#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c18 n GLU 2 N 0.00 0.00 -0.16 1.61 0.00 -1.26 -0.90 120.64 119.92 3c18 n GLU 2 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.09 3c18 n GLU 2 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 31.44 31.53 3c18 n GLU 2 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 3c18 h GLN 3 N 0.00 0.94 0.00 5.31 1.08 -2.02 -1.71 115.11 118.71 3c18 h GLN 3 Ca 0.00 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 3c18 h GLN 3 Cb 0.00 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.33 3c18 h GLN 3 CO 0.00 0.93 0.00 0.00 -0.95 0.00 0.00 178.83 178.81 3c18 h ALA 4 N 1.12 1.00 0.00 3.87 0.00 -1.50 -3.21 119.26 120.54 3c18 h ALA 4 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3c18 h ALA 4 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3c18 h ALA 4 CO 0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.53 3c18 n THR 5 N -2.31 0.55 -0.31 0.00 -2.24 -1.13 -4.80 114.28 104.04 3c18 n THR 5 Ca 0.05 -0.75 0.11 0.00 -2.27 0.00 0.00 64.05 61.18 3c18 n THR 5 Cb 0.38 0.74 0.33 0.00 -2.10 0.00 0.00 70.33 69.68 3c18 n THR 5 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3c18 h ARG 6 N 0.00 0.78 0.00 -0.78 2.43 -1.32 0.31 114.38 115.80 3c18 h ARG 6 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3c18 h ARG 6 Cb 0.31 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3c18 h ARG 6 CO 0.00 0.51 0.00 0.00 -1.51 0.00 0.00 179.97 178.97 3c18 h THR 7 N 0.80 0.00 0.03 0.20 1.03 -1.87 -1.89 112.91 111.21 3c18 h THR 7 Ca 0.48 -0.43 -0.35 0.00 -0.01 0.00 0.00 66.41 66.09 3c18 h THR 7 Cb 0.67 1.38 -0.05 0.00 -1.07 0.00 0.00 68.15 69.08 3c18 h THR 7 CO -0.24 0.00 -1.99 -0.38 -0.01 0.00 0.00 175.52 172.90 3c18 n ILE 8 N -2.93 1.58 0.14 0.00 5.41 0.94 -4.58 119.36 119.91 3c18 n ILE 8 Ca 0.01 -0.35 0.11 0.00 1.00 0.00 0.00 62.75 63.52 3c18 n ILE 8 Cb 0.28 -1.83 0.06 0.00 -0.71 0.00 0.00 39.64 37.43 3c18 n ILE 8 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 176.55 176.65 3c18 h TYR 9 N -0.62 0.00 -0.98 1.39 -0.00 -1.10 -3.37 116.97 112.29 3c18 h TYR 9 Ca -0.51 0.00 0.11 0.00 0.00 0.00 0.00 58.73 58.34 3c18 h TYR 9 Cb 1.64 0.00 -0.08 0.00 0.00 0.00 0.00 36.73 38.29 3c18 h TYR 9 CO 0.03 0.05 0.62 0.77 -0.00 0.00 0.00 178.16 179.62 3c18 h SER 10 N 0.00 0.89 0.64 0.10 0.02 -1.57 0.18 113.55 113.81 3c18 h SER 10 Ca -0.01 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 3c18 h SER 10 Cb 1.04 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 3c18 h SER 10 CO 0.00 0.49 -0.25 -0.33 -1.14 0.00 0.00 176.83 175.60 3c18 h GLU 11 N 0.96 0.00 -0.00 3.45 3.07 -1.84 -2.34 114.58 117.88 3c18 h GLU 11 Ca 0.47 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 59.17 3c18 h GLU 11 Cb 0.48 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.40 3c18 h GLU 11 CO -0.24 0.25 -0.64 1.88 -1.40 0.00 0.00 179.01 178.86 3c18 h TYR 12 N 0.00 0.65 0.00 4.33 0.05 -0.91 -2.80 116.97 118.30 3c18 h TYR 12 Ca -0.00 -0.35 -0.01 0.00 0.05 0.00 0.00 58.73 58.41 3c18 h TYR 12 Cb 0.64 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 38.30 3c18 h TYR 12 CO 0.00 1.17 -0.07 0.00 -1.05 0.00 0.00 178.16 178.22 3c18 h ALA 13 N 0.33 1.60 0.02 3.88 0.00 -1.05 -2.27 119.26 121.77 3c18 h ALA 13 Ca -0.08 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 3c18 h ALA 13 Cb 1.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3c18 h ALA 13 CO 0.13 0.08 -0.93 0.00 0.00 0.00 0.00 179.25 178.53 3c18 h ALA 14 N 1.93 0.45 -2.30 0.00 0.00 -1.28 -3.43 119.26 114.63 3c18 h ALA 14 Ca -0.00 -0.76 -0.55 0.00 0.00 0.00 0.00 54.91 53.60 3c18 h ALA 14 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3c18 h ALA 14 CO 0.01 0.95 0.98 -0.47 0.00 0.00 0.00 179.25 180.72 3c18 s TYR 15 N -3.10 2.39 0.66 0.00 5.04 -0.85 -4.87 117.35 116.61 3c18 s TYR 15 Ca -0.03 0.48 0.42 0.00 -2.44 0.00 0.00 57.07 55.51 3c18 s TYR 15 Cb 0.10 -3.80 2.32 0.00 0.35 0.00 0.00 41.96 40.93 3c18 s TYR 15 CO 0.84 -3.20 2.33 -1.35 -1.34 0.00 0.00 175.55 172.83 3c18 h PRO 16 N 8.73 0.00 0.00 4.97 0.11 -1.85 -2.29 132.00 141.67 3c18 h PRO 16 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3c18 h PRO 16 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3c18 h PRO 16 CO 0.94 0.00 -0.27 0.39 -0.21 0.00 0.00 178.00 178.84 3c18 n GLU 17 N -3.16 0.00 -2.30 1.05 -0.58 -1.26 -4.82 120.64 109.58 3c18 n GLU 17 Ca -0.03 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.29 3c18 n GLU 17 Cb 0.10 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.43 3c18 n GLU 17 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3c18 s THR 18 N -3.00 3.86 -0.11 2.62 2.01 -0.87 -1.17 115.64 118.98 3c18 s THR 18 Ca 0.12 1.24 0.18 0.00 0.31 0.00 0.00 61.69 63.55 3c18 s THR 18 Cb 0.18 -3.80 -0.27 0.00 0.01 0.00 0.00 72.50 68.62 3c18 s THR 18 CO 0.62 0.01 0.24 0.00 -0.69 0.00 0.00 174.62 174.80 3c18 n GLN 19 N 5.16 0.79 -3.58 4.92 1.13 0.19 -4.55 117.38 121.44 3c18 n GLN 19 Ca 0.12 -0.09 -0.08 0.00 -1.94 0.00 0.00 57.00 55.02 3c18 n GLN 19 Cb 0.44 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.28 3c18 n GLN 19 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3c18 s GLY 20 N -4.87 -0.26 -0.04 1.08 0.00 -1.07 -1.32 107.32 100.85 3c18 s GLY 20 Ca -0.08 1.87 -0.01 0.00 0.00 0.00 0.00 44.72 46.50 3c18 s GLY 20 CO 0.80 0.81 0.02 -0.42 0.00 0.00 0.00 173.10 174.31 3c18 s ILE 21 N -1.74 0.15 -0.02 0.90 1.01 0.91 -0.58 121.20 121.83 3c18 s ILE 21 Ca 0.03 0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.95 3c18 s ILE 21 Cb -0.01 -0.31 -0.02 0.00 0.01 0.00 0.00 42.46 42.13 3c18 s ILE 21 CO -0.03 0.19 -0.22 -0.63 0.00 0.00 0.00 174.94 174.25 3c18 s ILE 22 N 1.63 2.41 -0.08 2.92 -1.09 -0.07 -0.03 121.20 126.89 3c18 s ILE 22 Ca -0.01 -1.03 0.04 0.00 -2.23 0.00 0.00 60.65 57.42 3c18 s ILE 22 Cb -0.13 -1.89 -0.01 0.00 -1.58 0.00 0.00 42.46 38.85 3c18 s ILE 22 CO -0.03 0.54 -0.21 0.00 -1.23 0.00 0.00 174.94 174.01 3c18 s ALA 23 N -0.69 2.30 -0.09 9.38 0.00 0.49 -0.59 121.76 132.56 3c18 s ALA 23 Ca 0.11 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.08 3c18 s ALA 23 Cb -0.10 -0.83 0.02 0.00 0.00 0.00 0.00 23.12 22.21 3c18 s ALA 23 CO 0.00 0.38 -0.10 0.08 0.00 0.00 0.00 175.76 176.11 3c18 s VAL 24 N -0.03 1.13 0.11 0.00 1.01 -0.30 -0.71 120.40 121.61 3c18 s VAL 24 Ca -0.06 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 3c18 s VAL 24 Cb -0.15 -1.08 -0.06 0.00 0.00 0.00 0.00 36.38 35.09 3c18 s VAL 24 CO 0.05 0.37 0.47 -0.70 0.00 0.00 0.00 175.10 175.29 3c18 s GLU 25 N 1.19 3.86 0.55 2.72 2.12 -1.26 -0.67 118.70 127.21 3c18 s GLU 25 Ca -0.04 0.31 -0.22 0.00 0.36 0.00 0.00 54.97 55.38 3c18 s GLU 25 Cb -0.14 -2.96 -0.05 0.00 0.26 0.00 0.00 34.13 31.24 3c18 s GLU 25 CO -0.03 0.52 1.36 0.36 -0.54 0.00 0.00 175.26 176.94 3c18 n LYS 26 N 0.84 1.68 -0.00 4.30 2.85 -0.84 -4.91 118.16 122.09 3c18 n LYS 26 Ca -0.07 0.62 0.09 0.00 -1.05 0.00 0.00 58.31 57.91 3c18 n LYS 26 Cb 0.52 -2.58 -0.12 0.00 -0.65 0.00 0.00 35.03 32.20 3c18 n LYS 26 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3c18 n ARG 27 N -1.06 0.53 -3.67 -1.58 1.74 -1.26 -5.00 116.66 106.36 3c18 n ARG 27 Ca 0.11 -0.02 -0.04 0.00 -0.77 0.00 0.00 57.85 57.12 3c18 n ARG 27 Cb 0.45 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.44 3c18 n ARG 27 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3c18 s GLN 28 N -2.92 1.01 0.51 5.56 -2.07 -1.26 -5.10 119.66 115.39 3c18 s GLN 28 Ca 0.05 -0.52 -0.22 0.00 -1.82 0.00 0.00 55.36 52.86 3c18 s GLN 28 Cb 0.15 0.37 -0.06 0.00 -1.09 0.00 0.00 33.01 32.38 3c18 s GLN 28 CO 0.81 -0.46 1.22 -2.14 -1.32 0.00 0.00 175.29 173.40 3c18 s PRO 29 N -3.16 3.42 -1.35 9.60 0.02 -1.26 -3.19 135.00 139.09 3c18 s PRO 29 Ca 0.10 1.90 -0.02 0.00 0.02 0.00 0.00 61.00 63.00 3c18 s PRO 29 Cb -0.01 -2.25 -0.00 0.00 0.02 0.00 0.00 34.50 32.26 3c18 s PRO 29 CO -0.01 -0.86 0.54 0.54 -0.33 0.00 0.00 177.00 176.87 3c18 n ARG 30 N -0.89 -3.55 -2.53 5.54 1.74 -1.26 -4.90 116.66 110.81 3c18 n ARG 30 Ca 0.10 0.48 -0.43 0.00 -0.77 0.00 0.00 57.85 57.22 3c18 n ARG 30 Cb 0.48 -4.68 -0.02 0.00 -1.02 0.00 0.00 32.46 27.21 3c18 n ARG 30 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3c18 s ASP 31 N -4.27 7.03 0.52 0.55 -1.08 -1.19 -4.78 116.67 113.45 3c18 s ASP 31 Ca 0.05 1.59 0.28 0.00 -0.52 0.00 0.00 52.55 53.95 3c18 s ASP 31 Cb -0.02 -2.54 1.43 0.00 -1.46 0.00 0.00 42.92 40.33 3c18 s ASP 31 CO 0.86 -0.68 2.06 0.77 0.52 0.00 0.00 175.17 178.70 3c18 h SER 32 N 7.77 0.00 0.08 -0.34 4.64 -1.93 0.83 113.55 124.60 3c18 h SER 32 Ca -0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 3c18 h SER 32 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3c18 h SER 32 CO 0.95 0.12 -0.07 0.25 -0.87 0.00 0.00 176.83 177.22 3c18 h LEU 33 N 0.00 0.00 -2.97 5.97 5.85 -1.98 -2.76 115.31 119.43 3c18 h LEU 33 Ca -0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 3c18 h LEU 33 Cb 0.36 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 3c18 h LEU 33 CO 0.02 0.07 -0.50 0.35 -0.34 0.00 0.00 178.44 178.03 3c18 n THR 34 N -4.30 1.78 -2.23 1.05 -2.24 -0.97 -4.96 114.28 102.41 3c18 n THR 34 Ca -0.03 -2.68 -0.21 0.00 -2.27 0.00 0.00 64.05 58.86 3c18 n THR 34 Cb 0.15 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 3c18 n THR 34 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3c18 n ASP 35 N -0.90 -5.86 -0.79 3.42 8.00 -1.04 -1.33 116.55 118.05 3c18 n ASP 35 Ca 0.16 0.10 -0.10 0.00 0.71 0.00 0.00 54.79 55.66 3c18 n ASP 35 Cb 0.75 -4.93 -0.04 0.00 -0.02 0.00 0.00 41.12 36.87 3c18 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3c18 n GLN 36 N -2.88 -0.80 -2.93 -1.24 3.00 0.25 -4.99 117.38 107.79 3c18 n GLN 36 Ca -0.24 0.85 -0.17 0.00 -0.01 0.00 0.00 57.00 57.43 3c18 n GLN 36 Cb 0.69 -4.81 0.01 0.00 0.00 0.00 0.00 30.24 26.13 3c18 n GLN 36 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3c18 n PHE 37 N -2.66 -1.16 -0.02 1.08 3.01 -0.44 -4.73 117.46 112.54 3c18 n PHE 37 Ca -0.10 -1.53 -0.18 0.00 1.01 0.00 0.00 57.45 56.66 3c18 n PHE 37 Cb 0.36 -0.31 -0.14 0.00 -0.01 0.00 0.00 39.48 39.38 3c18 n PHE 37 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3c18 n ASP 38 N -2.00 1.72 -3.82 4.37 8.00 -0.36 -4.62 116.55 119.84 3c18 n ASP 38 Ca 0.01 0.20 -0.13 0.00 0.71 0.00 0.00 54.79 55.57 3c18 n ASP 38 Cb 0.41 -0.53 -0.14 0.00 -0.02 0.00 0.00 41.12 40.84 3c18 n ASP 38 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3c18 s VAL 39 N -2.56 -0.02 -0.16 2.53 1.01 -0.94 -1.98 120.40 118.27 3c18 s VAL 39 Ca -0.19 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 61.85 3c18 s VAL 39 Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.33 3c18 s VAL 39 CO 0.76 0.03 -0.07 -0.22 0.00 0.00 0.00 175.10 175.60 3c18 s LEU 40 N 0.48 2.97 -0.14 3.92 0.20 0.16 -1.53 118.68 124.73 3c18 s LEU 40 Ca -0.04 -0.26 -0.04 0.00 0.69 0.00 0.00 54.13 54.48 3c18 s LEU 40 Cb -0.05 -1.71 -0.03 0.00 -0.43 0.00 0.00 46.19 43.97 3c18 s LEU 40 CO -0.02 0.13 -0.01 -0.76 -0.29 0.00 0.00 176.35 175.40 3c18 s LEU 41 N 0.60 3.42 -0.26 -0.68 1.43 0.71 -1.15 118.68 122.75 3c18 s LEU 41 Ca -0.05 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.01 3c18 s LEU 41 Cb -0.15 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.28 3c18 s LEU 41 CO 0.03 0.22 -0.05 -0.22 0.23 0.00 0.00 176.35 176.56 3c18 s LEU 42 N 0.08 3.37 -0.27 1.79 2.96 0.24 -0.53 118.68 126.31 3c18 s LEU 42 Ca 0.01 -0.97 -0.07 0.00 -0.22 0.00 0.00 54.13 52.88 3c18 s LEU 42 Cb -0.13 -1.67 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 3c18 s LEU 42 CO 0.02 -0.16 0.08 -0.69 -1.32 0.00 0.00 176.35 174.28 3c18 s VAL 43 N 1.30 4.16 -0.20 1.68 1.01 0.46 -0.89 120.40 127.92 3c18 s VAL 43 Ca -0.01 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.46 3c18 s VAL 43 Cb -0.17 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 3c18 s VAL 43 CO -0.04 0.22 0.12 -0.63 0.00 0.00 0.00 175.10 174.78 3c18 s ILE 44 N 1.57 5.30 0.03 2.22 1.09 0.26 -1.60 121.20 130.06 3c18 s ILE 44 Ca 0.05 0.15 -0.03 0.00 -1.10 0.00 0.00 60.65 59.72 3c18 s ILE 44 Cb -0.16 -3.42 -0.02 0.00 -1.06 0.00 0.00 42.46 37.80 3c18 s ILE 44 CO 0.03 0.43 0.04 0.28 -0.10 0.00 0.00 174.94 175.62 3c18 s THR 45 N 0.46 0.14 -1.39 2.92 -1.32 -0.78 0.53 115.64 116.21 3c18 s THR 45 Ca 0.07 -1.15 0.17 0.00 -1.21 0.00 0.00 61.69 59.57 3c18 s THR 45 Cb -0.12 -0.80 0.49 0.00 -1.51 0.00 0.00 72.50 70.56 3c18 s THR 45 CO -0.01 -0.63 1.41 0.54 -2.21 0.00 0.00 174.62 173.71 3c18 n ARG 46 N 0.93 2.86 -1.60 7.08 1.74 -0.31 -1.13 116.66 126.23 3c18 n ARG 46 Ca -0.20 -2.39 -0.55 0.00 -0.77 0.00 0.00 57.85 53.95 3c18 n ARG 46 Cb 0.58 -1.45 -0.07 0.00 -1.02 0.00 0.00 32.46 30.50 3c18 n ARG 46 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3c18 n ASP 47 N 1.03 2.31 0.04 0.55 -0.08 -1.26 -4.78 116.55 114.36 3c18 n ASP 47 Ca 0.18 0.83 0.07 0.00 -1.51 0.00 0.00 54.79 54.37 3c18 n ASP 47 Cb 0.55 -1.18 0.32 0.00 2.34 0.00 0.00 41.12 43.14 3c18 n ASP 47 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3c18 n PRO 48 N 6.54 0.05 0.00 -0.67 -0.04 -1.26 -1.44 135.00 138.17 3c18 n PRO 48 Ca 0.33 0.35 0.13 0.00 -0.04 0.00 0.00 63.50 64.26 3c18 n PRO 48 Cb 0.16 -1.61 0.33 0.00 -0.04 0.00 0.00 33.50 32.35 3c18 n PRO 48 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3c18 n SER 49 N -1.70 0.67 -4.71 3.54 3.41 -1.26 -4.89 113.62 108.67 3c18 n SER 49 Ca 0.02 -0.47 -0.35 0.00 -0.26 0.00 0.00 58.87 57.81 3c18 n SER 49 Cb 0.15 0.16 -0.09 0.00 -0.26 0.00 0.00 64.21 64.17 3c18 n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3c18 s VAL 50 N -2.79 4.98 0.00 -3.33 1.01 -0.52 -4.99 120.40 114.77 3c18 s VAL 50 Ca 0.17 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.18 3c18 s VAL 50 Cb 0.18 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.35 3c18 s VAL 50 CO 0.61 0.51 0.00 1.21 0.00 0.00 0.00 175.10 177.43 3c18 n GLU 51 N 3.02 0.00 -3.69 2.72 4.07 -1.26 -4.42 120.64 121.08 3c18 n GLU 51 Ca -0.17 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 56.82 3c18 n GLU 51 Cb 0.53 -0.04 -0.10 0.00 -0.06 0.00 0.00 31.44 31.77 3c18 n GLU 51 CO 0.00 0.00 0.00 -0.46 -0.06 0.00 0.00 177.13 176.61 3c18 s TRP 52 N -0.13 -0.65 0.22 4.31 -0.00 -1.26 -0.95 118.94 120.48 3c18 s TRP 52 Ca 0.00 1.39 -0.06 0.00 -0.00 0.00 0.00 56.10 57.43 3c18 s TRP 52 Cb 0.00 0.30 -0.02 0.00 -0.00 0.00 0.00 33.47 33.75 3c18 s TRP 52 CO 0.00 -0.35 0.29 -0.08 -0.00 0.00 0.00 176.95 176.81 3c18 s THR 53 N 1.27 0.00 0.01 5.86 -1.32 0.67 -5.01 115.64 117.13 3c18 s THR 53 Ca -0.08 -1.73 0.02 0.00 -1.21 0.00 0.00 61.69 58.69 3c18 s THR 53 Cb -0.07 -2.36 -0.01 0.00 -1.51 0.00 0.00 72.50 68.55 3c18 s THR 53 CO -0.12 -0.00 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.54 3c18 s VAL 54 N -4.09 0.42 0.01 5.08 1.01 -1.26 -0.94 120.40 120.63 3c18 s VAL 54 Ca 0.31 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.86 3c18 s VAL 54 Cb 0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 36.00 3c18 s VAL 54 CO 0.11 -0.04 -0.10 -0.54 0.00 0.00 0.00 175.10 174.52 3c18 s LYS 55 N -0.56 0.72 -0.10 2.72 1.02 -0.13 -4.99 119.74 118.43 3c18 s LYS 55 Ca -0.02 -0.50 0.03 0.00 0.02 0.00 0.00 55.97 55.50 3c18 s LYS 55 Cb -0.04 -0.68 0.01 0.00 -0.52 0.00 0.00 37.83 36.60 3c18 s LYS 55 CO -0.00 0.17 -0.21 -1.01 -0.92 0.00 0.00 175.35 173.38 3c18 s HIS 56 N -0.57 2.34 0.13 3.18 3.76 -1.26 -0.26 115.29 122.61 3c18 s HIS 56 Ca 0.01 -1.00 0.05 0.00 -0.15 0.00 0.00 55.06 53.97 3c18 s HIS 56 Cb -0.06 -1.59 -0.04 0.00 1.11 0.00 0.00 32.58 32.00 3c18 s HIS 56 CO 0.00 -0.43 -0.13 0.71 -0.85 0.00 0.00 174.74 174.04 3c18 s TYR 57 N 0.53 1.33 -0.10 1.40 2.02 -0.14 -5.01 117.35 117.38 3c18 s TYR 57 Ca -0.15 -0.60 0.02 0.00 -0.37 0.00 0.00 57.07 55.96 3c18 s TYR 57 Cb -0.17 -0.69 0.01 0.00 -0.40 0.00 0.00 41.96 40.71 3c18 s TYR 57 CO 0.05 0.12 -0.15 0.50 -1.57 0.00 0.00 175.55 174.51 3c18 s ARG 58 N -2.90 2.15 -0.30 -0.62 3.52 -1.26 -0.56 118.95 118.97 3c18 s ARG 58 Ca 0.10 -0.54 0.03 0.00 -0.13 0.00 0.00 55.73 55.20 3c18 s ARG 58 Cb -0.03 -1.83 0.08 0.00 -1.56 0.00 0.00 34.95 31.61 3c18 s ARG 58 CO 0.02 -0.06 -0.01 -1.17 -0.81 0.00 0.00 175.30 173.27 3c18 s LEU 59 N 0.98 4.07 0.00 -0.88 2.96 0.50 -4.93 118.68 121.37 3c18 s LEU 59 Ca -0.07 -1.81 0.00 0.00 -0.22 0.00 0.00 54.13 52.03 3c18 s LEU 59 Cb -0.15 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 45.00 3c18 s LEU 59 CO -0.01 -0.30 0.00 0.59 -1.32 0.00 0.00 176.35 175.30 3c18 n ASN 60 N 4.36 0.00 -0.00 3.68 3.02 -1.26 -1.40 115.26 123.66 3c18 n ASN 60 Ca -0.04 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.56 3c18 n ASN 60 Cb 0.42 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.54 3c18 n ASN 60 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 3c18 n THR 61 N 0.00 0.00 -3.09 3.41 5.66 -1.26 -4.98 114.28 114.01 3c18 n THR 61 Ca 0.00 -0.27 -0.41 0.00 -3.05 0.00 0.00 64.05 60.31 3c18 n THR 61 Cb 0.00 0.85 -0.06 0.00 -1.55 0.00 0.00 70.33 69.56 3c18 n THR 61 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 3c18 s LEU 62 N -2.68 4.14 -0.16 1.09 2.96 -0.50 -5.04 118.68 118.50 3c18 s LEU 62 Ca 0.02 0.44 -0.20 0.00 -0.22 0.00 0.00 54.13 54.17 3c18 s LEU 62 Cb 0.06 -2.85 -0.03 0.00 0.50 0.00 0.00 46.19 43.88 3c18 s LEU 62 CO 0.36 -0.50 0.58 -0.13 -1.32 0.00 0.00 176.35 175.34 3c18 s ARG 63 N 2.65 4.27 -0.11 1.98 0.52 -1.26 -0.37 118.95 126.64 3c18 s ARG 63 Ca 0.26 0.57 0.01 0.00 -0.52 0.00 0.00 55.73 56.05 3c18 s ARG 63 Cb -0.15 -3.52 0.02 0.00 0.52 0.00 0.00 34.95 31.82 3c18 s ARG 63 CO 0.12 -0.08 -0.13 0.08 0.02 0.00 0.00 175.30 175.31 3c18 s VAL 64 N 1.40 1.34 -0.18 3.52 1.01 0.27 -1.22 120.40 126.54 3c18 s VAL 64 Ca 0.28 -0.54 -0.13 0.00 0.00 0.00 0.00 61.98 61.60 3c18 s VAL 64 Cb -0.16 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 3c18 s VAL 64 CO 0.11 0.41 0.26 -0.55 0.00 0.00 0.00 175.10 175.33 3c18 s SER 65 N 1.13 6.37 -0.24 3.32 0.15 -0.59 -0.96 113.70 122.87 3c18 s SER 65 Ca -0.04 0.42 -0.03 0.00 0.70 0.00 0.00 55.95 57.00 3c18 s SER 65 Cb -0.14 -2.16 0.01 0.00 -1.71 0.00 0.00 66.02 62.02 3c18 s SER 65 CO -0.03 0.10 -0.04 -0.22 1.20 0.00 0.00 173.24 174.25 3c18 s LEU 66 N 0.54 3.15 -0.31 3.45 0.20 0.64 -0.21 118.68 126.14 3c18 s LEU 66 Ca 0.14 -0.69 -0.15 0.00 0.69 0.00 0.00 54.13 54.13 3c18 s LEU 66 Cb -0.13 -1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 43.90 3c18 s LEU 66 CO 0.03 -0.10 0.35 -1.00 -0.29 0.00 0.00 176.35 175.34 3c18 s HIS 67 N 1.40 3.22 -0.31 5.38 3.76 0.31 -0.95 115.29 128.10 3c18 s HIS 67 Ca 0.03 0.13 -0.08 0.00 -0.15 0.00 0.00 55.06 54.98 3c18 s HIS 67 Cb -0.16 -2.62 0.01 0.00 1.11 0.00 0.00 32.58 30.92 3c18 s HIS 67 CO -0.03 -0.35 0.12 -1.17 -0.85 0.00 0.00 174.74 172.45 3c18 s LEU 68 N 2.02 4.02 -0.01 0.89 2.96 -0.12 -0.41 118.68 128.04 3c18 s LEU 68 Ca 0.12 -0.68 0.03 0.00 -0.22 0.00 0.00 54.13 53.39 3c18 s LEU 68 Cb -0.16 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 3c18 s LEU 68 CO 0.11 -0.21 -0.10 0.54 -1.32 0.00 0.00 176.35 175.37 3c18 s VAL 69 N 1.54 0.80 0.31 1.68 0.11 -0.63 -0.24 120.40 123.97 3c18 s VAL 69 Ca 0.03 -0.43 -0.28 0.00 -2.93 0.00 0.00 61.98 58.37 3c18 s VAL 69 Cb -0.17 -0.67 -0.09 0.00 -1.53 0.00 0.00 36.38 33.91 3c18 s VAL 69 CO 0.04 0.23 1.11 -2.28 -3.33 0.00 0.00 175.10 170.86 3c18 s HIS 70 N -0.23 3.47 0.55 1.54 2.46 -0.12 -1.87 115.29 121.08 3c18 s HIS 70 Ca 0.04 1.67 0.29 0.00 0.47 0.00 0.00 55.06 57.53 3c18 s HIS 70 Cb -0.04 -3.29 1.46 0.00 -0.13 0.00 0.00 32.58 30.58 3c18 s HIS 70 CO -0.00 -0.68 1.92 1.49 -2.47 0.00 0.00 174.74 174.99 3c18 h GLU 71 N 3.51 0.00 0.00 2.88 4.81 -1.48 -0.20 114.58 124.10 3c18 h GLU 71 Ca -0.47 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.60 3c18 h GLU 71 Cb 1.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 3c18 h GLU 71 CO 0.66 0.00 -1.19 1.96 -0.73 0.00 0.00 179.01 179.71 3c18 h GLN 72 N 0.00 0.00 -0.10 1.92 4.20 -1.91 -2.01 115.11 117.21 3c18 h GLN 72 Ca 0.33 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.85 3c18 h GLN 72 Cb 1.41 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.20 3c18 h GLN 72 CO -0.00 0.39 -0.69 0.28 -0.67 0.00 0.00 178.83 178.14 3c18 h VAL 73 N 0.00 1.32 -0.45 -0.54 2.07 -1.39 -2.74 116.25 114.53 3c18 h VAL 73 Ca -0.12 -1.96 -0.07 0.00 0.82 0.00 0.00 66.70 65.37 3c18 h VAL 73 Cb 1.57 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 33.49 3c18 h VAL 73 CO 0.06 0.60 0.01 0.25 0.02 0.00 0.00 177.57 178.51 3c18 h LEU 74 N 0.31 0.77 -0.06 2.57 5.85 -1.33 -2.05 115.31 121.37 3c18 h LEU 74 Ca -0.06 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.38 3c18 h LEU 74 Cb 1.34 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 3c18 h LEU 74 CO 0.14 0.88 -0.04 -1.28 -0.34 0.00 0.00 178.44 177.80 3c18 h SER 75 N 0.63 -0.14 -0.80 1.25 0.87 -1.40 -0.42 113.55 113.54 3c18 h SER 75 Ca 0.13 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.76 3c18 h SER 75 Cb 0.49 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.47 3c18 h SER 75 CO 0.02 -0.06 0.51 -0.09 -0.53 0.00 0.00 176.83 176.68 3c18 h ARG 76 N -0.05 0.94 -0.90 2.24 2.43 -1.45 0.13 114.38 117.72 3c18 h ARG 76 Ca 0.04 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3c18 h ARG 76 Cb 0.11 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 3c18 h ARG 76 CO -0.09 0.62 0.59 -1.49 -1.51 0.00 0.00 179.97 178.09 3c18 h TRP 77 N 0.97 1.13 0.03 2.20 6.55 -0.55 -1.60 115.95 124.67 3c18 h TRP 77 Ca 0.33 0.03 -0.22 0.00 0.95 0.00 0.00 58.89 59.97 3c18 h TRP 77 Cb 0.06 -0.38 -0.00 0.00 -0.86 0.00 0.00 29.16 27.98 3c18 h TRP 77 CO -0.03 0.71 -0.98 -0.07 -1.05 0.00 0.00 178.44 177.02 3c18 h LEU 78 N 1.22 0.39 -0.82 -4.49 3.38 -0.28 0.95 115.31 115.67 3c18 h LEU 78 Ca 0.33 -0.34 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3c18 h LEU 78 Cb -0.14 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3c18 h LEU 78 CO -0.07 1.17 -0.17 0.40 0.09 0.00 0.00 178.44 179.85 3c18 h ILE 79 N 0.15 1.26 -0.01 1.22 2.04 -0.34 -2.99 117.51 118.84 3c18 h ILE 79 Ca -0.08 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.56 3c18 h ILE 79 Cb 1.64 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 3c18 h ILE 79 CO 0.16 0.41 -0.62 0.18 0.00 0.00 0.00 178.15 178.28 3c18 n LEU 80 N -4.14 1.43 -3.64 1.44 4.77 -0.64 -4.83 117.00 111.39 3c18 n LEU 80 Ca 0.01 -0.54 -0.23 0.00 -0.03 0.00 0.00 56.01 55.21 3c18 n LEU 80 Cb 0.39 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.51 3c18 n LEU 80 CO 0.43 0.29 0.15 -3.20 -1.33 0.00 0.00 177.39 173.73 3c18 n ASN 81 N -0.71 -4.42 -0.71 -1.43 5.15 -0.03 -4.90 115.26 108.21 3c18 n ASN 81 Ca 0.08 -0.64 0.13 0.00 -0.60 0.00 0.00 54.58 53.54 3c18 n ASN 81 Cb 0.40 -4.69 0.29 0.00 -0.53 0.00 0.00 39.78 35.25 3c18 n ASN 81 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3c18 n ALA 82 N -4.65 2.57 -3.27 5.20 0.00 0.12 -4.73 120.51 115.75 3c18 n ALA 82 Ca -0.09 -0.57 -0.09 0.00 0.00 0.00 0.00 53.44 52.68 3c18 n ALA 82 Cb 0.59 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 3c18 n ALA 82 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3c18 s ASN 83 N -2.03 -0.03 0.33 0.00 3.84 -1.26 -5.02 114.94 110.77 3c18 s ASN 83 Ca 0.32 -1.33 0.03 0.00 0.21 0.00 0.00 52.86 52.08 3c18 s ASN 83 Cb 0.20 1.16 0.57 0.00 -0.55 0.00 0.00 41.25 42.62 3c18 s ASN 83 CO 0.33 -0.21 1.89 0.03 -2.79 0.00 0.00 177.10 176.36 3c18 h ARG 84 N 6.87 0.65 -0.65 0.43 2.47 -1.94 -2.23 114.38 119.99 3c18 h ARG 84 Ca 0.06 -0.12 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 3c18 h ARG 84 Cb 1.10 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 29.28 3c18 h ARG 84 CO 0.15 0.60 0.37 0.00 0.56 0.00 0.00 179.97 181.64 3c18 h ARG 85 N 0.64 0.89 -0.64 0.04 3.08 -1.99 -2.37 114.38 114.03 3c18 h ARG 85 Ca 0.15 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 3c18 h ARG 85 Cb 0.24 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 3c18 h ARG 85 CO -0.00 0.66 0.21 0.00 -1.07 0.00 0.00 179.97 179.77 3c18 h ALA 86 N 1.18 1.18 -0.59 0.04 0.00 -1.84 0.15 119.26 119.38 3c18 h ALA 86 Ca 0.23 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3c18 h ALA 86 Cb 0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3c18 h ALA 86 CO -0.04 0.58 0.38 0.28 0.00 0.00 0.00 179.25 180.46 3c18 h VAL 87 N 0.93 1.16 -0.57 0.00 2.07 -1.25 -1.19 116.25 117.39 3c18 h VAL 87 Ca 0.21 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 3c18 h VAL 87 Cb 0.24 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 3c18 h VAL 87 CO -0.01 0.15 0.17 -0.74 0.02 0.00 0.00 177.57 177.16 3c18 h HIS 88 N 0.80 0.93 -0.19 1.57 6.17 -0.78 -0.96 115.15 122.69 3c18 h HIS 88 Ca 0.22 -0.10 -0.00 0.00 0.71 0.00 0.00 60.37 61.20 3c18 h HIS 88 Cb -0.08 -0.27 -0.01 0.00 2.52 0.00 0.00 27.41 29.57 3c18 h HIS 88 CO -0.03 0.78 0.11 -1.49 0.71 0.00 0.00 177.93 178.01 3c18 h TRP 89 N 0.81 0.26 -0.13 5.26 6.55 -0.21 0.67 115.95 129.16 3c18 h TRP 89 Ca 0.18 -0.00 -0.14 0.00 0.95 0.00 0.00 58.89 59.88 3c18 h TRP 89 Cb 0.29 -0.08 -0.01 0.00 -0.86 0.00 0.00 29.16 28.50 3c18 h TRP 89 CO 0.02 0.23 -0.54 0.28 -1.05 0.00 0.00 178.44 177.38 3c18 h VAL 90 N 0.21 1.35 0.16 1.49 2.07 -1.03 0.21 116.25 120.71 3c18 h VAL 90 Ca 0.07 -1.81 -0.30 0.00 0.82 0.00 0.00 66.70 65.48 3c18 h VAL 90 Cb 0.06 1.84 0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3c18 h VAL 90 CO -0.01 0.55 -1.45 0.77 0.02 0.00 0.00 177.57 177.45 3c18 h SER 91 N 0.28 0.53 0.39 0.57 4.64 -0.94 -3.35 113.55 115.67 3c18 h SER 91 Ca 0.01 -0.90 0.00 0.00 -0.47 0.00 0.00 61.79 60.42 3c18 h SER 91 Cb 1.04 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 3c18 h SER 91 CO 0.09 1.65 -1.01 -0.62 -0.87 0.00 0.00 176.83 176.08 3c18 n GLU 92 N -3.82 0.25 -1.93 4.77 -0.58 0.21 -4.97 120.64 114.56 3c18 n GLU 92 Ca -0.22 -0.01 -0.34 0.00 -0.42 0.00 0.00 57.16 56.17 3c18 n GLU 92 Cb 0.97 -1.58 0.03 0.00 -0.57 0.00 0.00 31.44 30.30 3c18 n GLU 92 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3c18 s GLY 93 N -3.57 2.36 -0.15 0.62 0.00 0.06 -5.01 107.32 101.64 3c18 s GLY 93 Ca 0.04 0.68 -0.20 0.00 0.00 0.00 0.00 44.72 45.24 3c18 s GLY 93 CO 0.80 1.04 0.56 -1.59 0.00 0.00 0.00 173.10 173.91 3c18 s THR 94 N -2.09 5.11 -0.34 0.90 2.01 0.11 -4.86 115.64 116.48 3c18 s THR 94 Ca 0.70 1.10 -0.29 0.00 0.31 0.00 0.00 61.69 63.50 3c18 s THR 94 Cb -0.22 -3.89 0.01 0.00 0.01 0.00 0.00 72.50 68.40 3c18 s THR 94 CO 0.36 0.23 1.28 -0.63 -0.69 0.00 0.00 174.62 175.17 3c18 s ILE 95 N 1.18 4.15 -0.08 1.82 1.01 -1.26 -0.38 121.20 127.64 3c18 s ILE 95 Ca 0.28 1.27 0.08 0.00 0.00 0.00 0.00 60.65 62.28 3c18 s ILE 95 Cb -0.16 -4.24 -0.24 0.00 0.01 0.00 0.00 42.46 37.84 3c18 s ILE 95 CO 0.11 -0.57 0.53 -0.38 0.00 0.00 0.00 174.94 174.63 3c18 n ILE 96 N 6.38 1.64 -3.60 2.92 2.08 0.96 -4.98 119.36 124.75 3c18 n ILE 96 Ca 0.14 -0.76 -0.11 0.00 0.56 0.00 0.00 62.75 62.59 3c18 n ILE 96 Cb 0.47 -1.18 -0.06 0.00 -0.75 0.00 0.00 39.64 38.12 3c18 n ILE 96 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 3c18 s PHE 97 N -2.58 -0.47 0.05 1.39 5.36 -1.08 -4.97 117.98 115.69 3c18 s PHE 97 Ca -0.10 1.01 -0.26 0.00 -0.96 0.00 0.00 56.93 56.61 3c18 s PHE 97 Cb 0.08 0.39 0.07 0.00 -0.34 0.00 0.00 43.02 43.22 3c18 s PHE 97 CO 0.81 -0.32 0.62 -1.83 -1.46 0.00 0.00 175.22 173.04 3c18 s GLU 98 N -0.40 1.15 -0.04 10.12 -1.05 -1.26 -0.07 118.70 127.16 3c18 s GLU 98 Ca -0.00 -0.13 0.05 0.00 -0.15 0.00 0.00 54.97 54.74 3c18 s GLU 98 Cb -0.03 0.53 -0.02 0.00 -0.44 0.00 0.00 34.13 34.17 3c18 s GLU 98 CO -0.01 -0.43 -0.19 1.03 0.95 0.00 0.00 175.26 176.60 3c18 s ARG 99 N -2.48 2.34 -1.55 -4.83 0.52 -0.43 -4.73 118.95 107.79 3c18 s ARG 99 Ca -0.05 -0.79 -0.00 0.00 -0.52 0.00 0.00 55.73 54.36 3c18 s ARG 99 Cb -0.01 -2.24 0.00 0.00 0.52 0.00 0.00 34.95 33.23 3c18 s ARG 99 CO -0.02 0.60 0.06 0.09 0.02 0.00 0.00 175.30 176.05 3c18 n ASN 100 N 2.37 -5.36 -1.76 0.23 3.02 -1.26 -1.91 115.26 110.59 3c18 n ASN 100 Ca -0.17 -0.05 -0.16 0.00 -0.03 0.00 0.00 54.58 54.18 3c18 n ASN 100 Cb 0.52 -4.39 -0.05 0.00 -0.61 0.00 0.00 39.78 35.24 3c18 n ASN 100 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3c18 n ASP 101 N -1.56 -4.32 -0.20 6.41 8.00 -1.26 -4.83 116.55 118.78 3c18 n ASP 101 Ca -0.20 0.30 0.01 0.00 0.71 0.00 0.00 54.79 55.61 3c18 n ASP 101 Cb 0.66 -3.84 0.10 0.00 -0.02 0.00 0.00 41.12 38.02 3c18 n ASP 101 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3c18 h TYR 102 N 0.00 -0.01 0.04 1.24 3.20 -1.63 -0.70 116.97 119.10 3c18 h TYR 102 Ca -0.34 0.04 -0.24 0.00 3.14 0.00 0.00 58.73 61.33 3c18 h TYR 102 Cb 1.10 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 3c18 h TYR 102 CO 0.50 -0.15 -1.17 -0.07 -1.64 0.00 0.00 178.16 175.63 3c18 h LEU 103 N 0.13 0.12 -0.52 2.82 3.38 -1.84 -1.96 115.31 117.45 3c18 h LEU 103 Ca 0.32 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 3c18 h LEU 103 Cb 0.51 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3c18 h LEU 103 CO -0.51 1.12 -0.10 0.74 0.09 0.00 0.00 178.44 179.77 3c18 h THR 104 N 0.02 1.27 -0.23 0.22 2.02 -1.85 -1.96 112.91 112.40 3c18 h THR 104 Ca -0.09 -1.25 -0.16 0.00 0.77 0.00 0.00 66.41 65.68 3c18 h THR 104 Cb 1.86 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 3c18 h THR 104 CO 0.14 0.44 -0.52 0.44 0.37 0.00 0.00 175.52 176.39 3c18 h ASP 105 N 0.85 0.72 -0.63 4.18 3.32 -1.18 -3.12 116.42 120.56 3c18 h ASP 105 Ca 0.13 -0.37 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 3c18 h ASP 105 Cb 0.67 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 3c18 h ASP 105 CO 0.05 1.11 0.18 0.25 -1.72 0.00 0.00 179.24 179.10 3c18 h LEU 106 N 0.51 0.94 -1.25 1.55 5.85 -1.11 -0.80 115.31 120.99 3c18 h LEU 106 Ca 0.02 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.53 3c18 h LEU 106 Cb 1.08 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 3c18 h LEU 106 CO 0.10 0.91 0.51 0.11 -0.34 0.00 0.00 178.44 179.73 3c18 h LYS 107 N 0.92 0.99 -0.11 1.25 1.57 -1.33 -1.26 116.57 118.60 3c18 h LYS 107 Ca 0.20 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.86 3c18 h LYS 107 Cb 0.32 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.41 3c18 h LYS 107 CO -0.00 0.66 -0.19 0.87 -0.57 0.00 0.00 179.45 180.21 3c18 h LYS 108 N 1.02 0.32 -0.18 3.15 1.57 -1.40 -3.16 116.57 117.89 3c18 h LYS 108 Ca 0.29 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3c18 h LYS 108 Cb -0.08 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 3c18 h LYS 108 CO -0.07 0.79 0.12 1.96 -0.57 0.00 0.00 179.45 181.67 3c18 h GLN 109 N -0.12 0.24 0.00 3.15 4.20 -0.71 -0.85 115.11 121.01 3c18 h GLN 109 Ca 0.01 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3c18 h GLN 109 Cb 0.77 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.49 3c18 h GLN 109 CO 0.04 0.16 0.00 1.28 -0.67 0.00 0.00 178.83 179.64 3c18 n LEU 110 N -4.51 0.62 -0.10 1.46 4.77 -0.51 -1.25 117.00 117.47 3c18 n LEU 110 Ca -0.00 0.67 0.14 0.00 -0.03 0.00 0.00 56.01 56.78 3c18 n LEU 110 Cb 0.08 -0.61 0.53 0.00 -2.33 0.00 0.00 43.42 41.09 3c18 n LEU 110 CO 0.35 -0.60 0.80 0.54 -1.33 0.00 0.00 177.39 177.14 3c18 n ARG 111 N -2.21 0.53 -4.38 3.23 1.74 -0.32 -4.81 116.66 110.44 3c18 n ARG 111 Ca 0.02 -0.21 -0.29 0.00 -0.77 0.00 0.00 57.85 56.60 3c18 n ARG 111 Cb 0.20 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 30.02 3c18 n ARG 111 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3c18 s ASN 112 N -2.61 3.71 -0.63 0.55 2.47 -0.38 -5.09 114.94 112.96 3c18 s ASN 112 Ca 0.24 -0.60 0.03 0.00 0.42 0.00 0.00 52.86 52.96 3c18 s ASN 112 Cb 0.19 -0.46 0.15 0.00 -1.45 0.00 0.00 41.25 39.69 3c18 s ASN 112 CO 0.52 0.19 0.40 0.12 -3.72 0.00 0.00 177.10 174.61 3c18 s PHE 113 N -1.09 3.40 0.27 0.43 2.19 -1.26 -4.98 117.98 116.94 3c18 s PHE 113 Ca 0.16 -3.18 -0.29 0.00 0.33 0.00 0.00 56.93 53.95 3c18 s PHE 113 Cb -0.10 -2.85 -0.14 0.00 -1.31 0.00 0.00 43.02 38.62 3c18 s PHE 113 CO 0.08 -0.68 1.06 -2.30 1.83 0.00 0.00 175.22 175.21 3c18 n PRO 114 N 2.67 1.37 -0.30 10.12 -0.02 -1.26 -4.76 135.00 142.81 3c18 n PRO 114 Ca 0.12 0.48 -0.01 0.00 -2.02 0.00 0.00 63.50 62.07 3c18 n PRO 114 Cb 0.34 -1.89 0.11 0.00 -0.02 0.00 0.00 33.50 32.04 3c18 n PRO 114 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3c18 h GLU 115 N 2.32 1.00 -0.36 -0.52 4.57 -1.99 -0.62 114.58 118.99 3c18 h GLU 115 Ca -0.40 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 57.63 3c18 h GLU 115 Cb 1.34 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.69 3c18 h GLU 115 CO 0.63 0.66 -0.14 0.00 -1.18 0.00 0.00 179.01 178.98 3c18 h THR 116 N 1.03 1.25 -0.16 0.32 1.03 -1.99 -1.16 112.91 113.22 3c18 h THR 116 Ca 0.34 -1.13 -0.20 0.00 -0.01 0.00 0.00 66.41 65.41 3c18 h THR 116 Cb 0.04 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 68.25 3c18 h THR 116 CO -0.13 0.38 -0.70 -0.33 -0.01 0.00 0.00 175.52 174.73 3c18 h GLU 117 N 0.57 0.69 -0.62 0.00 5.08 -1.69 -2.22 114.58 116.39 3c18 h GLU 117 Ca 0.10 -0.53 -0.04 0.00 -1.00 0.00 0.00 59.36 57.89 3c18 h GLU 117 Cb 0.57 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 3c18 h GLU 117 CO 0.04 1.15 0.24 -0.09 -1.00 0.00 0.00 179.01 179.34 3c18 h ARG 118 N 0.49 0.94 -0.23 2.33 2.43 -0.76 -1.87 114.38 117.71 3c18 h ARG 118 Ca -0.03 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 58.84 3c18 h ARG 118 Cb 1.31 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 3c18 h ARG 118 CO 0.14 0.80 -0.40 0.00 -1.51 0.00 0.00 179.97 179.00 3c18 h LEU 120 N 0.44 0.77 -1.85 0.00 5.85 -1.24 -1.87 115.31 117.41 3c18 h LEU 120 Ca 0.04 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3c18 h LEU 120 Cb 0.89 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3c18 h LEU 120 CO 0.08 0.92 0.00 0.00 -0.34 0.00 0.00 178.44 179.10 3c18 n GLN 121 N -4.36 0.10 0.00 1.25 6.02 -0.72 -1.54 117.38 118.13 3c18 n GLN 121 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 3c18 n GLN 121 Cb 0.33 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.20 3c18 n GLN 121 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3c18 n SER 123 N 0.87 0.00 -0.09 1.08 7.64 -0.70 -1.27 113.62 121.15 3c18 n SER 123 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 3c18 n SER 123 Cb 0.05 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.36 3c18 n SER 123 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3c18 h LEU 124 N 0.00 0.76 -0.10 -3.43 3.38 -1.56 0.09 115.31 114.45 3c18 h LEU 124 Ca 0.00 -0.25 -0.22 0.00 0.09 0.00 0.00 57.88 57.50 3c18 h LEU 124 Cb 0.00 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.56 3c18 h LEU 124 CO 0.00 0.94 -0.79 0.28 0.09 0.00 0.00 178.44 178.96 3c18 h SER 125 N 0.68 0.86 -0.77 -0.43 0.02 -1.46 -2.82 113.55 109.64 3c18 h SER 125 Ca 0.10 -0.67 -0.04 0.00 -0.84 0.00 0.00 61.79 60.35 3c18 h SER 125 Cb 0.67 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 3c18 h SER 125 CO 0.05 1.40 0.32 0.15 -1.14 0.00 0.00 176.83 177.61 3c18 h PHE 126 N 0.40 1.16 -0.84 3.45 3.57 -1.79 -0.01 116.94 122.87 3c18 h PHE 126 Ca -0.07 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.38 3c18 h PHE 126 Cb 1.43 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 3c18 h PHE 126 CO 0.10 0.87 0.54 0.00 -2.23 0.00 0.00 178.31 177.59 3c18 h ALA 127 N 1.23 1.10 0.02 2.41 0.00 -0.88 -1.26 119.26 121.88 3c18 h ALA 127 Ca 0.26 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 54.90 3c18 h ALA 127 Cb 0.19 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.69 3c18 h ALA 127 CO -0.02 0.38 -1.00 0.87 0.00 0.00 0.00 179.25 179.48 3c18 h LYS 128 N 1.05 0.44 -0.83 0.00 1.79 -1.17 -2.07 116.57 115.78 3c18 h LYS 128 Ca 0.33 -0.50 0.03 0.00 -2.18 0.00 0.00 60.65 58.34 3c18 h LYS 128 Cb -0.01 0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 3c18 h LYS 128 CO -0.11 1.15 0.53 1.25 -1.08 0.00 0.00 179.45 181.20 3c18 h LEU 129 N 0.24 0.88 -0.40 2.94 5.85 -0.73 -0.65 115.31 123.44 3c18 h LEU 129 Ca -0.10 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 3c18 h LEU 129 Cb 1.64 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.47 3c18 h LEU 129 CO 0.18 0.60 -0.28 0.25 -0.34 0.00 0.00 178.44 178.85 3c18 h LEU 130 N 1.03 0.94 -0.28 2.25 5.85 -1.05 -0.28 115.31 123.76 3c18 h LEU 130 Ca 0.33 -0.43 -0.17 0.00 0.84 0.00 0.00 57.88 58.45 3c18 h LEU 130 Cb 0.02 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 3c18 h LEU 130 CO -0.12 1.17 -0.47 -0.09 -0.34 0.00 0.00 178.44 178.60 3c18 h ARG 131 N 0.72 0.82 -0.45 1.25 9.65 -1.19 -1.30 114.38 123.88 3c18 h ARG 131 Ca 0.08 -0.50 -0.11 0.00 -1.10 0.00 0.00 59.98 58.35 3c18 h ARG 131 Cb 0.86 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 3c18 h ARG 131 CO 0.08 1.13 -0.15 0.00 2.80 0.00 0.00 179.97 183.83 3c18 h ARG 132 N 0.59 0.86 -0.30 0.20 2.47 -0.98 -1.99 114.38 115.22 3c18 h ARG 132 Ca 0.02 -0.32 -0.02 0.00 -1.26 0.00 0.00 59.98 58.41 3c18 h ARG 132 Cb 1.07 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.32 3c18 h ARG 132 CO 0.11 0.95 0.12 0.35 0.56 0.00 0.00 179.97 182.06 3c18 h PHE 133 N 0.76 0.45 -0.62 3.04 3.57 -0.90 -0.15 116.94 123.08 3c18 h PHE 133 Ca 0.12 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 3c18 h PHE 133 Cb 0.67 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 3c18 h PHE 133 CO 0.04 0.43 0.21 1.96 -2.23 0.00 0.00 178.31 178.72 3c18 h GLN 134 N 0.33 0.93 -0.21 1.11 4.20 -1.09 -0.25 115.11 120.13 3c18 h GLN 134 Ca 0.10 -0.17 -0.17 0.00 0.06 0.00 0.00 58.65 58.47 3c18 h GLN 134 Cb 0.17 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3c18 h GLN 134 CO -0.01 0.79 -0.52 -0.44 -0.67 0.00 0.00 178.83 177.98 3c18 h ASP 135 N 0.91 0.83 -0.97 1.46 3.32 -1.16 -1.20 116.42 119.60 3c18 h ASP 135 Ca 0.21 -0.57 0.02 0.00 0.02 0.00 0.00 57.03 56.71 3c18 h ASP 135 Cb 0.24 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.50 3c18 h ASP 135 CO -0.01 1.24 0.64 1.23 -1.72 0.00 0.00 179.24 180.62 3c18 h GLY 136 N 0.45 1.39 0.96 2.75 0.00 -0.60 0.14 103.07 108.16 3c18 h GLY 136 Ca -0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 47.33 46.68 3c18 h GLY 136 CO 0.11 0.46 -0.44 -0.09 0.00 0.00 0.00 176.54 176.58 3c18 h ARG 137 N 1.28 0.64 -0.29 4.80 2.43 -0.88 -1.38 114.38 120.99 3c18 h ARG 137 Ca 0.37 -0.43 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3c18 h ARG 137 Cb -0.08 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3c18 h ARG 137 CO -0.10 1.05 0.12 -0.97 -1.51 0.00 0.00 179.97 178.56 3c18 h ASN 138 N 0.32 0.39 -0.39 -3.80 -0.73 -0.92 -0.84 115.58 109.61 3c18 h ASN 138 Ca -0.00 -0.15 -0.09 0.00 1.87 0.00 0.00 56.30 57.93 3c18 h ASN 138 Cb 1.05 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 39.52 3c18 h ASN 138 CO 0.10 0.43 -0.07 -0.07 -0.37 0.00 0.00 177.43 177.45 3c18 h LEU 139 N 0.32 0.81 -0.95 0.34 3.38 -0.69 -0.97 115.31 117.55 3c18 h LEU 139 Ca 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3c18 h LEU 139 Cb 0.16 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3c18 h LEU 139 CO -0.01 0.92 0.49 0.15 0.09 0.00 0.00 178.44 180.08 3c18 h PHE 140 N 0.75 1.20 0.00 1.13 3.04 -1.07 -0.75 116.94 121.25 3c18 h PHE 140 Ca 0.13 -0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.03 3c18 h PHE 140 Cb 0.56 -0.39 -0.00 0.00 2.56 0.00 0.00 35.95 38.68 3c18 h PHE 140 CO 0.03 0.83 -0.14 0.66 -2.02 0.00 0.00 178.31 177.66 3c18 h SER 141 N 1.23 0.00 -0.18 0.41 4.64 0.20 -2.09 113.55 117.76 3c18 h SER 141 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3c18 h SER 141 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3c18 h SER 141 CO -0.05 0.14 0.00 0.54 -0.87 0.00 0.00 176.83 176.59 3c18 n ARG 142 N -3.86 2.23 -1.00 4.77 1.74 -0.90 -4.93 116.66 114.71 3c18 n ARG 142 Ca -0.02 -1.82 -0.00 0.00 -0.77 0.00 0.00 57.85 55.24 3c18 n ARG 142 Cb 0.24 -1.47 -0.00 0.00 -1.02 0.00 0.00 32.46 30.21 3c18 n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c18 n GLY 143 N 1.36 0.48 3.35 -0.13 0.00 -0.79 -4.97 105.19 104.48 3c18 n GLY 143 Ca 0.17 -0.18 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 3c18 n GLY 143 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3c18 n ASN 144 N 0.30 5.28 0.02 1.61 5.03 -0.32 -4.86 115.26 122.33 3c18 n ASN 144 Ca -0.00 -3.02 -0.16 0.00 0.87 0.00 0.00 54.58 52.27 3c18 n ASN 144 Cb 0.01 -1.52 -0.05 0.00 -1.02 0.00 0.00 39.78 37.20 3c18 n ASN 144 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 3c18 h TYR 145 N 6.80 0.89 -0.31 3.10 0.05 -1.92 -1.49 116.97 124.09 3c18 h TYR 145 Ca 0.31 -0.43 -0.10 0.00 0.05 0.00 0.00 58.73 58.57 3c18 h TYR 145 Cb 0.83 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.43 3c18 h TYR 145 CO 1.07 1.24 -0.21 1.88 -1.05 0.00 0.00 178.16 181.10 3c18 h TYR 146 N 0.41 0.66 -0.02 4.88 0.05 -1.96 -1.04 116.97 119.95 3c18 h TYR 146 Ca -0.07 -0.13 -0.23 0.00 0.05 0.00 0.00 58.73 58.35 3c18 h TYR 146 Cb 1.48 -0.16 0.01 0.00 1.01 0.00 0.00 36.73 39.06 3c18 h TYR 146 CO 0.08 0.75 -0.93 -0.44 -1.05 0.00 0.00 178.16 176.57 3c18 h ASP 147 N 0.52 0.61 -0.57 3.88 3.32 -1.95 -2.90 116.42 119.33 3c18 h ASP 147 Ca 0.08 -0.48 -0.08 0.00 0.02 0.00 0.00 57.03 56.57 3c18 h ASP 147 Cb 0.65 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 3c18 h ASP 147 CO 0.05 1.27 0.04 0.00 -1.72 0.00 0.00 179.24 178.88 3c18 h ALA 148 N 0.70 0.77 -0.92 3.45 0.00 -1.04 -2.40 119.26 119.81 3c18 h ALA 148 Ca -0.08 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 54.64 3c18 h ALA 148 Cb 1.56 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 3c18 h ALA 148 CO 0.17 0.56 0.56 -0.92 0.00 0.00 0.00 179.25 179.62 3c18 h TYR 149 N 0.87 1.03 -0.35 0.00 5.03 -1.18 0.13 116.97 122.50 3c18 h TYR 149 Ca 0.17 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.53 3c18 h TYR 149 Cb 0.49 -0.33 -0.03 0.00 1.55 0.00 0.00 36.73 38.41 3c18 h TYR 149 CO 0.04 0.46 0.17 1.15 -1.32 0.00 0.00 178.16 178.66 3c18 h THR 150 N 0.95 0.99 -0.11 1.81 2.02 -1.23 -0.48 112.91 116.87 3c18 h THR 150 Ca 0.43 -0.12 -0.20 0.00 0.77 0.00 0.00 66.41 67.29 3c18 h THR 150 Cb 0.33 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 3c18 h THR 150 CO -0.23 0.07 -0.74 0.45 0.37 0.00 0.00 175.52 175.44 3c18 h HIS 151 N 0.36 0.73 -0.76 3.16 3.86 -1.11 -2.34 115.15 119.05 3c18 h HIS 151 Ca 0.14 -0.32 -0.05 0.00 -1.16 0.00 0.00 60.37 58.99 3c18 h HIS 151 Cb 0.05 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 3c18 h HIS 151 CO -0.10 1.10 0.30 0.28 0.86 0.00 0.00 177.93 180.37 3c18 h VAL 152 N 0.37 1.26 -0.38 2.45 2.07 -0.53 0.86 116.25 122.35 3c18 h VAL 152 Ca -0.04 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 66.62 3c18 h VAL 152 Cb 1.33 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 3c18 h VAL 152 CO 0.14 0.33 0.05 -0.74 0.02 0.00 0.00 177.57 177.37 3c18 h HIS 153 N 1.10 0.68 -0.64 1.57 6.17 -1.00 -0.86 115.15 122.18 3c18 h HIS 153 Ca 0.25 -0.10 -0.06 0.00 0.71 0.00 0.00 60.37 61.17 3c18 h HIS 153 Cb 0.22 -0.19 -0.03 0.00 2.52 0.00 0.00 27.41 29.94 3c18 h HIS 153 CO 0.02 0.69 0.15 1.25 0.71 0.00 0.00 177.93 180.75 3c18 h HIS 154 N 0.48 1.07 -0.92 5.26 2.76 -1.03 -1.73 115.15 121.04 3c18 h HIS 154 Ca 0.11 -0.13 0.01 0.00 -2.20 0.00 0.00 60.37 58.16 3c18 h HIS 154 Cb 0.38 -0.30 -0.05 0.00 1.55 0.00 0.00 27.41 29.00 3c18 h HIS 154 CO 0.03 0.90 0.61 0.00 -1.30 0.00 0.00 177.93 178.16 3c18 h ALA 155 N 1.05 1.16 -0.36 5.26 0.00 -0.45 -0.63 119.26 125.29 3c18 h ALA 155 Ca 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3c18 h ALA 155 Cb 0.37 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3c18 h ALA 155 CO 0.00 0.56 0.01 -0.07 0.00 0.00 0.00 179.25 179.76 3c18 h LEU 156 N 1.24 0.53 -0.36 0.00 3.38 -0.55 -1.18 115.31 118.36 3c18 h LEU 156 Ca 0.34 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 3c18 h LEU 156 Cb -0.14 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 3c18 h LEU 156 CO -0.07 0.59 -0.12 -0.74 0.09 0.00 0.00 178.44 178.18 3c18 h HIS 157 N 0.54 0.82 -0.21 1.13 2.76 -0.38 -1.74 115.15 118.07 3c18 h HIS 157 Ca 0.12 -0.19 -0.04 0.00 -2.20 0.00 0.00 60.37 58.05 3c18 h HIS 157 Cb 0.33 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 3c18 h HIS 157 CO 0.01 0.89 -0.07 0.45 -1.30 0.00 0.00 177.93 177.91 3c18 h HIS 158 N 0.51 0.34 -0.25 5.26 3.86 -0.70 -2.39 115.15 121.78 3c18 h HIS 158 Ca 0.09 -0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.14 3c18 h HIS 158 Cb 0.65 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 3c18 h HIS 158 CO 0.05 0.40 -0.37 1.25 0.86 0.00 0.00 177.93 180.12 3c18 h LEU 159 N 0.31 0.59 -0.44 2.43 5.85 -0.86 -0.86 115.31 122.33 3c18 h LEU 159 Ca 0.07 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 3c18 h LEU 159 Cb 0.33 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3c18 h LEU 159 CO 0.02 0.91 -0.11 0.00 -0.34 0.00 0.00 178.44 178.91 3c18 h ALA 160 N 1.13 0.61 -0.48 1.25 0.00 -1.02 -0.43 119.26 120.32 3c18 h ALA 160 Ca 0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 3c18 h ALA 160 Cb 0.86 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3c18 h ALA 160 CO 0.07 0.51 -0.04 0.00 0.00 0.00 0.00 179.25 179.79 3c18 h ARG 161 N 0.69 0.87 -0.57 0.00 3.08 -1.23 -2.00 114.38 115.22 3c18 h ARG 161 Ca 0.11 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 3c18 h ARG 161 Cb 0.65 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 3c18 h ARG 161 CO 0.04 0.93 0.24 1.25 -1.07 0.00 0.00 179.97 181.37 3c18 h LEU 162 N 0.72 0.78 -1.36 3.04 5.85 -1.10 -0.89 115.31 122.35 3c18 h LEU 162 Ca 0.13 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 3c18 h LEU 162 Cb 0.56 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 3c18 h LEU 162 CO 0.03 0.73 -0.09 0.77 -0.34 0.00 0.00 178.44 179.54 3c18 h SER 163 N 0.79 0.29 -0.06 1.25 4.64 -0.87 0.96 113.55 120.56 3c18 h SER 163 Ca 0.19 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 3c18 h SER 163 Cb 0.18 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3c18 h SER 163 CO -0.02 0.43 -0.08 0.58 -0.87 0.00 0.00 176.83 176.86 3c18 h VAL 164 N 0.30 1.40 -0.91 0.95 2.07 -0.89 -3.00 116.25 116.17 3c18 h VAL 164 Ca 0.06 -1.33 0.10 0.00 0.82 0.00 0.00 66.70 66.35 3c18 h VAL 164 Cb 0.35 2.15 -0.07 0.00 -1.52 0.00 0.00 31.29 32.21 3c18 h VAL 164 CO 0.02 0.37 0.59 -0.07 0.02 0.00 0.00 177.57 178.49 3c18 h LEU 165 N -0.32 0.84 -2.09 2.57 3.38 -0.65 -1.63 115.31 117.41 3c18 h LEU 165 Ca 0.01 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3c18 h LEU 165 Cb 0.63 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3c18 h LEU 165 CO 0.02 0.49 -0.01 -0.33 0.09 0.00 0.00 178.44 178.70 3c18 h GLU 166 N 0.92 0.00 -0.10 1.13 5.08 -0.68 0.17 114.58 121.10 3c18 h GLU 166 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 3c18 h GLU 166 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3c18 h GLU 166 CO -0.19 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.47 3c18 n LYS 167 N -4.36 2.03 -0.30 2.33 4.76 -0.63 -4.92 118.16 117.06 3c18 n LYS 167 Ca -0.03 -1.51 0.00 0.00 -2.87 0.00 0.00 58.31 53.90 3c18 n LYS 167 Cb 0.10 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 3c18 n LYS 167 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3c18 n GLY 168 N 1.28 0.83 3.65 0.72 0.00 0.59 -5.08 105.19 107.18 3c18 n GLY 168 Ca 0.17 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 3c18 n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c18 s ALA 169 N -2.00 3.15 0.05 4.61 0.00 -1.09 -4.98 121.76 121.51 3c18 s ALA 169 Ca 0.00 -1.37 -0.30 0.00 0.00 0.00 0.00 51.96 50.28 3c18 s ALA 169 Cb 0.00 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 3c18 s ALA 169 CO 0.00 0.49 1.11 -1.01 0.00 0.00 0.00 175.76 176.35 3c18 s HIS 170 N -1.70 3.54 0.40 0.00 3.76 -1.26 -3.44 115.29 116.59 3c18 s HIS 170 Ca 0.27 1.48 -0.26 0.00 -0.15 0.00 0.00 55.06 56.40 3c18 s HIS 170 Cb -0.09 -3.29 -0.09 0.00 1.11 0.00 0.00 32.58 30.22 3c18 s HIS 170 CO 0.18 -0.74 1.25 -2.14 -0.85 0.00 0.00 174.74 172.44 3c18 s PRO 171 N 0.89 4.01 0.25 8.40 0.02 -1.26 -4.97 135.00 142.33 3c18 s PRO 171 Ca 0.55 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.62 3c18 s PRO 171 Cb -0.26 -2.74 0.02 0.00 0.02 0.00 0.00 34.50 31.54 3c18 s PRO 171 CO 0.29 -0.41 0.12 0.39 -0.33 0.00 0.00 177.00 177.06 3c18 n GLU 172 N 0.13 1.22 0.16 5.54 1.02 -1.26 -5.03 120.64 122.42 3c18 n GLU 172 Ca 0.04 -1.63 0.01 0.00 -0.02 0.00 0.00 57.16 55.56 3c18 n GLU 172 Cb 0.45 0.27 0.32 0.00 -0.02 0.00 0.00 31.44 32.46 3c18 n GLU 172 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3c18 h VAL 173 N 0.76 1.28 -2.17 2.62 2.07 -2.04 -3.12 116.25 115.65 3c18 h VAL 173 Ca -0.17 -1.34 -0.79 0.00 0.82 0.00 0.00 66.70 65.22 3c18 h VAL 173 Cb 0.59 1.68 -0.27 0.00 -1.52 0.00 0.00 31.29 31.77 3c18 h VAL 173 CO 0.28 0.39 1.02 1.33 0.02 0.00 0.00 177.57 180.61 3c18 n VAL 174 N -4.08 5.33 -0.05 2.57 0.24 -1.26 -4.79 118.33 116.29 3c18 n VAL 174 Ca -0.02 -5.48 0.00 0.00 -2.04 0.00 0.00 64.34 56.81 3c18 n VAL 174 Cb 0.42 -1.46 0.29 0.00 -1.47 0.00 0.00 33.84 31.63 3c18 n VAL 174 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 3c18 h VAL 175 N 2.16 1.18 -0.07 3.34 3.04 -1.96 -2.48 116.25 121.46 3c18 h VAL 175 Ca 0.54 -0.61 -0.06 0.00 -1.01 0.00 0.00 66.70 65.56 3c18 h VAL 175 Cb 0.24 0.69 -0.01 0.00 -2.01 0.00 0.00 31.29 30.20 3c18 h VAL 175 CO 1.25 0.23 -0.23 -0.50 -1.01 0.00 0.00 177.57 177.32 3c18 h TRP 176 N 0.64 0.13 -0.05 3.17 4.06 -1.91 0.11 115.95 122.09 3c18 h TRP 176 Ca 0.15 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.07 3c18 h TRP 176 Cb 0.19 -0.04 -0.00 0.00 -1.00 0.00 0.00 29.16 28.31 3c18 h TRP 176 CO 0.01 0.35 -0.00 0.93 -3.56 0.00 0.00 178.44 176.16 3c18 h GLU 177 N 0.11 0.10 -1.01 0.49 4.39 -1.86 -1.59 114.58 115.22 3c18 h GLU 177 Ca 0.02 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.74 3c18 h GLU 177 Cb 0.47 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.05 3c18 h GLU 177 CO 0.03 0.38 0.66 1.96 -1.16 0.00 0.00 179.01 180.88 3c18 h GLN 178 N -0.20 1.21 0.00 2.33 4.20 -1.19 -2.69 115.11 118.77 3c18 h GLN 178 Ca 0.02 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3c18 h GLN 178 Cb 0.34 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.85 3c18 h GLN 178 CO 0.00 0.80 0.00 0.00 -0.67 0.00 0.00 178.83 178.96 3c18 h ALA 179 N 1.43 1.00 -0.21 3.87 0.00 -0.59 -2.40 119.26 122.36 3c18 h ALA 179 Ca 0.41 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.35 3c18 h ALA 179 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3c18 h ALA 179 CO -0.14 0.00 0.14 -0.09 0.00 0.00 0.00 179.25 179.16 3c18 h ARG 180 N 0.00 0.13 0.00 0.00 2.43 -0.93 -1.16 114.38 114.84 3c18 h ARG 180 Ca 0.00 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 3c18 h ARG 180 Cb 0.82 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.32 3c18 h ARG 180 CO 0.00 0.09 -1.52 1.28 -1.51 0.00 0.00 179.97 178.31 3c18 n LEU 181 N -4.50 1.07 0.24 3.80 4.77 -1.22 -4.13 117.00 117.04 3c18 n LEU 181 Ca 0.01 -0.02 0.11 0.00 -0.03 0.00 0.00 56.01 56.08 3c18 n LEU 181 Cb 0.19 -0.00 0.61 0.00 -2.33 0.00 0.00 43.42 41.89 3c18 n LEU 181 CO 0.35 0.35 0.90 0.44 -1.33 0.00 0.00 177.39 178.10 3c18 h ASP 182 N 0.00 0.00 -0.77 -1.43 5.19 -1.33 -3.38 116.42 114.70 3c18 h ASP 182 Ca -0.20 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.12 3c18 h ASP 182 Cb 1.41 0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.76 3c18 h ASP 182 CO -0.00 0.18 -0.38 -0.62 -3.12 0.00 0.00 179.24 175.30 3c18 s ASP 183 N -6.27 -1.12 0.54 6.45 -1.08 -0.45 -4.87 116.67 109.87 3c18 s ASP 183 Ca -0.02 -1.19 0.21 0.00 -0.52 0.00 0.00 52.55 51.02 3c18 s ASP 183 Cb 0.13 1.47 1.42 0.00 -1.46 0.00 0.00 42.92 44.47 3c18 s ASP 183 CO 0.62 -0.06 2.14 -0.65 0.52 0.00 0.00 175.17 177.74 3c18 h PRO 184 N 5.10 0.00 -0.47 4.34 0.11 -1.71 -1.42 132.00 137.95 3c18 h PRO 184 Ca 0.04 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.05 3c18 h PRO 184 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3c18 h PRO 184 CO -0.01 0.00 -0.09 -0.44 -0.21 0.00 0.00 178.00 177.25 3c18 h ASP 185 N 0.00 0.82 -0.17 -2.05 3.32 -1.92 0.40 116.42 116.82 3c18 h ASP 185 Ca 0.05 -0.24 -0.16 0.00 0.02 0.00 0.00 57.03 56.70 3c18 h ASP 185 Cb 0.20 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3c18 h ASP 185 CO -0.00 0.94 -0.50 0.58 -1.72 0.00 0.00 179.24 178.54 3c18 h VAL 186 N 0.76 1.33 -0.98 -1.35 2.07 -1.63 -2.56 116.25 113.89 3c18 h VAL 186 Ca 0.13 -1.75 0.01 0.00 0.82 0.00 0.00 66.70 65.91 3c18 h VAL 186 Cb 0.58 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 3c18 h VAL 186 CO 0.04 0.54 0.65 0.22 0.02 0.00 0.00 177.57 179.04 3c18 h TYR 187 N 0.31 1.23 -0.19 1.57 5.03 -1.25 -2.27 116.97 121.40 3c18 h TYR 187 Ca -0.01 0.03 -0.15 0.00 2.58 0.00 0.00 58.73 61.18 3c18 h TYR 187 Cb 1.12 -0.42 -0.01 0.00 1.55 0.00 0.00 36.73 38.98 3c18 h TYR 187 CO 0.10 0.77 -0.51 0.87 -1.32 0.00 0.00 178.16 178.07 3c18 h LYS 188 N 1.32 0.51 -0.61 1.82 1.79 -0.87 -1.63 116.57 118.91 3c18 h LYS 188 Ca 0.36 -0.30 -0.04 0.00 -2.18 0.00 0.00 60.65 58.49 3c18 h LYS 188 Cb -0.15 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.50 3c18 h LYS 188 CO -0.08 0.90 0.22 1.25 -1.08 0.00 0.00 179.45 180.66 3c18 h LEU 189 N 0.40 0.83 -0.26 2.94 5.85 -1.01 -1.40 115.31 122.66 3c18 h LEU 189 Ca 0.02 -0.12 -0.20 0.00 0.84 0.00 0.00 57.88 58.42 3c18 h LEU 189 Cb 1.03 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.85 3c18 h LEU 189 CO 0.09 0.76 -0.64 0.22 -0.34 0.00 0.00 178.44 178.53 3c18 h TYR 190 N 0.88 1.06 -0.55 1.25 3.20 -1.05 -2.87 116.97 118.89 3c18 h TYR 190 Ca 0.20 -0.41 -0.05 0.00 3.14 0.00 0.00 58.73 61.61 3c18 h TYR 190 Cb 0.21 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 3c18 h TYR 190 CO 0.01 1.24 0.15 1.49 -1.64 0.00 0.00 178.16 179.41 3c18 h GLU 191 N 0.60 0.88 -0.84 1.82 4.81 -1.09 -0.72 114.58 120.04 3c18 h GLU 191 Ca -0.01 -0.20 0.04 0.00 -0.13 0.00 0.00 59.36 59.05 3c18 h GLU 191 Cb 1.25 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.47 3c18 h GLU 191 CO 0.14 0.82 0.55 1.96 -0.73 0.00 0.00 179.01 181.74 3c18 h GLN 192 N 0.78 1.00 -0.20 1.92 4.20 -1.24 0.10 115.11 121.68 3c18 h GLN 192 Ca 0.18 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 3c18 h GLN 192 Cb 0.32 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.88 3c18 h GLN 192 CO -0.00 0.66 -0.45 1.25 -0.67 0.00 0.00 178.83 179.62 3c18 h LEU 193 N 1.03 0.74 -0.03 1.46 5.85 -1.09 -2.64 115.31 120.62 3c18 h LEU 193 Ca 0.34 -0.56 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 3c18 h LEU 193 Cb 0.05 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.86 3c18 h LEU 193 CO -0.10 1.17 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.97 3c18 h LEU 194 N 0.34 0.17 -2.34 2.25 3.38 -0.68 -3.22 115.31 115.22 3c18 h LEU 194 Ca -0.00 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.33 3c18 h LEU 194 Cb 1.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3c18 h LEU 194 CO 0.10 0.78 0.00 0.18 0.09 0.00 0.00 178.44 179.59 3c18 n LEU 195 N -4.64 3.54 -4.76 1.67 4.77 0.31 -4.93 117.00 112.96 3c18 n LEU 195 Ca -0.09 -1.79 -0.38 0.00 -0.03 0.00 0.00 56.01 53.73 3c18 n LEU 195 Cb 0.39 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3c18 n LEU 195 CO 0.37 0.56 0.90 -0.55 -1.33 0.00 0.00 177.39 177.33 3c18 s SER 196 N -0.70 5.98 -0.00 -1.43 0.15 -0.99 -4.92 113.70 111.78 3c18 s SER 196 Ca 0.35 2.50 0.05 0.00 0.70 0.00 0.00 55.95 59.54 3c18 s SER 196 Cb 0.23 -2.62 0.13 0.00 -1.71 0.00 0.00 66.02 62.05 3c18 s SER 196 CO 0.15 -1.06 1.11 -0.62 1.20 0.00 0.00 173.24 174.01 3c18 n GLU 197 N -0.48 2.94 -1.70 5.44 1.02 -1.26 -5.03 120.64 121.58 3c18 n GLU 197 Ca 0.07 -1.74 -0.30 0.00 -0.02 0.00 0.00 57.16 55.18 3c18 n GLU 197 Cb 0.46 -1.12 0.19 0.00 -0.02 0.00 0.00 31.44 30.95 3c18 n GLU 197 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3c18 s GLU 198 N -1.01 0.36 0.87 3.49 0.41 -1.26 -5.04 118.70 116.52 3c18 s GLU 198 Ca 0.10 -0.22 -0.11 0.00 -0.41 0.00 0.00 54.97 54.32 3c18 s GLU 198 Cb 0.05 -1.80 0.11 0.00 -1.78 0.00 0.00 34.13 30.72 3c18 s GLU 198 CO 0.07 -2.63 1.09 0.95 -0.49 0.00 0.00 175.26 174.25 3c18 s THR 199 N -3.61 2.82 0.17 3.63 -4.23 -1.26 -4.77 115.64 108.40 3c18 s THR 199 Ca 0.71 0.27 -0.15 0.00 -1.18 0.00 0.00 61.69 61.34 3c18 s THR 199 Cb -0.07 -2.75 0.06 0.00 1.34 0.00 0.00 72.50 71.08 3c18 s THR 199 CO 0.53 -0.35 1.74 0.25 -0.54 0.00 0.00 174.62 176.25 3c18 h LEU 200 N -1.44 0.08 -0.23 4.79 5.85 -1.99 -0.58 115.31 121.79 3c18 h LEU 200 Ca -0.48 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 3c18 h LEU 200 Cb 1.27 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.36 3c18 h LEU 200 CO 0.54 0.08 0.13 -0.33 -0.34 0.00 0.00 178.44 178.52 3c18 h GLU 201 N 0.26 0.31 -0.45 1.25 3.07 -1.96 -1.86 114.58 115.20 3c18 h GLU 201 Ca 0.20 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.98 3c18 h GLU 201 Cb 0.22 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 3c18 h GLU 201 CO -0.24 0.26 0.07 0.37 -1.40 0.00 0.00 179.01 178.08 3c18 h GLN 202 N 0.27 0.74 -0.43 2.33 5.75 -1.84 -1.01 115.11 120.92 3c18 h GLN 202 Ca 0.08 -0.20 -0.09 0.00 -0.15 0.00 0.00 58.65 58.29 3c18 h GLN 202 Cb 0.04 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 3c18 h GLN 202 CO -0.01 0.77 -0.10 0.07 -2.65 0.00 0.00 178.83 176.90 3c18 h ARG 203 N 0.61 0.76 -0.52 1.69 0.11 -0.89 0.26 114.38 116.39 3c18 h ARG 203 Ca 0.14 -0.24 -0.10 0.00 0.10 0.00 0.00 59.98 59.88 3c18 h ARG 203 Cb 0.38 -0.07 -0.02 0.00 1.11 0.00 0.00 29.97 31.38 3c18 h ARG 203 CO 0.01 0.83 -0.05 0.82 0.10 0.00 0.00 179.97 181.68 3c18 h ILE 204 N 0.69 1.27 -0.46 0.08 2.04 -1.19 -1.44 117.51 118.50 3c18 h ILE 204 Ca 0.12 -1.17 -0.06 0.00 1.00 0.00 0.00 64.86 64.75 3c18 h ILE 204 Cb 0.57 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3c18 h ILE 204 CO 0.03 0.41 0.06 -0.74 0.00 0.00 0.00 178.15 177.92 3c18 h HIS 205 N 0.82 0.83 -0.56 1.37 2.76 -0.55 -0.45 115.15 119.37 3c18 h HIS 205 Ca 0.14 -0.12 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 3c18 h HIS 205 Cb 0.60 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 3c18 h HIS 205 CO 0.04 0.78 0.10 -0.07 -1.30 0.00 0.00 177.93 177.48 3c18 h LEU 206 N 0.64 0.85 -0.84 0.26 3.38 -0.87 -1.64 115.31 117.09 3c18 h LEU 206 Ca 0.14 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 3c18 h LEU 206 Cb 0.41 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3c18 h LEU 206 CO 0.01 0.85 -0.28 0.00 0.09 0.00 0.00 178.44 179.11 3c18 h ALA 207 N 1.25 1.01 -0.32 1.53 0.00 -0.99 -1.95 119.26 119.80 3c18 h ALA 207 Ca 0.18 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 3c18 h ALA 207 Cb 0.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3c18 h ALA 207 CO 0.01 0.59 -0.36 -0.07 0.00 0.00 0.00 179.25 179.42 3c18 h LEU 208 N 0.48 0.77 0.14 0.00 3.38 -0.67 -0.22 115.31 119.18 3c18 h LEU 208 Ca 0.06 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3c18 h LEU 208 Cb 0.73 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3c18 h LEU 208 CO 0.06 1.05 -0.10 0.40 0.09 0.00 0.00 178.44 179.94 3c18 h ILE 209 N 0.61 0.77 -0.66 1.22 1.08 -0.99 -0.56 117.51 118.98 3c18 h ILE 209 Ca 0.06 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.51 3c18 h ILE 209 Cb 0.90 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 3c18 h ILE 209 CO 0.08 0.00 0.34 1.23 -0.69 0.00 0.00 178.15 179.11 3c18 h GLY 210 N -0.25 1.00 1.07 5.37 0.00 -1.24 -2.07 103.07 106.95 3c18 h GLY 210 Ca -0.01 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 3c18 h GLY 210 CO -0.00 0.45 0.56 1.41 0.00 0.00 0.00 176.54 178.96 3c18 h LEU 211 N 0.91 1.09 -0.69 3.11 3.38 -0.84 -1.72 115.31 120.55 3c18 h LEU 211 Ca 0.23 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 3c18 h LEU 211 Cb 0.07 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3c18 h LEU 211 CO -0.03 0.83 -0.50 -0.08 0.09 0.00 0.00 178.44 178.75 3c18 h GLU 212 N 1.26 0.39 0.19 1.13 4.81 -0.43 -1.02 114.58 120.92 3c18 h GLU 212 Ca 0.33 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 3c18 h GLU 212 Cb -0.07 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3c18 h GLU 212 CO -0.06 0.80 -0.09 1.25 -0.73 0.00 0.00 179.01 180.18 3c18 h HIS 213 N 0.31 -0.24 0.00 0.92 2.76 -1.17 -2.75 115.15 114.97 3c18 h HIS 213 Ca 0.01 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 3c18 h HIS 213 Cb 0.99 0.08 -0.00 0.00 1.55 0.00 0.00 27.41 30.02 3c18 h HIS 213 CO 0.03 0.08 -0.12 -0.07 -1.30 0.00 0.00 177.93 176.55 3c18 h LEU 214 N -0.58 0.00 0.09 0.26 3.38 -1.22 -1.75 115.31 115.49 3c18 h LEU 214 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3c18 h LEU 214 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3c18 h LEU 214 CO 0.04 0.12 -0.04 0.25 0.09 0.00 0.00 178.44 178.90 3c18 h LEU 215 N 0.00 -0.11 -1.13 1.67 5.85 -1.14 -1.96 115.31 118.49 3c18 h LEU 215 Ca -0.00 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 58.36 3c18 h LEU 215 Cb 0.38 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 3c18 h LEU 215 CO 0.02 0.41 0.60 -0.61 -0.34 0.00 0.00 178.44 178.51 3c18 h GLN 216 N -0.66 1.02 -0.01 1.25 5.75 -1.27 -2.64 115.11 118.54 3c18 h GLN 216 Ca -0.01 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.37 3c18 h GLN 216 Cb 0.53 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.84 3c18 h GLN 216 CO 0.02 0.67 -0.27 1.03 -2.65 0.00 0.00 178.83 177.64 3c18 h SER 217 N 1.05 0.02 -0.34 -0.69 0.87 -1.10 -2.93 113.55 110.43 3c18 h SER 217 Ca 0.39 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.95 3c18 h SER 217 Cb 0.19 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3c18 h SER 217 CO -0.15 0.30 0.00 0.29 -0.53 0.00 0.00 176.83 176.74 3c18 n LYS 218 N -4.21 3.18 -0.33 2.24 5.02 -0.76 -4.66 118.16 118.65 3c18 n LYS 218 Ca -0.02 -2.73 0.00 0.00 -2.02 0.00 0.00 58.31 53.55 3c18 n LYS 218 Cb 0.33 -1.78 0.17 0.00 -0.02 0.00 0.00 35.03 33.73 3c18 n LYS 218 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 3c18 h VAL 219 N 2.24 1.18 0.00 -0.18 3.04 -1.28 -1.23 116.25 120.03 3c18 h VAL 219 Ca 0.00 -0.41 -0.08 0.00 -1.01 0.00 0.00 66.70 65.20 3c18 h VAL 219 Cb 1.36 -0.12 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 3c18 h VAL 219 CO 0.21 0.22 -0.39 -0.07 -1.01 0.00 0.00 177.57 176.53 3c18 h LEU 220 N 1.20 0.00 -0.52 3.16 3.38 -1.84 -1.16 115.31 119.53 3c18 h LEU 220 Ca 0.36 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.18 3c18 h LEU 220 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3c18 h LEU 220 CO -0.10 0.39 -0.52 0.28 0.09 0.00 0.00 178.44 178.58 3c18 h SER 221 N 0.00 0.66 0.28 -0.43 0.02 -1.59 -1.72 113.55 110.77 3c18 h SER 221 Ca -0.00 -0.34 -0.21 0.00 -0.84 0.00 0.00 61.79 60.40 3c18 h SER 221 Cb 0.96 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.31 3c18 h SER 221 CO 0.05 1.06 -0.83 1.23 -1.14 0.00 0.00 176.83 177.19 3c18 h GLY 222 N 1.02 0.46 0.34 -3.77 0.00 -1.08 -3.34 103.07 96.70 3c18 h GLY 222 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.62 3c18 h GLY 222 CO 0.10 0.65 -1.23 0.61 0.00 0.00 0.00 176.54 176.67 3c18 n GLY 223 N 0.75 -1.12 0.24 4.60 0.00 -0.47 -4.12 105.19 105.08 3c18 n GLY 223 Ca -0.05 -0.47 0.02 0.00 0.00 0.00 0.00 46.02 45.51 3c18 n GLY 223 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3c18 h LYS 224 N 0.00 0.22 -0.50 1.61 3.64 -1.43 0.13 116.57 120.23 3c18 h LYS 224 Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3c18 h LYS 224 Cb 0.74 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 3c18 h LYS 224 CO 0.00 0.14 0.22 -0.92 -2.27 0.00 0.00 179.45 176.62 3c18 h TYR 225 N 0.22 0.74 -0.07 1.91 3.20 -1.79 -1.42 116.97 119.76 3c18 h TYR 225 Ca 0.34 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 3c18 h TYR 225 Cb 0.55 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 3c18 h TYR 225 CO -0.28 0.61 0.02 1.25 -1.64 0.00 0.00 178.16 178.12 3c18 h LEU 226 N 0.67 0.10 -1.12 2.82 5.85 -1.57 -2.41 115.31 119.65 3c18 h LEU 226 Ca 0.17 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 3c18 h LEU 226 Cb 0.16 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3c18 h LEU 226 CO -0.02 0.27 0.34 -0.26 -0.34 0.00 0.00 178.44 178.43 3c18 h PHE 227 N -0.07 0.94 -0.43 1.25 0.04 -0.61 -1.64 116.94 116.42 3c18 h PHE 227 Ca 0.02 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.67 3c18 h PHE 227 Cb 0.21 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 3c18 h PHE 227 CO -0.01 0.68 -0.10 1.49 -0.60 0.00 0.00 178.31 179.78 3c18 h GLU 228 N 0.96 0.82 -1.40 1.51 4.57 -1.18 -0.52 114.58 119.33 3c18 h GLU 228 Ca 0.24 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3c18 h GLU 228 Cb 0.08 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 3c18 h GLU 228 CO -0.03 0.94 0.00 0.28 -1.18 0.00 0.00 179.01 179.02 3c18 n VAL 229 N -4.30 0.17 0.00 0.32 0.31 -0.62 -3.24 118.33 110.97 3c18 n VAL 229 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3c18 n VAL 229 Cb 0.37 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 3c18 n VAL 229 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3c18 n ARG 231 N 0.77 0.00 0.00 5.55 1.74 -0.21 -4.44 116.66 120.08 3c18 n ARG 231 Ca 0.00 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.16 3c18 n ARG 231 Cb 0.10 -0.00 0.40 0.00 -1.02 0.00 0.00 32.46 31.93 3c18 n ARG 231 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3c18 n GLU 232 N 0.00 0.22 -4.08 5.56 1.02 -1.20 -4.62 120.64 117.55 3c18 n GLU 232 Ca 0.00 0.14 -0.13 0.00 -0.02 0.00 0.00 57.16 57.15 3c18 n GLU 232 Cb 0.00 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.81 3c18 n GLU 232 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3c18 s ARG 233 N -2.58 0.57 -0.21 3.49 1.70 -1.26 -5.05 118.95 115.60 3c18 s ARG 233 Ca 0.15 -0.84 0.11 0.00 -0.47 0.00 0.00 55.73 54.68 3c18 s ARG 233 Cb 0.11 -0.27 0.67 0.00 -0.57 0.00 0.00 34.95 34.89 3c18 s ARG 233 CO 0.24 0.04 1.55 -3.47 -1.08 0.00 0.00 175.30 172.58 3c18 n ASP 234 N 1.24 4.84 -4.05 -2.89 2.03 -1.26 -4.91 116.55 111.55 3c18 n ASP 234 Ca -0.21 -2.82 -0.10 0.00 0.52 0.00 0.00 54.79 52.18 3c18 n ASP 234 Cb 0.56 -0.67 -0.07 0.00 -0.72 0.00 0.00 41.12 40.22 3c18 n ASP 234 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3c18 s ARG 235 N -2.48 1.38 0.87 -0.67 1.70 -1.26 -5.15 118.95 113.33 3c18 s ARG 235 Ca 0.45 -1.35 -0.11 0.00 -0.47 0.00 0.00 55.73 54.25 3c18 s ARG 235 Cb 0.35 0.39 0.11 0.00 -0.57 0.00 0.00 34.95 35.24 3c18 s ARG 235 CO 0.13 -0.53 1.09 -2.14 -1.08 0.00 0.00 175.30 172.77 3c18 s PRO 236 N -4.05 1.51 -0.01 3.89 0.02 -1.26 -4.94 135.00 130.16 3c18 s PRO 236 Ca 0.26 0.84 0.03 0.00 0.02 0.00 0.00 61.00 62.16 3c18 s PRO 236 Cb 0.02 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.67 3c18 s PRO 236 CO 0.08 -2.08 -0.08 -1.58 -0.33 0.00 0.00 177.00 173.02 3c18 s TRP 237 N -2.96 2.86 0.00 6.54 0.52 0.47 -4.83 118.94 121.53 3c18 s TRP 237 Ca 0.63 -0.06 0.00 0.00 0.02 0.00 0.00 56.10 56.69 3c18 s TRP 237 Cb -0.17 -1.61 0.00 0.00 -1.15 0.00 0.00 33.47 30.53 3c18 s TRP 237 CO 0.56 0.34 0.00 0.25 0.02 0.00 0.00 176.95 178.13 3c18 n THR 238 N 1.71 0.00 0.00 2.01 -2.24 -1.26 -0.24 114.28 114.26 3c18 n THR 238 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3c18 n THR 238 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3c18 n THR 238 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3c18 n HIS 240 N 0.00 0.00 -0.25 4.78 -0.00 -1.26 -2.02 115.22 116.47 3c18 n HIS 240 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 3c18 n HIS 240 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 29.99 30.03 3c18 n HIS 240 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 3c18 h GLU 241 N 0.00 1.09 -1.33 1.57 5.08 -1.99 -1.29 114.58 117.72 3c18 h GLU 241 Ca 0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 3c18 h GLU 241 Cb 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3c18 h GLU 241 CO 0.00 0.96 0.00 1.28 -1.00 0.00 0.00 179.01 180.25 3c18 n LEU 242 N -4.28 0.66 0.00 1.33 4.77 -0.86 -2.13 117.00 116.49 3c18 n LEU 242 Ca 0.05 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 3c18 n LEU 242 Cb 0.24 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3c18 n LEU 242 CO 0.42 0.12 0.00 -0.62 -1.33 0.00 0.00 177.39 175.97 3c18 n GLU 244 N 0.73 0.00 -2.29 3.23 -0.58 -0.49 -4.80 120.64 116.45 3c18 n GLU 244 Ca 0.00 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.32 3c18 n GLU 244 Cb 0.12 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.96 3c18 n GLU 244 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 3c18 s GLU 245 N 0.00 4.30 0.32 3.49 2.56 -0.91 -4.91 118.70 123.56 3c18 s GLU 245 Ca 0.00 1.88 0.01 0.00 0.00 0.00 0.00 54.97 56.87 3c18 s GLU 245 Cb 0.00 -3.57 0.55 0.00 2.00 0.00 0.00 34.13 33.11 3c18 s GLU 245 CO 0.00 -0.54 1.91 0.66 -0.56 0.00 0.00 175.26 176.73 3c18 h SER 246 N 7.73 0.69 0.40 -1.70 4.64 -1.92 -1.84 113.55 121.55 3c18 h SER 246 Ca -0.37 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3c18 h SER 246 Cb 1.17 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 3c18 h SER 246 CO 0.90 0.62 0.00 0.54 -0.87 0.00 0.00 176.83 178.01 3c18 n ARG 247 N -4.34 0.03 -0.20 4.77 1.74 -1.26 -1.61 116.66 115.79 3c18 n ARG 247 Ca 0.04 0.34 0.07 0.00 -0.77 0.00 0.00 57.85 57.53 3c18 n ARG 247 Cb 0.15 -1.56 0.18 0.00 -1.02 0.00 0.00 32.46 30.21 3c18 n ARG 247 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3c18 n LEU 248 N -1.62 3.07 -0.26 0.55 4.77 -0.69 -4.70 117.00 118.13 3c18 n LEU 248 Ca 0.02 -1.95 0.02 0.00 -0.03 0.00 0.00 56.01 54.08 3c18 n LEU 248 Cb 0.13 -0.27 0.15 0.00 -2.33 0.00 0.00 43.42 41.11 3c18 n LEU 248 CO 0.11 0.76 1.08 0.00 -1.33 0.00 0.00 177.39 178.01 3c18 h THR 249 N 2.46 0.84 0.00 -5.08 1.03 -1.33 0.83 112.91 111.65 3c18 h THR 249 Ca 0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 66.41 66.19 3c18 h THR 249 Cb 0.77 0.16 0.00 0.00 -1.07 0.00 0.00 68.15 68.01 3c18 h THR 249 CO 0.00 0.11 0.00 -0.62 -0.01 0.00 0.00 175.52 175.00 3c18 n GLU 250 N -4.85 0.15 0.00 0.00 -0.58 -1.26 -2.54 120.64 111.56 3c18 n GLU 250 Ca 0.12 0.35 0.10 0.00 -0.42 0.00 0.00 57.16 57.31 3c18 n GLU 250 Cb 0.29 -1.77 0.08 0.00 -0.57 0.00 0.00 31.44 29.47 3c18 n GLU 250 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3c18 n LEU 251 N -2.06 2.61 -0.31 -4.62 4.77 0.25 -4.57 117.00 113.07 3c18 n LEU 251 Ca 0.03 -0.99 0.10 0.00 -0.03 0.00 0.00 56.01 55.13 3c18 n LEU 251 Cb 0.24 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.60 3c18 n LEU 251 CO 0.20 0.45 1.09 0.11 -1.33 0.00 0.00 177.39 177.91 3c18 h LYS 252 N 3.80 0.53 0.00 3.23 1.57 -1.16 -0.42 116.57 124.12 3c18 h LYS 252 Ca 0.00 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3c18 h LYS 252 Cb 0.82 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 3c18 h LYS 252 CO 0.00 0.35 -0.15 0.28 -0.57 0.00 0.00 179.45 179.36 3c18 h VAL 253 N 0.55 0.62 -0.02 0.50 2.07 -1.84 -3.04 116.25 115.09 3c18 h VAL 253 Ca 0.52 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3c18 h VAL 253 Cb 0.86 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 3c18 h VAL 253 CO -0.43 0.15 0.00 0.47 0.02 0.00 0.00 177.57 177.78 3c18 n ASP 254 N -3.65 1.40 -0.21 0.57 8.00 -0.31 -4.75 116.55 117.60 3c18 n ASP 254 Ca -0.02 -1.31 -0.06 0.00 0.71 0.00 0.00 54.79 54.11 3c18 n ASP 254 Cb 0.27 -0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.40 3c18 n ASP 254 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3c18 h LEU 255 N 0.34 0.70 -0.36 0.64 5.85 -1.05 -0.62 115.31 120.81 3c18 h LEU 255 Ca 0.00 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.70 3c18 h LEU 255 Cb 0.19 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 3c18 h LEU 255 CO 0.00 0.55 0.14 1.23 -0.34 0.00 0.00 178.44 180.02 3c18 h GLY 256 N 0.79 0.46 1.60 3.75 0.00 -1.85 0.15 103.07 107.97 3c18 h GLY 256 Ca 0.21 -0.08 -0.15 0.00 0.00 0.00 0.00 47.33 47.31 3c18 h GLY 256 CO -0.04 0.04 -0.53 1.76 0.00 0.00 0.00 176.54 177.78 3c18 h SER 257 N 0.29 0.47 -0.22 0.19 0.02 -1.79 -1.80 113.55 110.71 3c18 h SER 257 Ca 0.16 -0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 3c18 h SER 257 Cb 0.12 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 3c18 h SER 257 CO -0.15 0.91 0.02 -0.07 -1.14 0.00 0.00 176.83 176.39 3c18 h LEU 258 N 0.33 0.37 -0.67 5.07 3.38 -0.84 -1.92 115.31 121.02 3c18 h LEU 258 Ca 0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3c18 h LEU 258 Cb 1.04 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 3c18 h LEU 258 CO 0.09 0.56 0.28 0.58 0.09 0.00 0.00 178.44 180.04 3c18 h VAL 259 N 0.16 1.24 -0.78 1.22 2.07 -0.88 0.33 116.25 119.61 3c18 h VAL 259 Ca 0.07 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.87 3c18 h VAL 259 Cb 0.36 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3c18 h VAL 259 CO 0.01 0.30 0.50 -0.78 0.02 0.00 0.00 177.57 177.62 3c18 h ASP 260 N 0.95 0.84 -0.05 0.57 3.58 -1.29 -1.04 116.42 119.99 3c18 h ASP 260 Ca 0.23 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 3c18 h ASP 260 Cb 0.20 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 3c18 h ASP 260 CO -0.02 0.59 -0.00 0.15 -2.88 0.00 0.00 179.24 177.08 3c18 h PHE 261 N 1.00 0.10 0.00 0.28 3.57 -0.73 -2.52 116.94 118.63 3c18 h PHE 261 Ca 0.30 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 3c18 h PHE 261 Cb -0.03 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 3c18 h PHE 261 CO -0.03 0.39 -0.15 0.74 -2.23 0.00 0.00 178.31 177.04 3c18 h PHE 262 N -0.22 0.00 -0.35 0.41 0.04 -0.62 -1.32 116.94 114.88 3c18 h PHE 262 Ca 0.01 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.67 3c18 h PHE 262 Cb 0.35 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 3c18 h PHE 262 CO 0.04 0.15 -0.23 0.82 -0.60 0.00 0.00 178.31 178.48 3c18 h ILE 263 N 0.00 1.29 0.00 -0.55 2.04 -1.04 0.92 117.51 120.17 3c18 h ILE 263 Ca -0.00 -1.38 -0.01 0.00 1.00 0.00 0.00 64.86 64.47 3c18 h ILE 263 Cb 0.30 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.79 3c18 h ILE 263 CO 0.02 0.45 -0.04 0.03 0.00 0.00 0.00 178.15 178.61 3c18 h ARG 264 N 0.55 0.00 -0.08 2.37 3.08 -0.83 -2.20 114.38 117.27 3c18 h ARG 264 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3c18 h ARG 264 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.84 3c18 h ARG 264 CO 0.06 0.04 0.00 1.63 -1.07 0.00 0.00 179.97 180.64 3c18 n LYS 265 N -3.15 2.15 -0.93 0.04 4.76 -0.76 -4.94 118.16 115.32 3c18 n LYS 265 Ca 0.01 -1.68 0.00 0.00 -2.87 0.00 0.00 58.31 53.77 3c18 n LYS 265 Cb 0.35 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 3c18 n LYS 265 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3c18 n GLY 266 N 1.31 0.48 0.02 0.72 0.00 -0.82 -4.92 105.19 101.98 3c18 n GLY 266 Ca 0.16 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.80 3c18 n GLY 266 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c18 n LEU 267 N 0.00 0.56 -4.06 0.99 4.77 0.26 -4.76 117.00 114.76 3c18 n LEU 267 Ca 0.00 -0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.67 3c18 n LEU 267 Cb 0.00 -0.06 -0.15 0.00 -2.33 0.00 0.00 43.42 40.88 3c18 n LEU 267 CO 0.00 0.07 -0.46 -0.63 -1.33 0.00 0.00 177.39 175.04 3c18 s ILE 268 N -3.23 0.95 -0.22 -0.08 1.01 -1.07 -1.01 121.20 117.55 3c18 s ILE 268 Ca 0.02 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.09 3c18 s ILE 268 Cb 0.14 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 3c18 s ILE 268 CO 0.84 0.28 0.08 -0.60 0.00 0.00 0.00 174.94 175.53 3c18 s ARG 269 N -0.15 3.84 -0.16 2.79 3.52 0.77 -4.26 118.95 125.31 3c18 s ARG 269 Ca 0.02 -0.40 -0.12 0.00 -0.13 0.00 0.00 55.73 55.10 3c18 s ARG 269 Cb -0.06 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 3c18 s ARG 269 CO -0.00 0.03 0.25 -1.50 -0.81 0.00 0.00 175.30 173.26 3c18 s ILE 270 N 1.06 5.33 0.33 4.11 2.07 -1.26 -2.07 121.20 130.77 3c18 s ILE 270 Ca 0.05 0.45 0.03 0.00 -1.41 0.00 0.00 60.65 59.77 3c18 s ILE 270 Cb -0.14 -3.58 -0.02 0.00 0.13 0.00 0.00 42.46 38.85 3c18 s ILE 270 CO 0.03 0.43 0.35 -0.94 -1.91 0.00 0.00 174.94 172.91 3c18 s SER 271 N 0.20 1.28 -0.03 4.50 1.04 -0.38 -5.00 113.70 115.31 3c18 s SER 271 Ca 0.15 -1.63 0.01 0.00 0.48 0.00 0.00 55.95 54.96 3c18 s SER 271 Cb -0.13 0.59 0.03 0.00 0.10 0.00 0.00 66.02 66.61 3c18 s SER 271 CO 0.03 -1.15 -0.01 -0.31 0.98 0.00 0.00 173.24 172.78 3c18 s TYR 272 N -3.32 0.43 -0.21 5.02 2.02 -1.26 -0.79 117.35 119.24 3c18 s TYR 272 Ca 0.36 -0.06 0.01 0.00 -0.37 0.00 0.00 57.07 57.02 3c18 s TYR 272 Cb 0.01 -0.48 0.04 0.00 -0.40 0.00 0.00 41.96 41.13 3c18 s TYR 272 CO 0.24 -0.15 -0.13 -0.65 -1.57 0.00 0.00 175.55 173.29 3c18 s GLN 273 N 1.01 2.28 -0.01 -0.62 -0.21 -0.32 -4.95 119.66 116.84 3c18 s GLN 273 Ca -0.10 -0.95 -0.25 0.00 0.02 0.00 0.00 55.36 54.08 3c18 s GLN 273 Cb -0.14 -2.55 -0.04 0.00 1.00 0.00 0.00 33.01 31.28 3c18 s GLN 273 CO -0.01 -0.41 0.76 0.50 -2.12 0.00 0.00 175.29 174.01 3c18 s ARG 274 N 1.31 4.47 0.08 2.91 3.52 -1.26 -1.39 118.95 128.60 3c18 s ARG 274 Ca -0.02 1.02 -0.31 0.00 -0.13 0.00 0.00 55.73 56.30 3c18 s ARG 274 Cb -0.16 -3.41 -0.07 0.00 -1.56 0.00 0.00 34.95 29.74 3c18 s ARG 274 CO -0.08 0.14 1.40 0.99 -0.81 0.00 0.00 175.30 176.94 3c18 s THR 275 N 0.46 3.41 0.22 4.11 2.01 -0.45 -4.91 115.64 120.48 3c18 s THR 275 Ca 0.40 0.97 -0.32 0.00 0.31 0.00 0.00 61.69 63.04 3c18 s THR 275 Cb -0.19 -3.62 -0.13 0.00 0.01 0.00 0.00 72.50 68.57 3c18 s THR 275 CO 0.21 0.05 1.56 0.29 -0.69 0.00 0.00 174.62 176.05 3c18 n LYS 276 N 4.36 2.35 -0.39 4.92 5.02 -1.26 -1.33 118.16 131.84 3c18 n LYS 276 Ca 0.12 0.84 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 3c18 n LYS 276 Cb 0.43 -2.60 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 3c18 n LYS 276 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3c18 n GLY 277 N 2.93 1.41 3.39 0.72 0.00 -1.26 -5.00 105.19 107.37 3c18 n GLY 277 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 3c18 n GLY 277 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c18 s LEU 278 N 0.00 2.25 0.08 0.99 1.43 -0.44 -5.05 118.68 117.94 3c18 s LEU 278 Ca 0.00 -1.26 0.22 0.00 -1.03 0.00 0.00 54.13 52.06 3c18 s LEU 278 Cb 0.00 -0.39 -0.17 0.00 0.03 0.00 0.00 46.19 45.66 3c18 s LEU 278 CO 0.00 -0.50 0.76 0.61 0.23 0.00 0.00 176.35 177.44 3c18 n GLY 279 N -0.54 -1.23 3.74 -3.19 0.00 -1.26 -4.49 105.19 98.21 3c18 n GLY 279 Ca -0.04 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 3c18 n GLY 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c18 s VAL 280 N -3.40 3.29 -0.07 1.61 0.11 -1.26 -4.89 120.40 115.78 3c18 s VAL 280 Ca -0.04 1.11 0.01 0.00 -2.93 0.00 0.00 61.98 60.13 3c18 s VAL 280 Cb 0.11 -3.71 -0.03 0.00 -1.53 0.00 0.00 36.38 31.23 3c18 s VAL 280 CO 0.85 0.19 -0.09 -1.61 -3.33 0.00 0.00 175.10 171.10 3c18 s GLU 281 N -0.44 2.79 -0.10 1.54 2.02 -1.26 -1.35 118.70 121.91 3c18 s GLU 281 Ca 0.54 -0.60 -0.15 0.00 0.02 0.00 0.00 54.97 54.78 3c18 s GLU 281 Cb -0.35 -2.56 -0.05 0.00 0.10 0.00 0.00 34.13 31.27 3c18 s GLU 281 CO 0.40 0.59 0.37 -0.51 0.02 0.00 0.00 175.26 176.12 3c18 s LEU 282 N -0.62 4.33 0.21 1.80 1.02 -0.48 -4.87 118.68 120.07 3c18 s LEU 282 Ca 0.09 0.73 -0.30 0.00 0.02 0.00 0.00 54.13 54.68 3c18 s LEU 282 Cb -0.11 -2.51 -0.08 0.00 0.02 0.00 0.00 46.19 43.50 3c18 s LEU 282 CO 0.02 0.16 1.04 -0.69 0.02 0.00 0.00 176.35 176.90 3c18 s VAL 283 N -0.07 3.91 0.06 -1.59 1.01 -1.26 -1.18 120.40 121.29 3c18 s VAL 283 Ca 0.21 1.76 0.04 0.00 0.00 0.00 0.00 61.98 63.99 3c18 s VAL 283 Cb -0.15 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 3c18 s VAL 283 CO 0.09 0.35 -0.12 0.42 0.00 0.00 0.00 175.10 175.84 3c18 s THR 284 N -0.63 0.89 -0.01 3.92 -4.23 0.03 -4.40 115.64 111.21 3c18 s THR 284 Ca 0.46 -1.25 0.03 0.00 -1.18 0.00 0.00 61.69 59.75 3c18 s THR 284 Cb -0.28 -0.93 -0.01 0.00 1.34 0.00 0.00 72.50 72.62 3c18 s THR 284 CO 0.35 -0.31 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.71 3c18 s TYR 285 N -1.40 0.89 -0.10 3.99 2.02 0.67 -1.25 117.35 122.17 3c18 s TYR 285 Ca -0.04 -0.17 -0.07 0.00 -0.37 0.00 0.00 57.07 56.41 3c18 s TYR 285 Cb -0.09 -0.58 0.03 0.00 -0.40 0.00 0.00 41.96 40.92 3c18 s TYR 285 CO 0.01 -0.02 0.25 -2.00 -1.57 0.00 0.00 175.55 172.22 3c18 s GLU 286 N -0.20 0.26 0.27 -0.62 2.12 -0.88 -0.40 118.70 119.25 3c18 s GLU 286 Ca 0.03 0.43 -0.29 0.00 0.36 0.00 0.00 54.97 55.50 3c18 s GLU 286 Cb -0.04 0.03 -0.10 0.00 0.26 0.00 0.00 34.13 34.28 3c18 s GLU 286 CO -0.00 -0.09 1.30 -2.14 -0.54 0.00 0.00 175.26 173.79 3c18 s PRO 287 N 0.63 4.38 0.41 4.30 0.02 -1.26 -0.16 135.00 143.32 3c18 s PRO 287 Ca -0.04 2.13 -0.20 0.00 0.02 0.00 0.00 61.00 62.91 3c18 s PRO 287 Cb -0.05 -3.13 -0.11 0.00 0.02 0.00 0.00 34.50 31.23 3c18 s PRO 287 CO -0.04 -0.20 0.91 0.08 -0.33 0.00 0.00 177.00 177.43 3c18 s VAL 288 N -0.54 4.44 0.00 3.83 1.01 -0.18 -4.84 120.40 124.12 3c18 s VAL 288 Ca 0.53 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.91 3c18 s VAL 288 Cb -0.38 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.40 3c18 s VAL 288 CO 0.45 -0.30 0.00 1.33 0.00 0.00 0.00 175.10 176.59