 -3.42 114.58 120.89 1lo9 h GLU 53 Ca -0.46 -0.51 -0.06 0.00 -0.13 0.00 0.00 59.36 58.21 1lo9 h GLU 53 Cb 2.12 0.19 -0.12 0.00 0.63 0.00 0.00 28.75 31.57 1lo9 h GLU 53 CO 0.04 1.18 -0.53 2.89 -0.73 0.00 0.00 179.01 181.87 1lo9 n ARG 54 N -3.49 0.00 -0.98 1.92 1.85 0.27 -5.01 116.66 111.23 1lo9 n ARG 54 Ca -0.25 -1.08 0.00 0.00 -1.00 0.00 0.00 57.85 55.53 1lo9 n ARG 54 Cb 1.06 -0.17 0.00 0.00 -1.05 0.00 0.00 32.46 32.30 1lo9 n ARG 54 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1lo9 n GLY 55 N 0.13 0.28 3.67 2.89 0.00 -0.39 -4.93 105.19 106.84 1lo9 n GLY 55 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1lo9 n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lo9 s ILE 56 N -1.61 4.68 0.00 -0.61 1.01 -0.80 -4.44 121.20 119.43 1lo9 s ILE 56 Ca 0.00 1.98 -0.16 0.00 0.00 0.00 0.00 60.65 62.48 1lo9 s ILE 56 Cb 0.00 -4.28 -0.34 0.00 0.01 0.00 0.00 42.46 37.85 1lo9 s ILE 56 CO 0.00 -0.08 0.91 -0.37 0.00 0.00 0.00 174.94 175.40 1lo9 h VAL 57 N 5.25 1.22 0.00 2.92 -1.51 -1.26 -1.03 116.25 121.85 1lo9 h VAL 57 Ca -0.26 -2.63 0.00 0.00 -1.23 0.00 0.00 66.70 62.57 1lo9 h VAL 57 Cb 1.11 3.00 0.00 0.00 -2.13 0.00 0.00 31.29 33.27 1lo9 h VAL 57 CO 0.91 0.81 0.00 0.61 -1.23 0.00 0.00 177.57 178.67 1lo9 n GLY 58 N 1.75 -0.62 2.70 5.19 0.00 -1.24 -4.76 105.19 108.20 1lo9 n GLY 58 Ca -0.19 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 1lo9 n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lo9 s THR 59 N -4.00 1.04 0.53 2.61 -4.23 -1.25 -0.88 115.64 109.46 1lo9 s THR 59 Ca 0.00 -1.96 -0.19 0.00 -1.18 0.00 0.00 61.69 58.36 1lo9 s THR 59 Cb 0.00 -1.76 -0.07 0.00 1.34 0.00 0.00 72.50 72.02 1lo9 s THR 59 CO 0.00 -0.81 1.09 -2.84 -0.54 0.00 0.00 174.62 171.53 1lo9 s PRO 60 N 0.99 3.49 -0.20 3.99 0.01 -1.13 -4.65 135.00 137.50 1lo9 s PRO 60 Ca 0.14 1.50 -0.16 0.00 0.01 0.00 0.00 61.00 62.49 1lo9 s PRO 60 Cb -0.21 -2.04 -0.04 0.00 0.01 0.00 0.00 34.50 32.22 1lo9 s PRO 60 CO -0.11 -0.71 0.43 -1.50 0.01 0.00 0.00 177.00 175.12 1lo9 s ILE 61 N -1.88 5.18 -0.08 2.83 2.07 -1.26 -0.93 121.20 127.12 1lo9 s ILE 61 Ca 0.70 0.77 0.12 0.00 -1.41 0.00 0.00 60.65 60.83 1lo9 s ILE 61 Cb -0.21 -3.76 -0.18 0.00 0.13 0.00 0.00 42.46 38.44 1lo9 s ILE 61 CO 0.25 0.24 0.30 1.33 -1.91 0.00 0.00 174.94 175.15 1lo9 n VAL 62 N 4.37 0.00 -3.58 4.00 0.24 0.65 -4.98 118.33 119.02 1lo9 n VAL 62 Ca -0.08 -0.27 -0.17 0.00 -2.04 0.00 0.00 64.34 61.78 1lo9 n VAL 62 Cb 0.51 0.31 -0.07 0.00 -1.47 0.00 0.00 33.84 33.13 1lo9 n VAL 62 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1lo9 s SER 63 N -3.26 -0.54 -0.23 -1.34 0.15 -0.89 -5.01 113.70 102.59 1lo9 s SER 63 Ca -0.03 0.55 -0.20 0.00 0.70 0.00 0.00 55.95 56.97 1lo9 s SER 63 Cb 0.08 0.48 0.06 0.00 -1.71 0.00 0.00 66.02 64.93 1lo9 s SER 63 CO 0.51 -0.57 0.61 0.00 1.20 0.00 0.00 173.24 174.98 1lo9 s ASN 65 N 0.57 3.89 -0.07 0.00 3.84 -0.63 -4.98 114.94 117.55 1lo9 s ASN 65 Ca -0.02 -1.11 0.00 0.00 0.21 0.00 0.00 52.86 51.95 1lo9 s ASN 65 Cb -0.05 -1.45 -0.03 0.00 -0.55 0.00 0.00 41.25 39.17 1lo9 s ASN 65 CO -0.03 -0.14 -0.05 0.00 -2.79 0.00 0.00 177.10 174.09 1lo9 s ALA 66 N 1.22 3.05 -0.08 1.71 0.00 -1.26 -1.17 121.76 125.23 1lo9 s ALA 66 Ca -0.04 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 1lo9 s ALA 66 Cb -0.18 -1.29 0.05 0.00 0.00 0.00 0.00 23.12 21.70 1lo9 s ALA 66 CO -0.08 0.57 0.16 -1.12 0.00 0.00 0.00 175.76 175.29 1lo9 s SER 67 N -0.81 0.58 -0.65 0.00 0.01 -0.04 -5.01 113.70 107.77 1lo9 s SER 67 Ca 0.12 0.33 -0.16 0.00 1.31 0.00 0.00 55.95 57.55 1lo9 s SER 67 Cb -0.11 0.26 0.15 0.00 0.21 0.00 0.00 66.02 66.53 1lo9 s SER 67 CO 0.02 -0.23 0.66 -0.36 0.41 0.00 0.00 173.24 173.74 1lo9 s PHE 68 N 2.08 3.31 0.04 2.43 0.40 -1.26 -0.59 117.98 124.39 1lo9 s PHE 68 Ca 0.01 -1.39 -0.20 0.00 -0.60 0.00 0.00 56.93 54.75 1lo9 s PHE 68 Cb -0.12 -3.89 -0.14 0.00 0.51 0.00 0.00 43.02 39.38 1lo9 s PHE 68 CO -0.06 -1.11 1.33 0.28 0.70 0.00 0.00 175.22 176.36 1lo9 h VAL 69 N 5.61 1.35 -3.10 -0.44 2.07 0.07 -3.48 116.25 118.33 1lo9 h VAL 69 Ca -0.17 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 65.94 1lo9 h VAL 69 Cb 1.08 1.91 -0.12 0.00 -1.52 0.00 0.00 31.29 32.63 1lo9 h VAL 69 CO 0.99 0.41 0.14 0.00 0.02 0.00 0.00 177.57 179.12 1lo9 s THR 71 N -3.77 3.69 0.11 0.00 -4.23 -1.26 -4.67 115.64 105.52 1lo9 s THR 71 Ca 0.02 0.62 -0.01 0.00 -1.18 0.00 0.00 61.69 61.14 1lo9 s THR 71 Cb -0.00 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.58 1lo9 s THR 71 CO -0.12 -0.65 0.03 0.00 -0.54 0.00 0.00 174.62 173.33 1lo9 s ALA 72 N -2.82 0.83 0.29 3.99 0.00 -1.26 -5.02 121.76 117.77 1lo9 s ALA 72 Ca 0.61 -1.42 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 1lo9 s ALA 72 Cb -0.16 0.67 0.02 0.00 0.00 0.00 0.00 23.12 23.64 1lo9 s ALA 72 CO 0.51 -0.43 0.62 0.45 0.00 0.00 0.00 175.76 176.90 1lo9 s SER 73 N -3.03 -0.03 0.52 0.00 0.15 -1.26 -1.22 113.70 108.82 1lo9 s SER 73 Ca 0.20 -0.91 -0.21 0.00 0.70 0.00 0.00 55.95 55.73 1lo9 s SER 73 Cb 0.07 0.69 -0.08 0.00 -1.71 0.00 0.00 66.02 65.00 1lo9 s SER 73 CO -0.01 -1.33 0.89 0.00 1.20 0.00 0.00 173.24 173.99 1lo9 n TYR 74 N -0.45 0.64 0.00 3.44 4.11 -1.26 -1.65 117.16 121.98 1lo9 n TYR 74 Ca -0.03 0.49 0.00 0.00 -0.00 0.00 0.00 57.90 58.35 1lo9 n TYR 74 Cb 0.60 -2.13 0.00 0.00 -0.00 0.00 0.00 39.34 37.81 1lo9 n TYR 74 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.86 176.61 1lo9 n ASP 75 N 0.03 0.00 -4.76 9.48 8.00 0.53 -4.96 116.55 124.87 1lo9 n ASP 75 Ca 0.11 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.23 1lo9 n ASP 75 Cb 0.44 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.56 1lo9 n ASP 75 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1lo9 s ASP 76 N 0.50 5.68 -0.17 -2.24 1.01 -0.66 -4.70 116.67 116.09 1lo9 s ASP 76 Ca 0.00 2.70 -0.03 0.00 0.71 0.00 0.00 52.55 55.93 1lo9 s ASP 76 Cb 0.00 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 1lo9 s ASP 76 CO 0.00 -1.28 -0.07 -0.69 0.21 0.00 0.00 175.17 173.34 1lo9 s VAL 77 N -1.32 3.44 0.04 -1.27 1.01 -1.26 -1.15 120.40 119.89 1lo9 s VAL 77 Ca 0.66 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 62.14 1lo9 s VAL 77 Cb -0.39 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1lo9 s VAL 77 CO 0.47 0.47 0.17 -0.76 0.00 0.00 0.00 175.10 175.46 1lo9 s LEU 78 N 0.79 4.25 -0.12 3.92 1.43 0.13 -4.37 118.68 124.71 1lo9 s LEU 78 Ca -0.02 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1lo9 s LEU 78 Cb -0.15 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1lo9 s LEU 78 CO 0.02 0.20 -0.21 -0.89 0.23 0.00 0.00 176.35 175.70 1lo9 s THR 79 N -1.42 2.23 -0.24 5.49 2.01 -0.24 0.11 115.64 123.58 1lo9 s THR 79 Ca 0.31 -0.94 0.02 0.00 0.31 0.00 0.00 61.69 61.39 1lo9 s THR 79 Cb -0.13 -1.89 0.05 0.00 0.01 0.00 0.00 72.50 70.55 1lo9 s THR 79 CO 0.24 0.55 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.98 1lo9 s ILE 80 N 0.58 1.97 -0.44 1.82 1.01 0.40 -0.25 121.20 126.29 1lo9 s ILE 80 Ca -0.12 -1.42 -0.22 0.00 0.00 0.00 0.00 60.65 58.89 1lo9 s ILE 80 Cb -0.17 -2.08 0.02 0.00 0.01 0.00 0.00 42.46 40.25 1lo9 s ILE 80 CO 0.04 0.03 0.74 -0.70 0.00 0.00 0.00 174.94 175.05 1lo9 s GLU 81 N 1.21 3.38 0.02 2.79 2.12 0.09 -1.86 118.70 126.45 1lo9 s GLU 81 Ca -0.06 -0.17 0.03 0.00 0.36 0.00 0.00 54.97 55.13 1lo9 s GLU 81 Cb -0.19 -3.94 -0.04 0.00 0.26 0.00 0.00 34.13 30.23 1lo9 s GLU 81 CO -0.06 -1.07 -0.02 0.99 -0.54 0.00 0.00 175.26 174.55 1lo9 s THR 82 N 3.14 3.96 0.07 -1.70 2.01 0.71 -1.61 115.64 122.22 1lo9 s THR 82 Ca 0.28 -0.73 -0.26 0.00 0.31 0.00 0.00 61.69 61.29 1lo9 s THR 82 Cb -0.13 -2.77 0.08 0.00 0.01 0.00 0.00 72.50 69.69 1lo9 s THR 82 CO 0.21 0.34 0.72 0.00 -0.69 0.00 0.00 174.62 175.21 1lo9 s ILE 84 N -3.17 4.62 -0.06 0.00 -1.09 -1.26 -1.09 121.20 119.15 1lo9 s ILE 84 Ca 0.01 1.00 -0.26 0.00 -2.23 0.00 0.00 60.65 59.16 1lo9 s ILE 84 Cb -0.01 -4.31 -0.23 0.00 -1.58 0.00 0.00 42.46 36.34 1lo9 s ILE 84 CO -0.09 -0.56 1.05 0.50 -1.23 0.00 0.00 174.94 174.61 1lo9 h LYS 85 N 8.59 0.06 -2.56 2.79 3.64 0.16 -3.43 116.57 125.81 1lo9 h LYS 85 Ca -0.24 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 58.99 1lo9 h LYS 85 Cb 1.08 0.01 -0.22 0.00 -0.41 0.00 0.00 32.23 32.70 1lo9 h LYS 85 CO 0.96 0.78 -0.11 -2.00 -2.27 0.00 0.00 179.45 176.81 1lo9 s GLU 86 N -3.30 0.69 -0.23 1.90 2.12 -1.21 -4.94 118.70 113.73 1lo9 s GLU 86 Ca -0.17 0.39 -0.09 0.00 0.36 0.00 0.00 54.97 55.45 1lo9 s GLU 86 Cb 0.00 0.33 -0.05 0.00 0.26 0.00 0.00 34.13 34.67 1lo9 s GLU 86 CO 0.70 -0.15 0.13 -1.58 -0.54 0.00 0.00 175.26 173.82 1lo9 s TRP 87 N -0.41 3.27 0.00 5.30 0.52 -1.26 0.79 118.94 127.14 1lo9 s TRP 87 Ca -0.06 0.11 0.00 0.00 0.02 0.00 0.00 56.10 56.17 1lo9 s TRP 87 Cb -0.03 -2.22 0.00 0.00 -1.15 0.00 0.00 33.47 30.06 1lo9 s TRP 87 CO 0.03 0.03 0.00 0.54 0.02 0.00 0.00 176.95 177.58 1lo9 n ARG 88 N 4.20 0.00 -0.01 4.98 1.74 0.22 -4.99 116.66 122.79 1lo9 n ARG 88 Ca -0.15 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.91 1lo9 n ARG 88 Cb 0.52 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.95 1lo9 n ARG 88 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1lo9 n ARG 89 N 0.00 0.10 0.00 5.56 0.63 -1.26 -4.73 116.66 116.96 1lo9 n ARG 89 Ca 0.00 0.04 0.09 0.00 -0.92 0.00 0.00 57.85 57.06 1lo9 n ARG 89 Cb 0.00 -0.54 0.05 0.00 0.45 0.00 0.00 32.46 32.43 1lo9 n ARG 89 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1lo9 n LYS 90 N -3.03 1.60 -4.55 -0.14 5.02 -1.26 -1.10 118.16 114.71 1lo9 n LYS 90 Ca -0.03 -1.40 -0.25 0.00 -2.02 0.00 0.00 58.31 54.61 1lo9 n LYS 90 Cb 0.10 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 33.66 1lo9 n LYS 90 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1lo9 s SER 91 N -1.72 3.10 -0.20 4.39 1.04 -1.26 -4.25 113.70 114.81 1lo9 s SER 91 Ca 0.20 -1.44 -0.27 0.00 0.48 0.00 0.00 55.95 54.92 1lo9 s SER 91 Cb 0.15 -0.05 0.08 0.00 0.10 0.00 0.00 66.02 66.30 1lo9 s SER 91 CO 0.30 -0.62 0.77 0.72 0.98 0.00 0.00 173.24 175.39 1lo9 s PHE 92 N -3.05 -0.67 -0.20 5.02 -0.71 -0.82 -0.61 117.98 116.93 1lo9 s PHE 92 Ca 0.31 1.48 -0.17 0.00 -1.04 0.00 0.00 56.93 57.51 1lo9 s PHE 92 Cb 0.08 0.34 -0.04 0.00 -1.21 0.00 0.00 43.02 42.19 1lo9 s PHE 92 CO 0.15 -0.43 0.45 0.08 -1.34 0.00 0.00 175.22 174.14 1lo9 s VAL 93 N -0.24 5.15 -0.24 -2.49 1.01 0.24 -2.60 120.40 121.23 1lo9 s VAL 93 Ca -0.03 0.82 0.01 0.00 0.00 0.00 0.00 61.98 62.78 1lo9 s VAL 93 Cb -0.03 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 32.61 1lo9 s VAL 93 CO 0.03 0.21 -0.11 -1.58 0.00 0.00 0.00 175.10 173.65 1lo9 s GLN 94 N 1.50 2.54 -0.11 2.72 0.74 0.11 0.18 119.66 127.35 1lo9 s GLN 94 Ca 0.21 -1.15 -0.04 0.00 0.05 0.00 0.00 55.36 54.43 1lo9 s GLN 94 Cb -0.15 -2.86 -0.04 0.00 1.10 0.00 0.00 33.01 31.06 1lo9 s GLN 94 CO 0.09 -0.46 0.06 0.50 -0.55 0.00 0.00 175.29 174.93 1lo9 s ARG 95 N 1.20 3.24 -0.02 1.67 3.52 -0.25 -0.57 118.95 127.75 1lo9 s ARG 95 Ca -0.04 -0.29 0.00 0.00 -0.13 0.00 0.00 55.73 55.27 1lo9 s ARG 95 Cb -0.18 -2.98 0.02 0.00 -1.56 0.00 0.00 34.95 30.25 1lo9 s ARG 95 CO -0.06 0.70 0.01 -1.01 -0.81 0.00 0.00 175.30 174.13 1lo9 s HIS 96 N -0.85 0.09 -0.17 5.12 3.76 -0.78 -0.92 115.29 121.54 1lo9 s HIS 96 Ca 0.13 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.11 1lo9 s HIS 96 Cb -0.12 -0.21 0.03 0.00 1.11 0.00 0.00 32.58 33.39 1lo9 s HIS 96 CO 0.03 -0.07 -0.12 -1.12 -0.85 0.00 0.00 174.74 172.61 1lo9 s SER 97 N 0.74 2.95 -0.16 1.40 0.01 -0.64 -1.60 113.70 116.41 1lo9 s SER 97 Ca -0.06 -0.65 -0.11 0.00 1.31 0.00 0.00 55.95 56.44 1lo9 s SER 97 Cb -0.09 -1.16 -0.05 0.00 0.21 0.00 0.00 66.02 64.93 1lo9 s SER 97 CO -0.02 -0.10 0.19 -0.69 0.41 0.00 0.00 173.24 173.03 1lo9 s VAL 98 N 1.47 5.38 0.17 3.43 1.01 0.35 -0.73 120.40 131.49 1lo9 s VAL 98 Ca 0.02 0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 1lo9 s VAL 98 Cb -0.14 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.72 1lo9 s VAL 98 CO -0.09 0.48 0.31 -0.94 0.00 0.00 0.00 175.10 174.86 1lo9 s SER 99 N -0.06 0.00 0.10 3.32 1.04 0.66 -0.86 113.70 117.90 1lo9 s SER 99 Ca 0.13 -0.83 0.02 0.00 0.48 0.00 0.00 55.95 55.75 1lo9 s SER 99 Cb -0.12 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.41 1lo9 s SER 99 CO 0.02 -0.92 -0.07 0.00 0.98 0.00 0.00 173.24 173.25 1lo9 s ARG 100 N -3.96 0.84 -0.18 4.02 1.04 -0.61 -1.08 118.95 119.02 1lo9 s ARG 100 Ca 0.16 -1.32 -0.07 0.00 -1.04 0.00 0.00 55.73 53.47 1lo9 s ARG 100 Cb 0.03 -0.25 -0.04 0.00 -2.04 0.00 0.00 34.95 32.64 1lo9 s ARG 100 CO -0.00 -0.00 0.05 0.99 -0.04 0.00 0.00 175.30 176.30 1lo9 s THR 101 N -3.48 4.68 0.44 4.99 2.01 -1.26 -0.73 115.64 122.30 1lo9 s THR 101 Ca 0.11 -0.07 -0.20 0.00 0.31 0.00 0.00 61.69 61.84 1lo9 s THR 101 Cb 0.04 -3.11 -0.10 0.00 0.01 0.00 0.00 72.50 69.34 1lo9 s THR 101 CO -0.04 0.46 0.95 0.28 -0.69 0.00 0.00 174.62 175.58 1lo9 s THR 102 N 0.42 4.44 -1.60 -0.82 -1.32 0.10 -4.89 115.64 111.97 1lo9 s THR 102 Ca 0.02 1.40 0.01 0.00 -1.21 0.00 0.00 61.69 61.92 1lo9 s THR 102 Cb -0.13 -3.63 0.03 0.00 -1.51 0.00 0.00 72.50 67.26 1lo9 s THR 102 CO 0.01 -0.40 0.76 -2.65 -2.21 0.00 0.00 174.62 170.12 1lo9 n PRO 103 N -0.84 0.02 -0.12 7.08 -0.02 -1.26 0.55 135.00 140.41 1lo9 n PRO 103 Ca 0.07 0.19 0.09 0.00 -2.02 0.00 0.00 63.50 61.83 1lo9 n PRO 103 Cb 0.54 -1.50 0.30 0.00 -0.02 0.00 0.00 33.50 32.82 1lo9 n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lo9 n GLY 104 N -1.11 0.45 2.30 -1.23 0.00 -1.26 -4.85 105.19 99.50 1lo9 n GLY 104 Ca 0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 45.60 1lo9 n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lo9 n GLY 105 N 1.12 0.45 3.83 -0.02 0.00 0.19 -4.98 105.19 105.78 1lo9 n GLY 105 Ca 0.15 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1lo9 n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lo9 s ASP 106 N -2.18 6.91 -0.23 1.61 1.01 -1.18 -4.86 116.67 117.75 1lo9 s ASP 106 Ca 0.00 1.15 -0.08 0.00 0.71 0.00 0.00 52.55 54.33 1lo9 s ASP 106 Cb 0.00 -2.32 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1lo9 s ASP 106 CO 0.00 0.15 0.08 -0.69 0.21 0.00 0.00 175.17 174.93 1lo9 s VAL 107 N -1.36 4.62 -0.22 -1.27 1.01 -1.26 0.02 120.40 121.93 1lo9 s VAL 107 Ca 0.35 -0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 1lo9 s VAL 107 Cb -0.16 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1lo9 s VAL 107 CO 0.19 0.37 -0.05 -1.10 0.00 0.00 0.00 175.10 174.51 1lo9 s GLN 108 N 1.21 3.35 0.07 2.72 -0.21 0.09 -4.94 119.66 121.95 1lo9 s GLN 108 Ca 0.05 -0.64 -0.32 0.00 0.02 0.00 0.00 55.36 54.47 1lo9 s GLN 108 Cb -0.14 -2.99 -0.12 0.00 1.00 0.00 0.00 33.01 30.76 1lo9 s GLN 108 CO 0.04 -0.20 1.81 -0.11 -2.12 0.00 0.00 175.29 174.70 1lo9 n LEU 109 N 4.79 3.71 -0.10 2.90 7.94 -1.26 -1.58 117.00 133.39 1lo9 n LEU 109 Ca -0.18 1.00 -0.14 0.00 -1.11 0.00 0.00 56.01 55.57 1lo9 n LEU 109 Cb 0.51 -1.48 -0.05 0.00 0.53 0.00 0.00 43.42 42.93 1lo9 n LEU 109 CO 0.29 0.02 -0.78 0.52 -1.11 0.00 0.00 177.39 176.33 1lo9 n VAL 110 N 4.61 1.49 -3.68 1.96 0.31 -0.03 -4.16 118.33 118.82 1lo9 n VAL 110 Ca 0.19 0.02 -0.12 0.00 -0.01 0.00 0.00 64.34 64.42 1lo9 n VAL 110 Cb 0.34 -2.22 -0.06 0.00 -0.91 0.00 0.00 33.84 30.99 1lo9 n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1lo9 s MET 111 N -2.63 0.93 0.07 5.55 0.23 -1.08 0.77 119.30 123.14 1lo9 s MET 111 Ca -0.28 -0.50 0.00 0.00 -1.03 0.00 0.00 55.69 53.88 1lo9 s MET 111 Cb 0.06 0.41 -0.04 0.00 -1.53 0.00 0.00 34.83 33.73 1lo9 s MET 111 CO 0.42 -0.33 -0.05 0.50 -2.03 0.00 0.00 175.02 173.54 1lo9 s ARG 112 N -2.86 0.68 -0.24 3.16 3.52 0.24 -0.49 118.95 122.96 1lo9 s ARG 112 Ca -0.03 -1.22 -0.26 0.00 -0.13 0.00 0.00 55.73 54.09 1lo9 s ARG 112 Cb 0.00 0.03 0.10 0.00 -1.56 0.00 0.00 34.95 33.52 1lo9 s ARG 112 CO -0.05 -0.07 0.90 0.00 -0.81 0.00 0.00 175.30 175.27 1lo9 s ALA 113 N -3.59 -1.89 -0.22 6.12 0.00 -0.63 -0.86 121.76 120.69 1lo9 s ALA 113 Ca 0.07 1.84 0.01 0.00 0.00 0.00 0.00 51.96 53.88 1lo9 s ALA 113 Cb 0.05 -1.14 0.03 0.00 0.00 0.00 0.00 23.12 22.06 1lo9 s ALA 113 CO -0.07 -0.29 -0.13 -0.51 0.00 0.00 0.00 175.76 174.76 1lo9 s ASP 114 N -0.01 3.82 -0.04 0.00 1.01 -0.31 -1.87 116.67 119.27 1lo9 s ASP 114 Ca 0.00 -0.88 0.03 0.00 0.71 0.00 0.00 52.55 52.41 1lo9 s ASP 114 Cb -0.04 -1.56 -0.03 0.00 1.01 0.00 0.00 42.92 42.30 1lo9 s ASP 114 CO -0.02 -0.08 -0.12 -1.61 0.21 0.00 0.00 175.17 173.55 1lo9 s GLU 115 N 1.26 2.52 -0.32 8.23 2.02 0.27 -1.61 118.70 131.07 1lo9 s GLU 115 Ca 0.00 -0.70 -0.10 0.00 0.02 0.00 0.00 54.97 54.20 1lo9 s GLU 115 Cb -0.16 -2.42 -0.00 0.00 0.10 0.00 0.00 34.13 31.64 1lo9 s GLU 115 CO -0.08 0.62 0.17 0.42 0.02 0.00 0.00 175.26 176.41 1lo9 s ILE 116 N -0.81 4.67 0.48 -1.63 1.01 0.11 0.09 121.20 125.12 1lo9 s ILE 116 Ca 0.13 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1lo9 s ILE 116 Cb -0.11 -3.41 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 1lo9 s ILE 116 CO 0.02 0.02 0.03 -0.13 0.00 0.00 0.00 174.94 174.89 1lo9 s ARG 117 N 1.62 2.11 0.26 2.79 0.52 -1.07 -0.26 118.95 124.92 1lo9 s ARG 117 Ca 0.04 -2.32 -0.07 0.00 -0.52 0.00 0.00 55.73 52.86 1lo9 s ARG 117 Cb -0.17 -1.32 -0.01 0.00 0.52 0.00 0.00 34.95 33.97 1lo9 s ARG 117 CO 0.07 -0.36 0.38 0.14 0.02 0.00 0.00 175.30 175.54 1lo9 s VAL 118 N -2.95 0.00 -0.16 3.52 -7.23 -0.11 -1.94 120.40 111.53 1lo9 s VAL 118 Ca 0.12 -1.63 -0.05 0.00 -1.81 0.00 0.00 61.98 58.61 1lo9 s VAL 118 Cb 0.03 -2.40 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 1lo9 s VAL 118 CO 0.07 0.00 0.02 -0.36 -0.31 0.00 0.00 175.10 174.52 1lo9 s PHE 119 N -3.82 3.17 0.24 2.82 0.08 -1.26 -2.85 117.98 116.35 1lo9 s PHE 119 Ca 0.29 -0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.33 1lo9 s PHE 119 Cb 0.02 -1.99 -0.05 0.00 -0.57 0.00 0.00 43.02 40.43 1lo9 s PHE 119 CO 0.13 0.15 0.09 0.00 -0.10 0.00 0.00 175.22 175.49 1lo9 s ALA 120 N 0.13 1.59 0.25 5.36 0.00 -0.06 -1.17 121.76 127.86 1lo9 s ALA 120 Ca 0.02 -1.80 0.09 0.00 0.00 0.00 0.00 51.96 50.26 1lo9 s ALA 120 Cb -0.13 1.03 -0.05 0.00 0.00 0.00 0.00 23.12 23.97 1lo9 s ALA 120 CO 0.01 -0.46 -0.13 -1.64 0.00 0.00 0.00 175.76 173.54 1lo9 s MET 121 N -4.04 1.49 -0.45 0.00 -1.94 -0.26 -0.76 119.30 113.34 1lo9 s MET 121 Ca 0.36 -1.69 0.03 0.00 -1.71 0.00 0.00 55.69 52.68 1lo9 s MET 121 Cb 0.07 -1.31 0.12 0.00 2.01 0.00 0.00 34.83 35.72 1lo9 s MET 121 CO 0.12 0.18 0.19 -0.80 -0.01 0.00 0.00 175.02 174.70 1lo9 s ASN 122 N -3.41 4.56 -1.35 3.03 0.01 -1.26 -0.17 114.94 116.36 1lo9 s ASN 122 Ca 0.26 -2.65 -0.16 0.00 -0.71 0.00 0.00 52.86 49.61 1lo9 s ASN 122 Cb -0.01 -1.65 0.07 0.00 0.41 0.00 0.00 41.25 40.07 1lo9 s ASN 122 CO 0.10 -0.31 1.91 0.47 -1.51 0.00 0.00 177.10 177.77 1lo9 n ASP 123 N 3.61 4.57 0.00 -1.22 8.00 0.18 -4.73 116.55 126.96 1lo9 n ASP 123 Ca 0.05 -2.90 0.00 0.00 0.71 0.00 0.00 54.79 52.65 1lo9 n ASP 123 Cb 0.36 -1.70 0.00 0.00 -0.02 0.00 0.00 41.12 39.76 1lo9 n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lo9 n GLY 124 N 4.80 1.24 0.19 0.44 0.00 -1.26 -3.37 105.19 107.23 1lo9 n GLY 124 Ca 0.49 -0.70 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1lo9 n GLY 124 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1lo9 h GLU 125 N 0.00 0.00 -5.38 1.61 5.08 -2.01 -3.45 114.58 110.43 1lo9 h GLU 125 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 1lo9 h GLU 125 Cb 0.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.13 1lo9 h GLU 125 CO 0.00 0.00 -0.20 1.03 -1.00 0.00 0.00 179.01 178.84 1lo9 s ARG 126 N -3.23 4.15 0.02 2.33 0.52 -1.22 -5.07 118.95 116.46 1lo9 s ARG 126 Ca 0.06 0.18 -0.30 0.00 -0.52 0.00 0.00 55.73 55.15 1lo9 s ARG 126 Cb 0.07 -3.55 -0.04 0.00 0.52 0.00 0.00 34.95 31.95 1lo9 s ARG 126 CO 0.69 -0.07 0.99 -1.17 0.02 0.00 0.00 175.30 175.75 1lo9 s LEU 127 N 1.42 4.39 -0.02 2.53 2.96 -1.26 0.49 118.68 129.19 1lo9 s LEU 127 Ca 0.18 1.70 -0.00 0.00 -0.22 0.00 0.00 54.13 55.79 1lo9 s LEU 127 Cb -0.15 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 43.00 1lo9 s LEU 127 CO 0.08 -0.24 0.04 -0.60 -1.32 0.00 0.00 176.35 174.31 1lo9 s ARG 128 N 0.87 -0.02 0.55 1.98 3.52 0.77 -4.94 118.95 121.67 1lo9 s ARG 128 Ca 0.52 0.19 -0.16 0.00 -0.13 0.00 0.00 55.73 56.14 1lo9 s ARG 128 Cb -0.22 -0.22 -0.06 0.00 -1.56 0.00 0.00 34.95 32.90 1lo9 s ARG 128 CO 0.28 -0.15 1.02 0.00 -0.81 0.00 0.00 175.30 175.64 1lo9 s ALA 129 N 0.97 2.91 0.16 6.12 0.00 -1.26 -1.10 121.76 129.56 1lo9 s ALA 129 Ca -0.08 0.30 0.07 0.00 0.00 0.00 0.00 51.96 52.24 1lo9 s ALA 129 Cb -0.11 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1lo9 s ALA 129 CO -0.03 -0.49 -0.14 0.96 0.00 0.00 0.00 175.76 176.05 1lo9 s ILE 130 N -2.52 1.53 0.01 0.00 -4.36 -0.32 -4.91 121.20 110.63 1lo9 s ILE 130 Ca 0.61 -1.95 -0.32 0.00 -0.26 0.00 0.00 60.65 58.73 1lo9 s ILE 130 Cb -0.13 -1.79 -0.11 0.00 1.25 0.00 0.00 42.46 41.68 1lo9 s ILE 130 CO 0.33 -0.50 1.90 1.21 0.24 0.00 0.00 174.94 178.13 1lo9 n GLU 131 N 0.11 2.56 -1.60 0.37 2.13 -1.26 -4.32 120.64 118.62 1lo9 n GLU 131 Ca -0.12 0.94 -0.60 0.00 0.66 0.00 0.00 57.16 58.03 1lo9 n GLU 131 Cb 0.58 -2.83 -0.08 0.00 0.27 0.00 0.00 31.44 29.38 1lo9 n GLU 131 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1lo9 n VAL 132 N 5.18 0.03 -2.03 6.31 0.31 -0.25 -4.78 118.33 123.09 1lo9 n VAL 132 Ca 0.21 -0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.11 1lo9 n VAL 132 Cb 0.35 -0.36 -0.03 0.00 -0.91 0.00 0.00 33.84 32.89 1lo9 n VAL 132 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1lo9 s PRO 133 N 1.23 4.25 0.13 5.55 0.02 -1.26 -4.93 135.00 139.97 1lo9 s PRO 133 Ca 0.95 2.23 -0.32 0.00 0.02 0.00 0.00 61.00 63.87 1lo9 s PRO 133 Cb -1.27 -3.35 -0.10 0.00 0.02 0.00 0.00 34.50 29.80 1lo9 s PRO 133 CO 0.63 -0.59 1.56 0.00 -0.33 0.00 0.00 177.00 178.27 1lo9 h ALA 134 N 7.32 -0.77 -0.94 -1.55 0.00 -2.01 0.79 119.26 122.10 1lo9 h ALA 134 Ca -0.42 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 54.66 1lo9 h ALA 134 Cb 1.20 1.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.89 1lo9 h ALA 134 CO 0.90 -1.04 0.52 0.38 0.00 0.00 0.00 179.25 180.02 1lo9 h ASP 135 N -0.49 0.62 0.51 0.00 3.04 -2.00 -0.05 116.42 118.04 1lo9 h ASP 135 Ca 0.06 0.11 -0.01 0.00 -3.24 0.00 0.00 57.03 53.95 1lo9 h ASP 135 Cb 0.64 0.02 -0.02 0.00 -1.04 0.00 0.00 39.33 38.93 1lo9 h ASP 135 CO -0.50 0.18 -0.43 1.88 -2.04 0.00 0.00 179.24 178.34 1lo9 h TYR 136 N 0.63 -1.16 -0.74 4.15 0.05 -1.28 -1.81 116.97 116.81 1lo9 h TYR 136 Ca 0.56 0.00 0.07 0.00 0.05 0.00 0.00 58.73 59.41 1lo9 h TYR 136 Cb 0.92 0.44 -0.09 0.00 1.01 0.00 0.00 36.73 39.01 1lo9 h TYR 136 CO -0.05 -0.60 -0.44 -0.89 -1.05 0.00 0.00 178.16 175.13 1lo9 n ILE 137 N -5.53 -0.51 -0.25 -2.88 2.08 -0.10 -0.40 119.36 111.78 1lo9 n ILE 137 Ca -0.12 1.88 0.05 0.00 0.56 0.00 0.00 62.75 65.12 1lo9 n ILE 137 Cb 0.42 -2.32 0.16 0.00 -0.75 0.00 0.00 39.64 37.14 1lo9 n ILE 137 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1lo9 h GLU 138 N 0.00 0.13 -0.62 0.38 4.57 -0.97 -0.60 114.58 117.46 1lo9 h GLU 138 Ca 0.12 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 1lo9 h GLU 138 Cb 0.31 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 1lo9 h GLU 138 CO -0.70 0.08 0.18 -0.07 -1.18 0.00 0.00 179.01 177.33 1lo9 h LEU 139 N 0.13 0.91 -1.55 1.64 3.38 0.12 -2.58 115.31 117.37 1lo9 h LEU 139 Ca 0.40 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1lo9 h LEU 139 Cb 0.70 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1lo9 h LEU 139 CO -0.62 0.88 0.00 0.00 0.09 0.00 0.00 178.44 178.79