#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ala s TYR 4 N 0.00 3.28 0.09 5.64 5.04 -1.26 -5.10 117.35 125.04 1ala s TYR 4 Ca 0.00 -2.06 -0.22 0.00 -2.44 0.00 0.00 57.07 52.35 1ala s TYR 4 Cb 0.00 -2.06 -0.07 0.00 0.35 0.00 0.00 41.96 40.18 1ala s TYR 4 CO 0.00 -0.84 0.66 -0.08 -1.34 0.00 0.00 175.55 173.96 1ala s THR 5 N 1.19 4.62 0.16 4.34 -1.32 -1.26 -5.07 115.64 118.30 1ala s THR 5 Ca -0.06 1.43 0.11 0.00 -1.21 0.00 0.00 61.69 61.96 1ala s THR 5 Cb -0.20 -4.01 -0.04 0.00 -1.51 0.00 0.00 72.50 66.74 1ala s THR 5 CO -0.03 0.51 -0.25 -0.13 -2.21 0.00 0.00 174.62 172.52 1ala s ARG 6 N -0.93 1.50 0.48 7.08 0.52 -1.18 -4.85 118.95 121.57 1ala s ARG 6 Ca 0.32 -1.42 0.06 0.00 -0.52 0.00 0.00 55.73 54.18 1ala s ARG 6 Cb -0.21 -1.90 0.00 0.00 0.52 0.00 0.00 34.95 33.37 1ala s ARG 6 CO 0.22 0.43 0.31 0.20 0.02 0.00 0.00 175.30 176.48 1ala s GLY 7 N -2.36 2.37 -0.01 -3.53 0.00 -1.23 -2.14 107.32 100.42 1ala s GLY 7 Ca 0.18 -1.53 0.19 0.00 0.00 0.00 0.00 44.72 43.56 1ala s GLY 7 CO 0.08 -1.91 0.63 -1.30 0.00 0.00 0.00 173.10 170.60 1ala n THR 8 N -1.55 0.00 -4.28 0.90 -2.24 -0.23 -4.45 114.28 102.42 1ala n THR 8 Ca -0.02 -0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.20 1ala n THR 8 Cb 0.64 0.60 -0.15 0.00 -2.10 0.00 0.00 70.33 69.31 1ala n THR 8 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ala s VAL 9 N -3.00 2.48 0.40 2.28 0.11 -0.84 -4.93 120.40 116.90 1ala s VAL 9 Ca 0.01 -0.81 0.07 0.00 -2.93 0.00 0.00 61.98 58.32 1ala s VAL 9 Cb 0.13 -2.05 -0.07 0.00 -1.53 0.00 0.00 36.38 32.86 1ala s VAL 9 CO 0.78 0.51 0.08 0.42 -3.33 0.00 0.00 175.10 173.56 1ala s THR 10 N 1.11 2.20 0.13 5.04 -4.23 -1.26 -4.73 115.64 113.90 1ala s THR 10 Ca 0.00 -1.88 -0.31 0.00 -1.18 0.00 0.00 61.69 58.32 1ala s THR 10 Cb -0.14 -2.97 -0.09 0.00 1.34 0.00 0.00 72.50 70.64 1ala s THR 10 CO -0.06 -0.03 1.47 0.00 -0.54 0.00 0.00 174.62 175.47 1ala s ALA 11 N -2.64 3.67 0.45 3.99 0.00 -1.26 -4.13 121.76 121.84 1ala s ALA 11 Ca 0.37 1.23 -0.20 0.00 0.00 0.00 0.00 51.96 53.36 1ala s ALA 11 Cb 0.06 -3.58 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 1ala s ALA 11 CO 0.20 -0.70 0.98 0.12 0.00 0.00 0.00 175.76 176.36 1ala s PHE 12 N 1.17 3.23 -0.19 0.00 5.36 -1.26 -4.99 117.98 121.30 1ala s PHE 12 Ca 0.67 1.59 -0.27 0.00 -0.96 0.00 0.00 56.93 57.96 1ala s PHE 12 Cb -0.40 -2.90 0.08 0.00 -0.34 0.00 0.00 43.02 39.45 1ala s PHE 12 CO 0.31 -0.32 0.74 0.45 -1.46 0.00 0.00 175.22 174.94 1ala s SER 13 N -2.19 -0.68 -0.16 6.13 0.15 -1.26 -3.64 113.70 112.05 1ala s SER 13 Ca 0.63 1.12 -0.29 0.00 0.70 0.00 0.00 55.95 58.11 1ala s SER 13 Cb -0.11 1.07 -0.00 0.00 -1.71 0.00 0.00 66.02 65.26 1ala s SER 13 CO 0.16 -0.37 1.02 -2.16 1.20 0.00 0.00 173.24 173.09 1ala s PRO 14 N -0.22 4.35 -0.04 5.44 0.04 -1.26 -5.15 135.00 138.16 1ala s PRO 14 Ca -0.04 1.37 -0.28 0.00 0.04 0.00 0.00 61.00 62.09 1ala s PRO 14 Cb -0.03 -3.59 -0.03 0.00 0.04 0.00 0.00 34.50 30.90 1ala s PRO 14 CO 0.04 -0.46 0.92 0.12 0.04 0.00 0.00 177.00 177.66 1ala s PHE 15 N 2.54 3.60 -0.37 0.56 5.36 -1.24 -5.02 117.98 123.42 1ala s PHE 15 Ca 0.46 1.57 0.01 0.00 -0.96 0.00 0.00 56.93 58.01 1ala s PHE 15 Cb -0.17 -3.07 0.15 0.00 -0.34 0.00 0.00 43.02 39.60 1ala s PHE 15 CO 0.13 -0.04 0.27 0.34 -1.46 0.00 0.00 175.22 174.46 1ala s ASP 16 N 0.99 2.27 0.25 6.13 2.15 -1.26 -5.03 116.67 122.17 1ala s ASP 16 Ca 0.48 -2.22 -0.04 0.00 0.43 0.00 0.00 52.55 51.21 1ala s ASP 16 Cb -0.20 -0.17 0.48 0.00 -0.30 0.00 0.00 42.92 42.73 1ala s ASP 16 CO 0.23 -0.27 1.71 0.00 -0.17 0.00 0.00 175.17 176.67 1ala h ALA 17 N 6.75 1.05 -0.31 3.66 0.00 -1.94 1.14 119.26 129.61 1ala h ALA 17 Ca 0.09 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1ala h ALA 17 Cb 0.98 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1ala h ALA 17 CO 0.26 -0.27 0.05 0.00 0.00 0.00 0.00 179.25 179.28 1ala h ARG 18 N 0.37 0.51 -0.12 0.00 3.08 -1.93 0.22 114.38 116.52 1ala h ARG 18 Ca 0.43 -0.14 -0.14 0.00 0.07 0.00 0.00 59.98 60.20 1ala h ARG 18 Cb 0.70 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1ala h ARG 18 CO -0.46 0.61 -0.52 0.00 -1.07 0.00 0.00 179.97 178.54 1ala h ALA 19 N 0.88 0.89 -0.30 0.04 0.00 -1.49 -2.60 119.26 116.67 1ala h ALA 19 Ca 0.09 -0.49 -0.18 0.00 0.00 0.00 0.00 54.91 54.33 1ala h ALA 19 Cb 0.35 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ala h ALA 19 CO 0.01 0.67 -0.51 -0.44 0.00 0.00 0.00 179.25 178.98 1ala h ASP 20 N 0.26 0.97 -0.28 0.00 3.32 0.17 -3.08 116.42 117.78 1ala h ASP 20 Ca 0.01 -0.50 -0.03 0.00 0.02 0.00 0.00 57.03 56.53 1ala h ASP 20 Cb 1.00 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1ala h ASP 20 CO 0.09 1.30 0.09 0.00 -1.72 0.00 0.00 179.24 178.99 1ala h ALA 21 N 0.72 1.50 -0.05 3.45 0.00 -0.49 -2.91 119.26 121.48 1ala h ALA 21 Ca 0.02 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1ala h ALA 21 Cb 1.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1ala h ALA 21 CO 0.12 0.37 -0.61 0.93 0.00 0.00 0.00 179.25 180.06 1ala h GLU 22 N 0.50 0.18 0.00 0.00 5.08 -1.46 -2.88 114.58 116.00 1ala h GLU 22 Ca 0.12 -0.12 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 1ala h GLU 22 Cb 0.19 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1ala h GLU 22 CO -0.00 0.73 -0.79 0.00 -1.00 0.00 0.00 179.01 177.95 1ala h ALA 23 N 1.24 0.69 -0.01 3.43 0.00 -1.47 -3.01 119.26 120.13 1ala h ALA 23 Ca -0.01 -0.72 -0.21 0.00 0.00 0.00 0.00 54.91 53.97 1ala h ALA 23 Cb 1.11 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.79 1ala h ALA 23 CO 0.09 0.99 -0.81 -0.07 0.00 0.00 0.00 179.25 179.45 1ala h LEU 24 N 0.00 0.73 -0.35 0.00 3.38 -1.50 -2.66 115.31 114.92 1ala h LEU 24 Ca -0.01 -0.74 0.01 0.00 0.09 0.00 0.00 57.88 57.23 1ala h LEU 24 Cb 1.40 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 1ala h LEU 24 CO 0.10 1.38 0.22 -0.09 0.09 0.00 0.00 178.44 180.14 1ala h ARG 25 N 0.17 0.44 -0.46 1.13 9.65 -1.62 -2.02 114.38 121.67 1ala h ARG 25 Ca -0.10 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.68 1ala h ARG 25 Cb 1.49 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.95 1ala h ARG 25 CO 0.16 0.29 -0.01 0.87 2.80 0.00 0.00 179.97 184.08 1ala h LYS 26 N 0.46 0.82 -0.06 0.20 1.57 -1.62 0.46 116.57 118.41 1ala h LYS 26 Ca 0.13 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1ala h LYS 26 Cb -0.04 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1ala h LYS 26 CO -0.04 0.88 -0.00 0.00 -0.57 0.00 0.00 179.45 179.72 1ala h ALA 27 N 0.91 1.89 0.00 3.86 0.00 -1.14 -3.19 119.26 121.59 1ala h ALA 27 Ca 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ala h ALA 27 Cb 0.52 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ala h ALA 27 CO 0.03 0.09 -1.82 -0.12 0.00 0.00 0.00 179.25 177.42 1ala n MET 28 N -4.48 0.65 -1.81 0.00 0.00 -0.79 -0.04 117.12 110.65 1ala n MET 28 Ca -0.02 -0.13 -0.42 0.00 -0.00 0.00 0.00 57.70 57.13 1ala n MET 28 Cb 0.12 -1.40 -0.03 0.00 0.00 0.00 0.00 33.22 31.91 1ala n MET 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1ala s LYS 29 N -3.06 4.16 0.85 2.12 2.20 0.16 -4.71 119.74 121.47 1ala s LYS 29 Ca -0.06 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.02 1ala s LYS 29 Cb 0.10 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 1ala s LYS 29 CO 0.70 -0.80 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 1ala n GLY 30 N 4.13 -1.86 3.63 5.54 0.00 -1.26 -4.91 105.19 110.47 1ala n GLY 30 Ca 0.17 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.14 1ala n GLY 30 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ala s MET 31 N 0.00 3.85 0.74 1.61 1.75 -1.26 -4.76 119.30 121.22 1ala s MET 31 Ca 0.00 1.78 0.00 0.00 -1.25 0.00 0.00 55.69 56.22 1ala s MET 31 Cb 0.00 -4.04 0.00 0.00 2.84 0.00 0.00 34.83 33.63 1ala s MET 31 CO 0.00 -1.23 0.00 0.41 -0.65 0.00 0.00 175.02 173.55 1ala n GLY 32 N 4.59 -1.91 3.35 2.11 0.00 -1.26 -5.01 105.19 107.07 1ala n GLY 32 Ca 0.19 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.43 1ala n GLY 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ala s THR 33 N 0.00 0.02 -1.09 2.61 2.01 -1.26 -4.73 115.64 113.19 1ala s THR 33 Ca 0.00 -0.13 -0.13 0.00 0.31 0.00 0.00 61.69 61.74 1ala s THR 33 Cb 0.00 -0.69 0.20 0.00 0.01 0.00 0.00 72.50 72.02 1ala s THR 33 CO 0.00 -0.07 1.21 -0.62 -0.69 0.00 0.00 174.62 174.45 1ala s ASP 34 N -0.40 7.04 0.47 3.53 2.15 0.95 -4.87 116.67 125.54 1ala s ASP 34 Ca -0.05 -2.98 0.19 0.00 0.43 0.00 0.00 52.55 50.13 1ala s ASP 34 Cb -0.03 -2.32 1.19 0.00 -0.30 0.00 0.00 42.92 41.45 1ala s ASP 34 CO 0.03 -0.64 1.97 -0.33 -0.17 0.00 0.00 175.17 176.03 1ala h GLU 35 N 7.36 0.24 -0.05 4.34 3.07 -1.98 -2.35 114.58 125.20 1ala h GLU 35 Ca 0.22 -0.01 -0.21 0.00 -0.50 0.00 0.00 59.36 58.86 1ala h GLU 35 Cb 0.92 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 1ala h GLU 35 CO 1.09 0.16 -0.83 1.49 -1.40 0.00 0.00 179.01 179.52 1ala h GLU 36 N 0.24 0.46 -0.71 2.33 4.81 -1.99 -2.38 114.58 117.35 1ala h GLU 36 Ca 0.30 -0.43 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 1ala h GLU 36 Cb 0.84 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.29 1ala h GLU 36 CO -0.06 1.07 0.20 1.15 -0.73 0.00 0.00 179.01 180.64 1ala h THR 37 N 0.29 1.26 0.07 0.32 2.02 -1.83 -2.43 112.91 112.62 1ala h THR 37 Ca -0.06 -0.93 0.01 0.00 0.77 0.00 0.00 66.41 66.21 1ala h THR 37 Cb 1.44 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 68.31 1ala h THR 37 CO 0.15 0.36 -0.51 0.40 0.37 0.00 0.00 175.52 176.29 1ala h ILE 38 N 1.06 0.00 -0.31 3.11 2.04 -1.54 -1.82 117.51 120.06 1ala h ILE 38 Ca 0.23 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.03 1ala h ILE 38 Cb 0.33 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 1ala h ILE 38 CO -0.00 0.00 -0.04 0.17 0.00 0.00 0.00 178.15 178.28 1ala h LEU 39 N -0.69 0.45 -0.02 1.44 8.10 -1.36 -0.98 115.31 122.25 1ala h LEU 39 Ca 0.00 -0.09 -0.00 0.00 0.11 0.00 0.00 57.88 57.90 1ala h LEU 39 Cb 0.71 -0.12 -0.00 0.00 -0.44 0.00 0.00 40.66 40.81 1ala h LEU 39 CO -0.30 0.55 0.00 0.11 -4.11 0.00 0.00 178.44 174.69 1ala h LYS 40 N 0.46 0.04 0.82 0.17 1.79 -1.22 -1.18 116.57 117.45 1ala h LYS 40 Ca 0.10 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.51 1ala h LYS 40 Cb 0.36 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1ala h LYS 40 CO 0.02 0.33 -0.39 0.82 -1.08 0.00 0.00 179.45 179.14 1ala h ILE 41 N -0.25 0.00 -0.19 1.86 2.04 -1.05 -3.18 117.51 116.75 1ala h ILE 41 Ca 0.01 -0.08 0.06 0.00 1.00 0.00 0.00 64.86 65.85 1ala h ILE 41 Cb 0.31 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1ala h ILE 41 CO 0.00 0.00 0.16 -0.07 0.00 0.00 0.00 178.15 178.24 1ala h LEU 42 N -1.18 0.00 -1.27 1.44 4.07 -1.25 -1.93 115.31 115.19 1ala h LEU 42 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1ala h LEU 42 Cb 0.84 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.58 1ala h LEU 42 CO 0.19 0.00 -0.07 0.35 -1.08 0.00 0.00 178.44 177.82 1ala n THR 43 N -4.22 0.00 0.15 0.22 -2.24 -0.45 -4.13 114.28 103.62 1ala n THR 43 Ca 0.02 -0.33 0.04 0.00 -2.27 0.00 0.00 64.05 61.51 1ala n THR 43 Cb 0.29 0.93 0.07 0.00 -2.10 0.00 0.00 70.33 69.52 1ala n THR 43 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ala n SER 44 N 0.50 2.13 -4.57 3.42 3.41 -0.75 -4.75 113.62 113.01 1ala n SER 44 Ca 0.16 -1.62 -0.31 0.00 -0.26 0.00 0.00 58.87 56.83 1ala n SER 44 Cb 0.46 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.23 1ala n SER 44 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1ala s ARG 45 N -0.83 2.36 0.86 4.33 3.00 -1.07 -4.10 118.95 123.51 1ala s ARG 45 Ca 0.13 -0.85 -0.10 0.00 0.00 0.00 0.00 55.73 54.92 1ala s ARG 45 Cb 0.08 -2.40 0.17 0.00 0.00 0.00 0.00 34.95 32.80 1ala s ARG 45 CO 0.11 0.56 1.19 0.54 0.00 0.00 0.00 175.30 177.70 1ala s ASN 46 N -1.69 3.60 0.17 0.23 6.03 -1.26 -4.84 114.94 117.18 1ala s ASN 46 Ca 0.18 -0.02 -0.12 0.00 -1.03 0.00 0.00 52.86 51.87 1ala s ASN 46 Cb -0.11 -0.15 0.06 0.00 -3.03 0.00 0.00 41.25 38.02 1ala s ASN 46 CO 0.09 -2.39 1.71 -1.13 -2.03 0.00 0.00 177.10 173.36 1ala h ASN 47 N -1.19 0.80 -0.59 3.54 -1.24 -1.95 -1.37 115.58 113.57 1ala h ASN 47 Ca -0.41 -0.19 0.05 0.00 0.71 0.00 0.00 56.30 56.47 1ala h ASN 47 Cb 1.25 -0.21 -0.05 0.00 0.73 0.00 0.00 38.32 40.04 1ala h ASN 47 CO 0.38 0.77 0.31 0.00 -1.29 0.00 0.00 177.43 177.60 1ala h ALA 48 N 1.06 0.78 -0.05 1.57 0.00 -1.97 -0.51 119.26 120.13 1ala h ALA 48 Ca 0.19 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ala h ALA 48 Cb 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1ala h ALA 48 CO -0.01 -0.03 -0.03 1.96 0.00 0.00 0.00 179.25 181.14 1ala h GLN 49 N 0.59 -0.02 -0.83 0.00 4.20 -1.92 -2.17 115.11 114.96 1ala h GLN 49 Ca 0.27 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.05 1ala h GLN 49 Cb 0.17 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.89 1ala h GLN 49 CO -0.18 -0.02 0.49 0.00 -0.67 0.00 0.00 178.83 178.46 1ala h ARG 50 N -0.03 0.84 -0.21 1.46 3.08 -0.67 -0.07 114.38 118.79 1ala h ARG 50 Ca 0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ala h ARG 50 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1ala h ARG 50 CO -0.07 0.56 0.07 1.96 -1.07 0.00 0.00 179.97 181.42 1ala h GLN 51 N 0.87 0.29 0.01 0.04 1.08 -0.67 -1.97 115.11 114.75 1ala h GLN 51 Ca 0.38 -0.03 -0.22 0.00 -1.45 0.00 0.00 58.65 57.33 1ala h GLN 51 Cb 0.26 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 1ala h GLN 51 CO -0.21 0.25 -1.11 0.93 -0.95 0.00 0.00 178.83 177.74 1ala h GLU 52 N 0.29 0.01 -0.15 1.46 5.08 -0.45 -2.69 114.58 118.12 1ala h GLU 52 Ca 0.07 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.20 1ala h GLU 52 Cb 0.08 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1ala h GLU 52 CO -0.01 0.94 -0.73 0.82 -1.00 0.00 0.00 179.01 179.03 1ala h ILE 53 N 0.00 1.30 -0.68 3.13 2.04 -0.84 -2.51 117.51 119.96 1ala h ILE 53 Ca -0.06 -1.97 -0.01 0.00 1.00 0.00 0.00 64.86 63.82 1ala h ILE 53 Cb 1.81 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 39.82 1ala h ILE 53 CO 0.13 0.62 0.38 0.00 0.00 0.00 0.00 178.15 179.28 1ala h ALA 54 N 0.68 0.86 -0.23 1.87 0.00 -1.31 -1.64 119.26 119.49 1ala h ALA 54 Ca -0.04 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1ala h ALA 54 Cb 1.34 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1ala h ALA 54 CO 0.15 0.37 -0.13 0.77 0.00 0.00 0.00 179.25 180.40 1ala h SER 55 N 0.92 0.51 -0.60 0.00 0.02 -1.49 -1.16 113.55 111.75 1ala h SER 55 Ca 0.24 -0.42 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1ala h SER 55 Cb 0.02 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1ala h SER 55 CO -0.04 0.82 0.33 0.00 -1.14 0.00 0.00 176.83 176.80 1ala h ALA 56 N 0.70 0.76 -0.31 3.77 0.00 -1.29 -1.87 119.26 121.03 1ala h ALA 56 Ca 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ala h ALA 56 Cb 0.64 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ala h ALA 56 CO 0.04 0.28 0.18 0.35 0.00 0.00 0.00 179.25 180.10 1ala h PHE 57 N 0.81 0.42 -0.06 0.00 3.04 -1.31 -0.18 116.94 119.65 1ala h PHE 57 Ca 0.21 -0.01 -0.11 0.00 3.98 0.00 0.00 57.97 62.04 1ala h PHE 57 Cb 0.05 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.41 1ala h PHE 57 CO -0.01 0.33 -0.47 -0.22 -2.02 0.00 0.00 178.31 175.91 1ala h LYS 58 N 0.39 0.16 -0.31 1.11 3.64 -0.75 -2.42 116.57 118.39 1ala h LYS 58 Ca 0.11 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 1ala h LYS 58 Cb 0.04 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1ala h LYS 58 CO -0.02 0.60 -0.46 1.15 -2.27 0.00 0.00 179.45 178.45 1ala h THR 59 N 0.13 1.28 0.12 1.00 2.02 -0.91 -1.87 112.91 114.67 1ala h THR 59 Ca 0.01 -1.65 -0.16 0.00 0.77 0.00 0.00 66.41 65.37 1ala h THR 59 Cb 0.89 1.53 0.02 0.00 -1.74 0.00 0.00 68.15 68.85 1ala h THR 59 CO 0.07 0.54 -0.74 -0.07 0.37 0.00 0.00 175.52 175.69 1ala h LEU 60 N 0.65 0.39 0.00 2.58 3.38 -1.01 -3.40 115.31 117.89 1ala h LEU 60 Ca 0.04 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.06 1ala h LEU 60 Cb 1.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1ala h LEU 60 CO 0.10 1.35 -1.17 0.49 0.09 0.00 0.00 178.44 179.30 1ala n PHE 61 N -4.19 0.00 -2.03 1.13 3.72 -0.92 -5.02 117.46 110.15 1ala n PHE 61 Ca -0.14 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.23 1ala n PHE 61 Cb 0.78 -0.16 -0.00 0.00 -0.94 0.00 0.00 39.48 39.16 1ala n PHE 61 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ala n GLY 62 N 1.79 0.25 3.45 1.37 0.00 -0.70 -5.03 105.19 106.32 1ala n GLY 62 Ca -0.01 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 1ala n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ala s ARG 63 N -4.11 1.61 -0.21 1.61 0.52 -1.26 -5.06 118.95 112.05 1ala s ARG 63 Ca 0.00 -1.79 -0.07 0.00 -0.52 0.00 0.00 55.73 53.35 1ala s ARG 63 Cb 0.00 -1.38 -0.03 0.00 0.52 0.00 0.00 34.95 34.06 1ala s ARG 63 CO 0.00 0.13 0.04 0.34 0.02 0.00 0.00 175.30 175.83 1ala s ASP 64 N -3.48 5.17 0.15 0.23 -1.08 -1.26 -3.83 116.67 112.56 1ala s ASP 64 Ca 0.29 -0.13 -0.17 0.00 -0.52 0.00 0.00 52.55 52.03 1ala s ASP 64 Cb 0.01 -1.90 -0.00 0.00 -1.46 0.00 0.00 42.92 39.57 1ala s ASP 64 CO 0.13 0.06 1.80 0.25 0.52 0.00 0.00 175.17 177.92 1ala h LEU 65 N 7.56 0.42 0.25 -1.34 5.85 -1.94 -2.46 115.31 123.65 1ala h LEU 65 Ca -0.37 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1ala h LEU 65 Cb 1.18 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1ala h LEU 65 CO 0.62 0.31 -0.12 0.58 -0.34 0.00 0.00 178.44 179.49 1ala h VAL 66 N 0.49 0.80 -0.86 1.05 2.07 -1.96 0.18 116.25 118.02 1ala h VAL 66 Ca 0.13 -0.35 0.22 0.00 0.82 0.00 0.00 66.70 67.52 1ala h VAL 66 Cb -0.05 1.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.57 1ala h VAL 66 CO -0.03 0.08 0.08 0.44 0.02 0.00 0.00 177.57 178.16 1ala h ASP 67 N -0.52 -0.27 -0.22 0.57 3.32 -1.98 0.11 116.42 117.43 1ala h ASP 67 Ca -0.03 0.22 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 1ala h ASP 67 Cb 0.39 0.36 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1ala h ASP 67 CO 0.06 -0.22 -0.12 0.44 -1.72 0.00 0.00 179.24 177.68 1ala h ASP 68 N 0.11 0.48 -0.48 6.45 5.19 -1.29 -0.49 116.42 126.39 1ala h ASP 68 Ca 0.50 -0.42 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1ala h ASP 68 Cb 0.98 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.33 1ala h ASP 68 CO -0.73 0.80 0.30 -0.07 -3.12 0.00 0.00 179.24 176.42 1ala h LEU 69 N 0.16 0.57 -0.84 1.55 3.38 0.16 0.11 115.31 120.41 1ala h LEU 69 Ca 0.05 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.08 1ala h LEU 69 Cb 0.62 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.15 1ala h LEU 69 CO 0.03 0.44 0.48 0.11 0.09 0.00 0.00 178.44 179.60 1ala h LYS 70 N 0.65 0.77 0.00 1.13 1.57 -0.82 0.87 116.57 120.74 1ala h LYS 70 Ca 0.17 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.67 1ala h LYS 70 Cb -0.04 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.06 1ala h LYS 70 CO -0.03 0.51 -1.28 1.03 -0.57 0.00 0.00 179.45 179.10 1ala h SER 71 N 0.79 0.00 0.18 0.86 0.87 -0.81 -3.37 113.55 112.08 1ala h SER 71 Ca 0.41 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.67 1ala h SER 71 Cb 0.40 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.38 1ala h SER 71 CO -0.26 0.97 -1.45 -0.33 -0.53 0.00 0.00 176.83 175.24 1ala h GLU 72 N 0.00 0.39 -7.26 2.24 4.39 -0.43 -3.48 114.58 110.44 1ala h GLU 72 Ca -0.13 -0.67 -0.46 0.00 0.34 0.00 0.00 59.36 58.45 1ala h GLU 72 Cb 1.85 0.25 0.09 0.00 -0.10 0.00 0.00 28.75 30.84 1ala h GLU 72 CO 0.11 1.32 0.18 -0.51 -1.16 0.00 0.00 179.01 178.95 1ala s LEU 73 N -7.54 2.91 -0.01 1.33 1.43 0.30 -4.98 118.68 112.13 1ala s LEU 73 Ca -0.15 0.12 -0.14 0.00 -1.03 0.00 0.00 54.13 52.93 1ala s LEU 73 Cb 0.04 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.66 1ala s LEU 73 CO 0.86 -1.78 0.29 0.28 0.23 0.00 0.00 176.35 176.22 1ala s THR 74 N -3.24 0.06 0.00 5.49 -1.32 -1.26 -4.83 115.64 110.54 1ala s THR 74 Ca 0.64 -0.50 0.00 0.00 -1.21 0.00 0.00 61.69 60.62 1ala s THR 74 Cb -0.08 -0.60 0.00 0.00 -1.51 0.00 0.00 72.50 70.31 1ala s THR 74 CO 0.45 -0.28 0.00 0.61 -2.21 0.00 0.00 174.62 173.19 1ala n GLY 75 N 1.28 1.54 0.17 6.08 0.00 -1.26 -3.00 105.19 110.01 1ala n GLY 75 Ca -0.22 -0.64 0.04 0.00 0.00 0.00 0.00 46.02 45.21 1ala n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ala h LYS 76 N 0.00 0.00 -0.32 1.61 1.57 -2.00 -2.74 116.57 114.70 1ala h LYS 76 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1ala h LYS 76 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1ala h LYS 76 CO 0.00 0.43 0.10 0.35 -0.57 0.00 0.00 179.45 179.76 1ala h PHE 77 N 0.00 0.51 -0.51 -1.35 3.57 -1.94 -1.48 116.94 115.73 1ala h PHE 77 Ca -0.00 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.48 1ala h PHE 77 Cb 0.99 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 1ala h PHE 77 CO 0.00 0.51 0.28 1.49 -2.23 0.00 0.00 178.31 178.36 1ala h GLU 78 N 0.36 0.53 -0.24 1.11 4.81 -1.41 -1.43 114.58 118.31 1ala h GLU 78 Ca 0.10 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1ala h GLU 78 Cb 0.24 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1ala h GLU 78 CO -0.00 0.35 0.14 1.15 -0.73 0.00 0.00 179.01 179.92 1ala h THR 79 N 0.55 1.10 -0.04 0.32 2.02 -1.35 -0.24 112.91 115.27 1ala h THR 79 Ca 0.22 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1ala h THR 79 Cb 0.09 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1ala h THR 79 CO -0.13 0.10 -0.04 0.25 0.37 0.00 0.00 175.52 176.07 1ala h LEU 80 N 0.30 -0.14 -0.48 2.58 5.85 -1.00 0.37 115.31 122.79 1ala h LEU 80 Ca 0.09 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 1ala h LEU 80 Cb 0.03 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1ala h LEU 80 CO -0.02 -0.07 0.08 0.24 -0.34 0.00 0.00 178.44 178.34 1ala h MET 81 N -0.06 0.79 -0.38 1.25 2.86 -1.17 -0.23 114.93 117.99 1ala h MET 81 Ca 0.03 -0.21 -0.13 0.00 -2.06 0.00 0.00 59.70 57.33 1ala h MET 81 Cb 0.11 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 1ala h MET 81 CO -0.08 0.80 -0.29 0.28 1.06 0.00 0.00 176.91 178.69 1ala h VAL 82 N 0.66 1.28 -0.45 -2.22 2.07 -0.91 -2.72 116.25 113.96 1ala h VAL 82 Ca 0.15 -1.43 -0.12 0.00 0.82 0.00 0.00 66.70 66.12 1ala h VAL 82 Cb 0.39 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1ala h VAL 82 CO 0.01 0.48 -0.18 0.28 0.02 0.00 0.00 177.57 178.17 1ala h SER 83 N 0.69 0.90 -0.80 0.57 0.02 -0.72 -2.68 113.55 111.53 1ala h SER 83 Ca 0.08 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.70 1ala h SER 83 Cb 0.83 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.08 1ala h SER 83 CO 0.07 1.06 0.44 -0.07 -1.14 0.00 0.00 176.83 177.19 1ala h LEU 84 N 0.78 1.01 -0.95 5.07 3.38 -0.87 -2.64 115.31 121.09 1ala h LEU 84 Ca 0.11 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1ala h LEU 84 Cb 0.72 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1ala h LEU 84 CO 0.06 0.82 -0.18 0.24 0.09 0.00 0.00 178.44 179.46 1ala h MET 85 N 1.14 0.00 -6.69 1.13 2.86 -1.34 -3.46 114.93 108.57 1ala h MET 85 Ca 0.29 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.40 1ala h MET 85 Cb 0.04 0.00 0.04 0.00 0.06 0.00 0.00 31.60 31.74 1ala h MET 85 CO -0.04 0.18 0.73 0.50 1.06 0.00 0.00 176.91 179.34 1ala s ARG 86 N -3.54 4.31 0.24 1.72 3.52 -1.00 -4.88 118.95 119.32 1ala s ARG 86 Ca 0.02 2.20 -0.31 0.00 -0.13 0.00 0.00 55.73 57.51 1ala s ARG 86 Cb 0.09 -3.16 -0.13 0.00 -1.56 0.00 0.00 34.95 30.19 1ala s ARG 86 CO 0.63 -0.39 1.46 -2.30 -0.81 0.00 0.00 175.30 173.89 1ala n PRO 87 N 2.78 2.16 0.25 5.12 -0.02 -1.26 -4.85 135.00 139.18 1ala n PRO 87 Ca 0.08 0.77 0.10 0.00 -2.02 0.00 0.00 63.50 62.43 1ala n PRO 87 Cb 0.41 -2.46 0.69 0.00 -0.02 0.00 0.00 33.50 32.13 1ala n PRO 87 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ala h ALA 88 N 4.49 1.95 0.00 3.55 0.00 -1.92 -2.53 119.26 124.80 1ala h ALA 88 Ca -0.45 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1ala h ALA 88 Cb 1.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ala h ALA 88 CO 0.78 -0.05 -0.16 0.07 0.00 0.00 0.00 179.25 179.89 1ala h ARG 89 N 0.00 0.00 0.00 0.00 0.11 -2.03 -3.25 114.38 109.21 1ala h ARG 89 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1ala h ARG 89 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.16 1ala h ARG 89 CO -0.00 0.16 -1.38 -0.89 0.10 0.00 0.00 179.97 177.95 1ala n ILE 90 N -3.76 0.00 -0.13 0.08 5.41 -1.17 -4.79 119.36 114.99 1ala n ILE 90 Ca -0.02 -0.24 -0.12 0.00 1.00 0.00 0.00 62.75 63.37 1ala n ILE 90 Cb 0.26 0.33 -0.08 0.00 -0.71 0.00 0.00 39.64 39.45 1ala n ILE 90 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1ala h PHE 91 N 0.00 -1.53 -0.22 1.39 3.04 -1.48 0.43 116.94 118.57 1ala h PHE 91 Ca 0.00 0.08 -0.02 0.00 3.98 0.00 0.00 57.97 62.01 1ala h PHE 91 Cb 0.45 0.72 -0.01 0.00 2.56 0.00 0.00 35.95 39.67 1ala h PHE 91 CO 0.00 -0.48 0.06 -0.44 -2.02 0.00 0.00 178.31 175.43 1ala h ASP 92 N -0.38 0.34 -0.92 0.41 3.32 -1.87 -0.12 116.42 117.20 1ala h ASP 92 Ca 0.10 -0.22 0.04 0.00 0.02 0.00 0.00 57.03 56.96 1ala h ASP 92 Cb 0.60 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 40.01 1ala h ASP 92 CO -0.59 0.47 0.60 0.00 -1.72 0.00 0.00 179.24 178.01 1ala h ALA 93 N 0.88 1.42 -0.15 3.45 0.00 -1.81 0.56 119.26 123.61 1ala h ALA 93 Ca 0.07 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ala h ALA 93 Cb 0.26 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ala h ALA 93 CO -0.00 0.50 -0.19 1.25 0.00 0.00 0.00 179.25 180.80 1ala h HIS 94 N 1.15 0.49 -0.79 0.00 -0.00 -0.70 -2.04 115.15 113.25 1ala h HIS 94 Ca 0.36 -0.16 -0.04 0.00 -0.00 0.00 0.00 60.37 60.53 1ala h HIS 94 Cb 0.01 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 27.29 1ala h HIS 94 CO -0.00 0.81 0.32 0.00 -0.00 0.00 0.00 177.93 179.06 1ala h ALA 95 N 0.59 1.07 -0.07 5.26 0.00 -0.63 -2.79 119.26 122.70 1ala h ALA 95 Ca 0.02 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1ala h ALA 95 Cb 0.75 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ala h ALA 95 CO 0.05 0.66 -0.42 -0.07 0.00 0.00 0.00 179.25 179.46 1ala h LEU 96 N 1.15 0.16 -1.36 0.00 3.38 -0.82 -2.59 115.31 115.23 1ala h LEU 96 Ca 0.26 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1ala h LEU 96 Cb 0.21 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1ala h LEU 96 CO -0.02 0.57 -0.13 0.50 0.09 0.00 0.00 178.44 179.44 1ala h LYS 97 N 0.13 0.26 0.00 1.13 3.64 -1.10 -3.14 116.57 117.49 1ala h LYS 97 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1ala h LYS 97 Cb 0.81 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1ala h LYS 97 CO 0.06 0.41 -0.87 0.72 -2.27 0.00 0.00 179.45 177.50 1ala n HIS 98 N -4.26 0.36 0.61 1.91 8.25 -1.01 -1.27 115.22 119.80 1ala n HIS 98 Ca -0.01 0.10 0.13 0.00 -0.26 0.00 0.00 57.72 57.68 1ala n HIS 98 Cb 0.28 -0.51 0.30 0.00 1.12 0.00 0.00 29.99 31.19 1ala n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ala n ALA 99 N -1.81 2.57 -0.08 -1.41 0.00 -1.02 -4.06 120.51 114.70 1ala n ALA 99 Ca 0.02 -0.12 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 1ala n ALA 99 Cb 0.43 -1.34 -0.05 0.00 0.00 0.00 0.00 19.45 18.49 1ala n ALA 99 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ala n ILE 100 N -2.19 1.02 -2.05 0.00 5.41 -1.22 0.40 119.36 120.73 1ala n ILE 100 Ca 0.05 -0.14 -0.39 0.00 1.00 0.00 0.00 62.75 63.26 1ala n ILE 100 Cb 0.43 -1.79 -0.00 0.00 -0.71 0.00 0.00 39.64 37.57 1ala n ILE 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1ala s LYS 101 N -2.36 3.94 0.33 0.38 -2.85 -0.40 -4.75 119.74 114.03 1ala s LYS 101 Ca -0.23 2.15 0.00 0.00 -1.00 0.00 0.00 55.97 56.90 1ala s LYS 101 Cb 0.08 -2.73 0.00 0.00 -2.06 0.00 0.00 37.83 33.12 1ala s LYS 101 CO 0.29 -0.52 0.00 0.41 0.10 0.00 0.00 175.35 175.63 1ala n GLY 102 N 0.66 -1.79 3.76 0.59 0.00 -1.26 -4.90 105.19 102.24 1ala n GLY 102 Ca 0.04 -1.88 -0.40 0.00 0.00 0.00 0.00 46.02 43.78 1ala n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ala s ALA 103 N -1.73 3.38 0.00 4.61 0.00 -1.26 -4.82 121.76 121.93 1ala s ALA 103 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1ala s ALA 103 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1ala s ALA 103 CO 0.00 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.38 1ala n GLY 104 N 1.67 -1.14 3.40 0.00 0.00 -1.26 -4.97 105.19 102.89 1ala n GLY 104 Ca -0.03 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.60 1ala n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ala s THR 105 N 0.00 0.03 -0.81 2.61 2.01 -1.26 -4.77 115.64 113.44 1ala s THR 105 Ca 0.00 -0.22 -0.11 0.00 0.31 0.00 0.00 61.69 61.67 1ala s THR 105 Cb 0.00 -0.98 0.21 0.00 0.01 0.00 0.00 72.50 71.74 1ala s THR 105 CO 0.00 -0.12 0.74 0.21 -0.69 0.00 0.00 174.62 174.76 1ala s ASN 106 N -1.98 6.52 0.30 3.53 3.04 1.31 -4.91 114.94 122.75 1ala s ASN 106 Ca -0.05 -2.81 0.06 0.00 0.04 0.00 0.00 52.86 50.09 1ala s ASN 106 Cb -0.01 -2.14 0.75 0.00 -1.54 0.00 0.00 41.25 38.31 1ala s ASN 106 CO -0.02 -0.51 1.75 -0.33 -3.04 0.00 0.00 177.10 174.96 1ala h GLU 107 N 7.52 0.64 -0.14 0.43 3.07 -1.98 -2.87 114.58 121.24 1ala h GLU 107 Ca 0.09 -0.04 0.02 0.00 -0.50 0.00 0.00 59.36 58.94 1ala h GLU 107 Cb 1.01 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.74 1ala h GLU 107 CO 0.76 0.42 -0.26 -0.22 -1.40 0.00 0.00 179.01 178.32 1ala h LYS 108 N 0.66 -0.21 -0.60 2.33 1.63 -1.96 -0.41 116.57 118.00 1ala h LYS 108 Ca 0.58 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.39 1ala h LYS 108 Cb 0.97 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.62 1ala h LYS 108 CO -0.42 -0.14 0.36 0.28 -3.45 0.00 0.00 179.45 176.08 1ala h VAL 109 N -0.22 1.17 0.22 2.00 2.07 -1.92 -1.66 116.25 117.91 1ala h VAL 109 Ca 0.03 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.18 1ala h VAL 109 Cb 0.29 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 1ala h VAL 109 CO -0.25 0.18 -0.47 -0.07 0.02 0.00 0.00 177.57 176.97 1ala h LEU 110 N 0.83 -1.38 -0.41 2.57 3.38 -1.14 -2.14 115.31 117.01 1ala h LEU 110 Ca 0.22 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 1ala h LEU 110 Cb -0.04 0.50 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1ala h LEU 110 CO -0.04 -0.56 0.22 0.74 0.09 0.00 0.00 178.44 178.90 1ala h THR 111 N -0.77 1.16 0.49 0.22 2.02 -1.00 -1.87 112.91 113.16 1ala h THR 111 Ca -0.01 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 1ala h THR 111 Cb 0.75 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1ala h THR 111 CO -0.21 0.16 -0.24 -0.08 0.37 0.00 0.00 175.52 175.53 1ala h GLU 112 N 0.54 -0.64 -0.25 6.66 4.81 -1.20 -0.83 114.58 123.66 1ala h GLU 112 Ca 0.15 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1ala h GLU 112 Cb 0.06 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1ala h GLU 112 CO -0.02 -0.42 0.06 0.82 -0.73 0.00 0.00 179.01 178.72 1ala h ILE 113 N -0.68 1.22 -0.08 2.32 2.04 -1.45 -1.35 117.51 119.52 1ala h ILE 113 Ca -0.07 -0.72 -0.13 0.00 1.00 0.00 0.00 64.86 64.94 1ala h ILE 113 Cb 0.52 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1ala h ILE 113 CO 0.11 0.23 -0.53 -0.07 0.00 0.00 0.00 178.15 177.90 1ala h LEU 114 N 0.24 0.26 0.06 1.44 3.38 -1.37 -2.59 115.31 116.73 1ala h LEU 114 Ca 0.08 -0.13 -0.28 0.00 0.09 0.00 0.00 57.88 57.63 1ala h LEU 114 Cb 0.30 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 40.99 1ala h LEU 114 CO 0.00 0.74 -1.19 0.00 0.09 0.00 0.00 178.44 178.08 1ala h ALA 115 N 1.27 0.07 0.00 1.53 0.00 -1.18 -3.39 119.26 117.56 1ala h ALA 115 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1ala h ALA 115 Cb 0.99 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ala h ALA 115 CO 0.08 0.74 -1.03 -1.13 0.00 0.00 0.00 179.25 177.92 1ala n SER 116 N -3.76 0.64 -4.86 0.00 3.41 -0.51 -4.79 113.62 103.75 1ala n SER 116 Ca -0.12 0.01 -0.33 0.00 -0.26 0.00 0.00 58.87 58.17 1ala n SER 116 Cb 0.96 0.69 -0.06 0.00 -0.26 0.00 0.00 64.21 65.54 1ala n SER 116 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1ala s ARG 117 N -3.26 3.91 0.51 4.33 3.00 -0.98 -5.03 118.95 121.43 1ala s ARG 117 Ca 0.02 0.47 -0.19 0.00 0.00 0.00 0.00 55.73 56.03 1ala s ARG 117 Cb 0.13 -2.59 -0.07 0.00 0.00 0.00 0.00 34.95 32.42 1ala s ARG 117 CO 0.79 0.27 1.04 0.95 0.00 0.00 0.00 175.30 178.34 1ala s THR 118 N -1.85 3.85 0.44 0.02 -4.23 -1.26 -4.75 115.64 107.86 1ala s THR 118 Ca 0.49 1.08 0.23 0.00 -1.18 0.00 0.00 61.69 62.31 1ala s THR 118 Cb -0.11 -3.45 0.43 0.00 1.34 0.00 0.00 72.50 70.71 1ala s THR 118 CO 0.19 -0.32 1.80 -0.65 -0.54 0.00 0.00 174.62 175.10 1ala h PRO 119 N 1.30 0.27 -0.12 3.99 0.11 -1.96 0.97 132.00 136.56 1ala h PRO 119 Ca -0.49 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.47 1ala h PRO 119 Cb 1.22 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.27 1ala h PRO 119 CO 0.59 0.18 -0.48 0.00 -0.21 0.00 0.00 178.00 178.08 1ala h ALA 120 N 1.57 0.21 -0.44 -0.75 0.00 -1.92 -0.36 119.26 117.58 1ala h ALA 120 Ca 0.56 -0.49 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1ala h ALA 120 Cb 1.65 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1ala h ALA 120 CO -0.20 0.37 -0.14 0.93 0.00 0.00 0.00 179.25 180.22 1ala h GLU 121 N 0.13 0.87 -0.46 0.00 5.08 0.31 -0.62 114.58 119.89 1ala h GLU 121 Ca -0.03 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 1ala h GLU 121 Cb 1.11 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 1ala h GLU 121 CO 0.10 0.99 0.23 0.28 -1.00 0.00 0.00 179.01 179.60 1ala h VAL 122 N 0.70 1.18 -0.84 3.13 2.07 0.16 -1.87 116.25 120.78 1ala h VAL 122 Ca 0.11 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 67.18 1ala h VAL 122 Cb 0.68 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 1ala h VAL 122 CO 0.05 0.20 0.52 1.56 0.02 0.00 0.00 177.57 179.91 1ala h GLN 123 N 0.60 0.92 -0.35 1.57 4.20 -0.98 -1.45 115.11 119.62 1ala h GLN 123 Ca 0.16 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.75 1ala h GLN 123 Cb 0.11 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1ala h GLN 123 CO -0.02 0.61 -0.03 -0.97 -0.67 0.00 0.00 178.83 177.75 1ala h ASN 124 N 0.95 0.63 -0.53 1.46 -0.00 -0.69 -3.22 115.58 114.18 1ala h ASN 124 Ca 0.37 -0.33 0.03 0.00 -0.00 0.00 0.00 56.30 56.37 1ala h ASN 124 Cb 0.16 -0.17 -0.04 0.00 -0.00 0.00 0.00 38.32 38.27 1ala h ASN 124 CO -0.17 0.81 0.30 0.40 -0.00 0.00 0.00 177.43 178.77 1ala h ILE 125 N 0.45 1.02 -0.71 2.57 2.04 -0.81 -0.67 117.51 121.40 1ala h ILE 125 Ca 0.10 -0.20 0.10 0.00 1.00 0.00 0.00 64.86 65.86 1ala h ILE 125 Cb 0.50 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.91 1ala h ILE 125 CO 0.02 0.11 0.47 0.11 0.00 0.00 0.00 178.15 178.86 1ala h LYS 126 N 0.59 0.55 0.02 2.37 1.57 -1.33 0.17 116.57 120.51 1ala h LYS 126 Ca 0.22 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1ala h LYS 126 Cb 0.06 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1ala h LYS 126 CO -0.12 0.36 -0.01 1.96 -0.57 0.00 0.00 179.45 181.07 1ala h GLN 127 N 0.56 -0.03 -0.45 3.15 4.20 -1.49 -1.88 115.11 119.18 1ala h GLN 127 Ca 0.33 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.97 1ala h GLN 127 Cb 0.53 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 1ala h GLN 127 CO -0.11 0.70 -0.01 0.28 -0.67 0.00 0.00 178.83 179.02 1ala h VAL 128 N -0.82 1.24 -0.13 -0.54 2.07 -1.00 -0.89 116.25 116.18 1ala h VAL 128 Ca -0.00 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.54 1ala h VAL 128 Cb 0.74 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1ala h VAL 128 CO 0.00 0.34 0.07 0.22 0.02 0.00 0.00 177.57 178.23 1ala h TYR 129 N 0.69 0.18 0.07 1.57 5.03 -0.71 0.33 116.97 124.13 1ala h TYR 129 Ca 0.14 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.45 1ala h TYR 129 Cb 0.43 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.64 1ala h TYR 129 CO 0.02 0.20 -0.10 1.98 -1.32 0.00 0.00 178.16 178.94 1ala h MET 130 N 0.12 -0.20 0.15 1.82 4.05 -1.21 0.18 114.93 119.83 1ala h MET 130 Ca 0.05 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1ala h MET 130 Cb 0.08 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 1ala h MET 130 CO -0.01 -0.14 -0.16 1.96 0.23 0.00 0.00 176.91 178.80 1ala h GLN 131 N -0.21 -0.33 0.02 0.39 4.20 -0.85 -1.34 115.11 116.99 1ala h GLN 131 Ca 0.01 0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 1ala h GLN 131 Cb 0.22 0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.08 1ala h GLN 131 CO -0.05 -0.22 -0.41 0.93 -0.67 0.00 0.00 178.83 178.41 1ala h GLU 132 N -0.34 0.25 -0.00 1.46 4.39 -0.35 -3.37 114.58 116.61 1ala h GLU 132 Ca 0.00 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1ala h GLU 132 Cb 0.33 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1ala h GLU 132 CO -0.04 1.02 -0.64 0.66 -1.16 0.00 0.00 179.01 178.85 1ala n TYR 133 N -4.38 0.00 -0.09 4.33 4.01 0.61 -4.97 117.16 116.68 1ala n TYR 133 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1ala n TYR 133 Cb 0.60 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.49 1ala n TYR 133 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1ala n GLU 134 N -1.31 0.00 -3.70 -0.72 1.02 -0.50 -4.99 120.64 110.44 1ala n GLU 134 Ca 0.06 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.00 1ala n GLU 134 Cb 0.34 -2.48 -0.03 0.00 -0.02 0.00 0.00 31.44 29.26 1ala n GLU 134 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ala s ALA 135 N -2.37 3.97 -0.21 0.62 0.00 -1.26 -4.94 121.76 117.57 1ala s ALA 135 Ca 0.00 -1.61 -0.23 0.00 0.00 0.00 0.00 51.96 50.12 1ala s ALA 135 Cb 0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.79 1ala s ALA 135 CO 0.00 -0.02 0.74 1.21 0.00 0.00 0.00 175.76 177.70 1ala s ASN 136 N -4.05 6.78 0.20 0.00 2.47 -1.26 -3.23 114.94 115.84 1ala s ASN 136 Ca 0.42 0.96 -0.16 0.00 0.42 0.00 0.00 52.86 54.51 1ala s ASN 136 Cb -0.07 -2.40 0.18 0.00 -1.45 0.00 0.00 41.25 37.52 1ala s ASN 136 CO 0.28 -0.40 1.63 0.25 -3.72 0.00 0.00 177.10 175.14 1ala h LEU 137 N 8.65 -0.63 -0.91 3.21 5.85 -1.92 -3.01 115.31 126.55 1ala h LEU 137 Ca -0.27 0.18 0.13 0.00 0.84 0.00 0.00 57.88 58.75 1ala h LEU 137 Cb 1.12 0.38 -0.09 0.00 0.37 0.00 0.00 40.66 42.45 1ala h LEU 137 CO 0.82 -0.21 0.53 -0.08 -0.34 0.00 0.00 178.44 179.15 1ala h GLU 138 N -0.04 0.77 -0.69 1.25 4.81 -1.96 -1.39 114.58 117.34 1ala h GLU 138 Ca 0.26 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1ala h GLU 138 Cb 0.44 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1ala h GLU 138 CO -0.59 0.51 0.27 -0.44 -0.73 0.00 0.00 179.01 178.02 1ala h ASP 139 N 0.79 0.93 0.28 1.04 3.32 -1.94 -2.61 116.42 118.23 1ala h ASP 139 Ca 0.47 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 1ala h ASP 139 Cb 0.57 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1ala h ASP 139 CO -0.31 0.84 -0.13 0.11 -1.72 0.00 0.00 179.24 178.03 1ala h LYS 140 N 1.00 -0.36 -0.64 3.56 1.79 -1.44 -2.16 116.57 118.31 1ala h LYS 140 Ca 0.23 0.02 0.11 0.00 -2.18 0.00 0.00 60.65 58.84 1ala h LYS 140 Cb 0.20 0.08 -0.08 0.00 -1.58 0.00 0.00 32.23 30.85 1ala h LYS 140 CO -0.02 -0.02 0.20 0.82 -1.08 0.00 0.00 179.45 179.35 1ala h ILE 141 N -0.85 0.68 0.00 1.86 2.04 -1.22 0.21 117.51 120.23 1ala h ILE 141 Ca -0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1ala h ILE 141 Cb 0.51 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1ala h ILE 141 CO 0.06 0.06 0.00 0.00 0.00 0.00 0.00 178.15 178.28 1ala h THR 142 N 0.35 0.00 0.00 -0.27 1.03 -1.53 0.49 112.91 112.97 1ala h THR 142 Ca 0.34 -0.11 -0.09 0.00 -0.01 0.00 0.00 66.41 66.54 1ala h THR 142 Cb 0.48 0.97 -0.02 0.00 -1.07 0.00 0.00 68.15 68.52 1ala h THR 142 CO -0.37 0.00 -1.72 0.61 -0.01 0.00 0.00 175.52 174.02 1ala n GLY 143 N -0.84 -1.14 0.07 2.99 0.00 0.65 -4.39 105.19 102.53 1ala n GLY 143 Ca -0.02 -0.35 0.01 0.00 0.00 0.00 0.00 46.02 45.67 1ala n GLY 143 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ala n GLU 144 N -2.55 0.65 -4.47 1.61 -0.58 -0.71 -4.99 120.64 109.60 1ala n GLU 144 Ca -0.09 0.04 -0.26 0.00 -0.42 0.00 0.00 57.16 56.43 1ala n GLU 144 Cb 0.70 -1.66 -0.10 0.00 -0.57 0.00 0.00 31.44 29.82 1ala n GLU 144 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1ala s THR 145 N -3.02 2.28 0.17 2.62 -4.23 0.08 -4.91 115.64 108.64 1ala s THR 145 Ca -0.06 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 58.30 1ala s THR 145 Cb 0.10 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1ala s THR 145 CO 0.84 -0.13 0.34 -0.94 -0.54 0.00 0.00 174.62 174.19 1ala s SER 146 N -3.69 -0.03 0.05 3.99 1.04 -1.26 -4.76 113.70 109.04 1ala s SER 146 Ca 0.35 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 56.00 1ala s SER 146 Cb 0.04 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1ala s SER 146 CO 0.18 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 174.08 1ala n GLY 147 N -0.24 -0.75 0.18 7.32 0.00 -1.26 -2.99 105.19 107.45 1ala n GLY 147 Ca -0.08 -1.17 0.06 0.00 0.00 0.00 0.00 46.02 44.83 1ala n GLY 147 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1ala h HIS 148 N 0.00 0.00 0.85 1.61 3.86 -2.00 -1.07 115.15 118.40 1ala h HIS 148 Ca 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 1ala h HIS 148 Cb 0.00 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.48 1ala h HIS 148 CO 0.00 0.38 -0.41 0.35 0.86 0.00 0.00 177.93 179.11 1ala h PHE 149 N 0.00 -1.05 -0.64 2.45 3.57 -1.95 0.79 116.94 120.11 1ala h PHE 149 Ca -0.00 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.60 1ala h PHE 149 Cb 0.96 0.35 -0.10 0.00 2.79 0.00 0.00 35.95 39.95 1ala h PHE 149 CO 0.00 -0.66 0.12 0.37 -2.23 0.00 0.00 178.31 175.91 1ala h GLN 150 N -1.25 0.23 -0.06 1.11 4.15 -1.42 -1.65 115.11 116.22 1ala h GLN 150 Ca -0.12 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.18 1ala h GLN 150 Cb 0.87 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 1ala h GLN 150 CO 0.19 0.15 -0.48 0.07 -1.93 0.00 0.00 178.83 176.83 1ala h ARG 151 N 0.24 0.15 -0.34 1.69 -0.00 -0.99 -2.25 114.38 112.87 1ala h ARG 151 Ca 0.34 -0.08 -0.13 0.00 -0.00 0.00 0.00 59.98 60.11 1ala h ARG 151 Cb 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.50 1ala h ARG 151 CO -0.45 0.60 -0.31 1.25 -0.00 0.00 0.00 179.97 181.06 1ala h LEU 152 N 0.12 0.77 -0.82 0.08 5.85 0.08 -1.08 115.31 120.31 1ala h LEU 152 Ca 0.00 -0.31 -0.10 0.00 0.84 0.00 0.00 57.88 58.32 1ala h LEU 152 Cb 0.90 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1ala h LEU 152 CO 0.07 1.02 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.95 1ala h LEU 153 N 0.63 0.70 -0.45 2.25 3.38 -1.27 -1.95 115.31 118.59 1ala h LEU 153 Ca 0.07 -0.22 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 1ala h LEU 153 Cb 0.83 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1ala h LEU 153 CO 0.07 0.88 -0.27 0.58 0.09 0.00 0.00 178.44 179.78 1ala h VAL 154 N 0.63 1.27 -0.09 1.22 2.07 -1.20 0.09 116.25 120.24 1ala h VAL 154 Ca 0.10 -1.44 0.02 0.00 0.82 0.00 0.00 66.70 66.19 1ala h VAL 154 Cb 0.64 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1ala h VAL 154 CO 0.04 0.49 -0.03 0.58 0.02 0.00 0.00 177.57 178.68 1ala h VAL 155 N 0.83 0.89 -0.81 2.57 2.07 -0.92 -2.73 116.25 118.15 1ala h VAL 155 Ca 0.09 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.63 1ala h VAL 155 Cb 0.86 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1ala h VAL 155 CO 0.08 0.00 0.54 -0.07 0.02 0.00 0.00 177.57 178.13 1ala h LEU 156 N -0.02 0.91 -1.69 2.57 3.38 -1.20 -2.14 115.31 117.13 1ala h LEU 156 Ca 0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1ala h LEU 156 Cb 0.08 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1ala h LEU 156 CO -0.10 0.65 -0.11 0.25 0.09 0.00 0.00 178.44 179.22 1ala h LEU 157 N 1.07 0.00 -1.34 1.67 5.85 -0.69 -2.72 115.31 119.15 1ala h LEU 157 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1ala h LEU 157 Cb -0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.94 1ala h LEU 157 CO -0.07 0.11 0.00 1.56 -0.34 0.00 0.00 178.44 179.70 1ala h GLN 158 N 0.00 0.00 -6.73 1.25 1.08 -1.10 -3.47 115.11 106.14 1ala h GLN 158 Ca -0.00 0.00 -0.55 0.00 -1.45 0.00 0.00 58.65 56.65 1ala h GLN 158 Cb 0.46 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 27.75 1ala h GLN 158 CO 0.01 0.00 -0.89 0.00 -0.95 0.00 0.00 178.83 177.00 1ala n ALA 159 N -1.99 -1.79 -1.70 3.87 0.00 -1.03 -4.89 120.51 112.98 1ala n ALA 159 Ca 0.01 -0.24 0.06 0.00 0.00 0.00 0.00 53.44 53.27 1ala n ALA 159 Cb 0.26 -1.86 0.16 0.00 0.00 0.00 0.00 19.45 18.01 1ala n ALA 159 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ala n ASN 160 N -2.86 1.60 -4.70 0.00 3.02 -1.26 -4.88 115.26 106.18 1ala n ASN 160 Ca -0.20 -3.35 -0.32 0.00 -0.03 0.00 0.00 54.58 50.67 1ala n ASN 160 Cb 0.63 -0.46 0.13 0.00 -0.61 0.00 0.00 39.78 39.47 1ala n ASN 160 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1ala s ARG 161 N -2.45 1.59 0.94 3.52 3.52 -1.26 -4.92 118.95 119.89 1ala s ARG 161 Ca 0.35 1.59 -0.11 0.00 -0.13 0.00 0.00 55.73 57.43 1ala s ARG 161 Cb 0.34 -1.79 0.16 0.00 -1.56 0.00 0.00 34.95 32.10 1ala s ARG 161 CO -0.07 -2.21 1.09 -0.51 -0.81 0.00 0.00 175.30 172.79 1ala s ASP 162 N -2.50 2.93 0.27 -2.12 1.01 0.23 -4.88 116.67 111.60 1ala s ASP 162 Ca 0.69 1.74 -0.19 0.00 0.71 0.00 0.00 52.55 55.49 1ala s ASP 162 Cb -0.25 -2.36 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 1ala s ASP 162 CO 0.53 -3.02 0.76 -2.16 0.21 0.00 0.00 175.17 171.49 1ala s PRO 163 N -4.75 4.22 -0.56 8.23 0.04 -1.26 -3.78 135.00 137.13 1ala s PRO 163 Ca 0.65 0.88 -0.27 0.00 0.04 0.00 0.00 61.00 62.29 1ala s PRO 163 Cb -0.21 -2.73 -0.00 0.00 0.04 0.00 0.00 34.50 31.60 1ala s PRO 163 CO 0.59 0.30 1.60 -0.51 0.04 0.00 0.00 177.00 179.02 1ala s ASP 164 N -1.82 5.81 0.00 6.66 1.01 -1.26 -4.73 116.67 122.33 1ala s ASP 164 Ca 0.47 0.37 0.00 0.00 0.71 0.00 0.00 52.55 54.10 1ala s ASP 164 Cb -0.15 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1ala s ASP 164 CO 0.20 -1.95 0.00 0.61 0.21 0.00 0.00 175.17 174.24 1ala n GLY 165 N 5.44 4.69 3.70 0.21 0.00 -1.26 -5.11 105.19 112.86 1ala n GLY 165 Ca 0.16 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1ala n GLY 165 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ala s ARG 166 N 3.72 4.32 -0.20 1.61 0.52 -1.26 -5.02 118.95 122.65 1ala s ARG 166 Ca 0.00 1.94 -0.09 0.00 -0.52 0.00 0.00 55.73 57.06 1ala s ARG 166 Cb 0.00 -3.45 -0.05 0.00 0.52 0.00 0.00 34.95 31.98 1ala s ARG 166 CO 0.00 -0.47 0.12 0.08 0.02 0.00 0.00 175.30 175.04 1ala s VAL 167 N 1.81 5.24 -0.34 3.52 1.01 -1.26 -5.03 120.40 125.35 1ala s VAL 167 Ca 0.63 0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.60 1ala s VAL 167 Cb -0.32 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1ala s VAL 167 CO 0.28 0.44 0.27 -0.70 0.00 0.00 0.00 175.10 175.38 1ala s GLU 168 N 0.44 3.50 0.61 2.72 2.12 -1.26 -4.93 118.70 121.90 1ala s GLU 168 Ca 0.07 -0.61 0.37 0.00 0.36 0.00 0.00 54.97 55.16 1ala s GLU 168 Cb -0.12 -3.81 1.99 0.00 0.26 0.00 0.00 34.13 32.45 1ala s GLU 168 CO -0.01 -0.46 2.24 0.93 -0.54 0.00 0.00 175.26 177.42 1ala h GLU 169 N 8.49 0.00 -0.31 4.30 3.07 -1.98 -1.37 114.58 126.78 1ala h GLU 169 Ca -0.31 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.45 1ala h GLU 169 Cb 1.15 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.06 1ala h GLU 169 CO 0.65 0.02 -0.19 0.00 -1.40 0.00 0.00 179.01 178.09 1ala h ALA 170 N 1.98 0.44 -0.42 3.43 0.00 -1.97 0.36 119.26 123.07 1ala h ALA 170 Ca -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 1ala h ALA 170 Cb 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ala h ALA 170 CO 0.00 0.37 -0.05 1.25 0.00 0.00 0.00 179.25 180.82 1ala h LEU 171 N 0.42 0.78 -1.00 0.00 5.85 -1.77 0.35 115.31 119.95 1ala h LEU 171 Ca 0.06 -0.34 0.12 0.00 0.84 0.00 0.00 57.88 58.57 1ala h LEU 171 Cb 0.73 -0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.46 1ala h LEU 171 CO 0.05 0.93 0.62 0.58 -0.34 0.00 0.00 178.44 180.29 1ala h VAL 172 N 0.61 0.91 -0.22 1.05 2.07 -1.12 -0.55 116.25 119.00 1ala h VAL 172 Ca 0.11 -0.34 -0.19 0.00 0.82 0.00 0.00 66.70 67.11 1ala h VAL 172 Cb 0.56 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1ala h VAL 172 CO 0.03 0.18 -0.60 -0.08 0.02 0.00 0.00 177.57 177.12 1ala h GLU 173 N 0.98 0.79 0.03 1.57 4.81 -0.30 -1.80 114.58 120.65 1ala h GLU 173 Ca 0.50 -0.56 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1ala h GLU 173 Cb 0.50 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1ala h GLU 173 CO -0.27 1.18 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.96 1ala h LYS 174 N 0.54 -0.03 -0.51 1.92 3.64 0.45 -2.97 116.57 119.60 1ala h LYS 174 Ca -0.01 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1ala h LYS 174 Cb 1.22 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.01 1ala h LYS 174 CO 0.13 0.10 0.30 -0.44 -2.27 0.00 0.00 179.45 177.27 1ala h ASP 175 N -0.16 0.48 -0.83 4.20 3.32 -1.16 -2.17 116.42 120.11 1ala h ASP 175 Ca -0.00 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ala h ASP 175 Cb 0.15 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 1ala h ASP 175 CO 0.01 0.34 0.50 0.00 -1.72 0.00 0.00 179.24 178.37 1ala h ALA 176 N 1.23 1.05 -0.32 3.45 0.00 -1.36 -1.83 119.26 121.48 1ala h ALA 176 Ca 0.21 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1ala h ALA 176 Cb 0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1ala h ALA 176 CO -0.10 0.51 -0.10 1.96 0.00 0.00 0.00 179.25 181.52 1ala h GLN 177 N 1.13 0.53 0.05 0.00 1.08 -1.32 -1.86 115.11 114.72 1ala h GLN 177 Ca 0.30 -0.15 -0.23 0.00 -1.45 0.00 0.00 58.65 57.12 1ala h GLN 177 Cb -0.05 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 1ala h GLN 177 CO -0.06 0.63 -1.05 -0.39 -0.95 0.00 0.00 178.83 177.02 1ala h VAL 178 N 0.49 1.54 -0.07 -0.54 -1.51 -0.90 -3.13 116.25 112.14 1ala h VAL 178 Ca 0.09 -2.95 -0.13 0.00 -1.23 0.00 0.00 66.70 62.47 1ala h VAL 178 Cb 0.47 2.73 -0.01 0.00 -2.13 0.00 0.00 31.29 32.35 1ala h VAL 178 CO 0.03 0.86 -0.56 -0.07 -1.23 0.00 0.00 177.57 176.59 1ala h LEU 179 N 0.08 0.23 -0.15 4.19 3.38 -1.22 -2.20 115.31 119.62 1ala h LEU 179 Ca -0.07 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.82 1ala h LEU 179 Cb 1.74 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.38 1ala h LEU 179 CO 0.16 0.74 -0.16 0.15 0.09 0.00 0.00 178.44 179.43 1ala h PHE 180 N 0.16 -0.40 -0.39 1.13 3.57 -1.40 0.34 116.94 119.94 1ala h PHE 180 Ca -0.00 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.44 1ala h PHE 180 Cb 1.04 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 1ala h PHE 180 CO 0.02 -0.23 -0.10 0.00 -2.23 0.00 0.00 178.31 175.77 1ala h ARG 181 N -0.19 0.76 0.00 1.11 -0.00 -1.49 -2.33 114.38 112.24 1ala h ARG 181 Ca 0.10 -0.29 -0.12 0.00 -0.50 0.00 0.00 59.98 59.17 1ala h ARG 181 Cb 0.34 -0.04 -0.02 0.00 0.00 0.00 0.00 29.97 30.25 1ala h ARG 181 CO -0.26 0.90 -0.55 0.00 0.00 0.00 0.00 179.97 180.05 1ala h ALA 182 N 0.84 0.99 -0.45 0.04 0.00 -1.18 -2.60 119.26 116.90 1ala h ALA 182 Ca 0.10 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1ala h ALA 182 Cb 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1ala h ALA 182 CO 0.04 0.69 0.23 0.78 0.00 0.00 0.00 179.25 180.99 1ala h GLY 183 N 1.90 0.69 2.00 0.00 0.00 -0.14 0.33 103.07 107.85 1ala h GLY 183 Ca -0.01 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 1ala h GLY 183 CO 0.07 0.32 -0.32 0.83 0.00 0.00 0.00 176.54 177.44 1ala h GLU 184 N 0.59 0.00 -0.34 4.80 4.39 -1.35 -1.54 114.58 121.13 1ala h GLU 184 Ca 0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1ala h GLU 184 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1ala h GLU 184 CO -0.02 0.32 0.00 1.28 -1.16 0.00 0.00 179.01 179.43 1ala n LEU 185 N -4.09 1.90 -1.76 1.33 4.77 -0.81 -4.92 117.00 113.42 1ala n LEU 185 Ca -0.02 -0.93 -0.14 0.00 -0.03 0.00 0.00 56.01 54.88 1ala n LEU 185 Cb 0.37 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1ala n LEU 185 CO 0.38 0.47 -0.13 0.29 -1.33 0.00 0.00 177.39 177.07 1ala n LYS 186 N 0.53 -1.77 -2.33 3.23 4.76 -0.58 -2.08 118.16 119.92 1ala n LYS 186 Ca 0.13 0.67 -0.14 0.00 -2.87 0.00 0.00 58.31 56.09 1ala n LYS 186 Cb 0.31 -4.94 -0.01 0.00 -1.84 0.00 0.00 35.03 28.55 1ala n LYS 186 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1ala n TRP 187 N -4.04 -1.23 0.08 2.13 7.02 0.04 -4.85 117.44 116.60 1ala n TRP 187 Ca -0.14 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.26 1ala n TRP 187 Cb 0.61 -2.98 -0.06 0.00 -2.42 0.00 0.00 31.31 26.46 1ala n TRP 187 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1ala h GLY 188 N 0.00 0.11 -2.00 6.99 0.00 -1.58 -3.47 103.07 103.12 1ala h GLY 188 Ca -0.33 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 46.70 1ala h GLY 188 CO 0.40 0.21 -0.02 -0.51 0.00 0.00 0.00 176.54 176.61 1ala s THR 189 N -2.93 0.00 -1.16 4.70 -4.23 -1.26 -4.85 115.64 105.90 1ala s THR 189 Ca -0.01 -1.32 -0.04 0.00 -1.18 0.00 0.00 61.69 59.14 1ala s THR 189 Cb 0.10 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.64 1ala s THR 189 CO 0.83 0.00 0.99 0.47 -0.54 0.00 0.00 174.62 176.37 1ala n ASP 190 N -0.65 -4.12 -0.16 3.99 8.00 -1.26 -4.80 116.55 117.54 1ala n ASP 190 Ca -0.02 -0.52 -0.11 0.00 0.71 0.00 0.00 54.79 54.85 1ala n ASP 190 Cb 0.61 -4.64 0.01 0.00 -0.02 0.00 0.00 41.12 37.08 1ala n ASP 190 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1ala h GLU 191 N -2.11 1.00 -0.94 -1.24 3.07 -1.91 -2.99 114.58 109.46 1ala h GLU 191 Ca -0.52 -0.41 0.21 0.00 -0.50 0.00 0.00 59.36 58.13 1ala h GLU 191 Cb 1.32 -0.04 -0.08 0.00 -0.84 0.00 0.00 28.75 29.11 1ala h GLU 191 CO 0.48 1.09 0.61 1.49 -1.40 0.00 0.00 179.01 181.28 1ala h GLU 192 N 0.87 0.47 0.03 2.33 4.81 -2.00 -1.14 114.58 119.95 1ala h GLU 192 Ca 0.12 -0.03 -0.25 0.00 -0.13 0.00 0.00 59.36 59.07 1ala h GLU 192 Cb 0.76 -0.11 0.02 0.00 0.63 0.00 0.00 28.75 30.06 1ala h GLU 192 CO 0.06 0.31 -0.98 1.15 -0.73 0.00 0.00 179.01 178.83 1ala h THR 193 N 0.49 1.32 0.00 0.32 2.02 -1.91 -3.23 112.91 111.91 1ala h THR 193 Ca 0.51 -2.25 0.00 0.00 0.77 0.00 0.00 66.41 65.43 1ala h THR 193 Cb 1.14 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 70.07 1ala h THR 193 CO -0.23 0.69 -0.09 2.19 0.37 0.00 0.00 175.52 178.45 1ala h PHE 194 N 0.24 0.00 -0.06 3.16 -5.15 -1.47 -2.84 116.94 110.82 1ala h PHE 194 Ca -0.13 0.00 -0.21 0.00 -0.20 0.00 0.00 57.97 57.43 1ala h PHE 194 Cb 1.65 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.83 1ala h PHE 194 CO 0.12 0.00 -0.83 0.82 -2.00 0.00 0.00 178.31 176.42 1ala h ILE 195 N 0.00 1.36 -0.10 0.88 2.04 -1.30 -2.33 117.51 118.06 1ala h ILE 195 Ca 0.00 -2.22 -0.01 0.00 1.00 0.00 0.00 64.86 63.63 1ala h ILE 195 Cb 0.78 2.20 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1ala h ILE 195 CO 0.00 0.67 0.02 0.74 0.00 0.00 0.00 178.15 179.58 1ala h THR 196 N 0.32 1.20 0.19 -0.27 2.02 -1.57 -0.44 112.91 114.36 1ala h THR 196 Ca -0.06 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1ala h THR 196 Cb 1.44 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 1ala h THR 196 CO 0.15 0.18 -0.09 0.40 0.37 0.00 0.00 175.52 176.53 1ala h ILE 197 N -0.05 0.89 -0.06 3.11 2.04 -1.55 -2.59 117.51 119.31 1ala h ILE 197 Ca 0.03 -0.85 -0.17 0.00 1.00 0.00 0.00 64.86 64.87 1ala h ILE 197 Cb 0.26 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1ala h ILE 197 CO 0.00 0.18 -0.69 -0.07 0.00 0.00 0.00 178.15 177.58 1ala h LEU 198 N -0.71 0.32 0.12 1.44 3.38 -1.50 -2.86 115.31 115.50 1ala h LEU 198 Ca -0.03 -0.21 -0.28 0.00 0.09 0.00 0.00 57.88 57.46 1ala h LEU 198 Cb 0.49 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1ala h LEU 198 CO 0.04 0.91 -1.30 1.23 0.09 0.00 0.00 178.44 179.41 1ala h GLY 199 N 1.50 0.30 0.00 0.83 0.00 -1.19 -3.42 103.07 101.09 1ala h GLY 199 Ca -0.02 -0.76 -0.07 0.00 0.00 0.00 0.00 47.33 46.48 1ala h GLY 199 CO 0.11 0.67 -1.76 -1.30 0.00 0.00 0.00 176.54 174.26 1ala n THR 200 N -3.51 0.27 -2.16 4.70 -2.24 -0.97 -4.55 114.28 105.81 1ala n THR 200 Ca -0.10 -0.41 -0.34 0.00 -2.27 0.00 0.00 64.05 60.93 1ala n THR 200 Cb 1.03 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 1ala n THR 200 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ala s ARG 201 N -2.84 3.35 1.14 -0.78 1.81 -1.08 0.74 118.95 121.29 1ala s ARG 201 Ca -0.06 1.36 -0.14 0.00 -1.72 0.00 0.00 55.73 55.17 1ala s ARG 201 Cb 0.08 -2.03 0.23 0.00 -0.45 0.00 0.00 34.95 32.79 1ala s ARG 201 CO 0.61 -0.81 0.78 -1.13 -0.68 0.00 0.00 175.30 174.07 1ala n SER 202 N -1.69 -1.75 0.06 0.23 3.41 -1.25 -4.33 113.62 108.31 1ala n SER 202 Ca 0.10 -0.10 -0.10 0.00 -0.26 0.00 0.00 58.87 58.52 1ala n SER 202 Cb 0.52 -1.21 0.03 0.00 -0.26 0.00 0.00 64.21 63.29 1ala n SER 202 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1ala h VAL 203 N -2.47 1.40 -0.34 -3.33 2.07 -1.93 -2.80 116.25 108.85 1ala h VAL 203 Ca -0.58 -2.22 -0.12 0.00 0.82 0.00 0.00 66.70 64.59 1ala h VAL 203 Cb 1.33 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 1ala h VAL 203 CO 0.46 0.66 -0.28 0.77 0.02 0.00 0.00 177.57 179.20 1ala h SER 204 N 0.24 0.74 -0.29 0.57 4.64 -1.94 -1.93 113.55 115.58 1ala h SER 204 Ca -0.04 -0.28 -0.08 0.00 -0.47 0.00 0.00 61.79 60.92 1ala h SER 204 Cb 1.34 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 1ala h SER 204 CO 0.13 0.98 -0.12 -0.74 -0.87 0.00 0.00 176.83 176.20 1ala h HIS 205 N 0.62 0.67 -0.06 4.77 6.17 -1.91 -2.96 115.15 122.45 1ala h HIS 205 Ca 0.08 -0.16 -0.14 0.00 0.71 0.00 0.00 60.37 60.86 1ala h HIS 205 Cb 0.79 -0.16 -0.01 0.00 2.52 0.00 0.00 27.41 30.55 1ala h HIS 205 CO 0.04 0.82 -0.58 -0.07 0.71 0.00 0.00 177.93 178.85 1ala h LEU 206 N 0.34 0.22 -1.10 0.26 3.38 -1.33 -2.83 115.31 114.25 1ala h LEU 206 Ca 0.07 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1ala h LEU 206 Cb 0.63 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1ala h LEU 206 CO 0.04 0.75 -0.06 0.03 0.09 0.00 0.00 178.44 179.29 1ala h ARG 207 N 0.15 0.56 -0.45 1.13 3.08 -1.37 -0.91 114.38 116.57 1ala h ARG 207 Ca -0.00 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 59.79 1ala h ARG 207 Cb 1.06 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 1ala h ARG 207 CO 0.09 0.63 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.38 1ala h ARG 208 N 0.53 0.89 0.25 0.04 9.65 -1.34 -2.38 114.38 122.01 1ala h ARG 208 Ca 0.10 -0.36 -0.01 0.00 -1.10 0.00 0.00 59.98 58.61 1ala h ARG 208 Cb 0.43 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.98 1ala h ARG 208 CO 0.02 1.01 -0.12 0.28 2.80 0.00 0.00 179.97 183.96 1ala h VAL 209 N 0.72 0.79 -0.55 0.20 2.07 -1.34 -2.53 116.25 115.62 1ala h VAL 209 Ca 0.11 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 1ala h VAL 209 Cb 0.71 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1ala h VAL 209 CO 0.05 0.04 0.13 -0.26 0.02 0.00 0.00 177.57 177.55 1ala h PHE 210 N -0.42 0.87 -0.11 1.57 0.04 -1.11 0.23 116.94 118.00 1ala h PHE 210 Ca -0.03 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 1ala h PHE 210 Cb 0.32 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1ala h PHE 210 CO -0.04 0.73 0.04 -0.44 -0.60 0.00 0.00 178.31 178.01 1ala h ASP 211 N 0.81 0.16 -0.22 2.17 3.32 -1.21 -2.26 116.42 119.19 1ala h ASP 211 Ca 0.18 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ala h ASP 211 Cb 0.30 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1ala h ASP 211 CO -0.00 0.28 0.15 0.50 -1.72 0.00 0.00 179.24 178.44 1ala h LYS 212 N 0.02 0.29 -0.19 3.56 1.63 -1.27 -2.01 116.57 118.60 1ala h LYS 212 Ca 0.04 -0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.87 1ala h LYS 212 Cb 0.17 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 31.68 1ala h LYS 212 CO -0.00 0.20 -0.17 -0.92 -3.45 0.00 0.00 179.45 175.10 1ala h TYR 213 N 0.30 -0.43 -0.84 1.91 5.03 -0.42 -0.89 116.97 121.64 1ala h TYR 213 Ca 0.08 0.03 0.08 0.00 2.58 0.00 0.00 58.73 61.50 1ala h TYR 213 Cb -0.03 0.22 -0.06 0.00 1.55 0.00 0.00 36.73 38.41 1ala h TYR 213 CO -0.06 -0.24 0.54 1.98 -1.32 0.00 0.00 178.16 179.06 1ala h MET 214 N -0.18 0.85 0.00 1.82 4.05 -1.17 -2.23 114.93 118.07 1ala h MET 214 Ca 0.12 -0.05 -0.06 0.00 -0.28 0.00 0.00 59.70 59.42 1ala h MET 214 Cb 0.36 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.96 1ala h MET 214 CO -0.30 0.56 -0.31 1.79 0.23 0.00 0.00 176.91 178.88 1ala h THR 215 N 0.87 0.68 0.00 -0.77 1.35 -0.43 -1.18 112.91 113.43 1ala h THR 215 Ca 0.37 -1.41 -0.01 0.00 -0.55 0.00 0.00 66.41 64.80 1ala h THR 215 Cb 0.30 1.93 -0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1ala h THR 215 CO -0.14 0.30 -0.09 0.40 -0.25 0.00 0.00 175.52 175.74 1ala h ILE 216 N 0.00 1.25 0.20 6.82 2.04 -0.78 -3.41 117.51 123.64 1ala h ILE 216 Ca -0.00 -1.97 -0.31 0.00 1.00 0.00 0.00 64.86 63.57 1ala h ILE 216 Cb 0.90 2.40 0.02 0.00 -0.74 0.00 0.00 36.82 39.40 1ala h ILE 216 CO 0.04 0.43 -1.48 0.77 0.00 0.00 0.00 178.15 177.91 1ala h SER 217 N -1.00 0.65 0.00 1.72 4.64 -1.61 -3.49 113.55 114.46 1ala h SER 217 Ca -0.02 -0.92 0.00 0.00 -0.47 0.00 0.00 61.79 60.38 1ala h SER 217 Cb 0.76 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1ala h SER 217 CO -0.01 1.68 0.00 0.61 -0.87 0.00 0.00 176.83 178.24 1ala n GLY 218 N 1.77 0.59 3.28 -0.77 0.00 -0.45 -5.04 105.19 104.58 1ala n GLY 218 Ca -0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 1ala n GLY 218 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ala s PHE 219 N -2.32 1.63 0.19 1.61 0.08 -1.26 -5.03 117.98 112.89 1ala s PHE 219 Ca 0.00 -0.49 -0.28 0.00 0.12 0.00 0.00 56.93 56.28 1ala s PHE 219 Cb 0.00 -0.85 -0.08 0.00 -0.57 0.00 0.00 43.02 41.52 1ala s PHE 219 CO 0.00 0.23 0.87 -0.65 -0.10 0.00 0.00 175.22 175.57 1ala s GLN 220 N -2.51 4.72 0.43 0.44 -1.52 -1.26 -3.79 119.66 116.16 1ala s GLN 220 Ca 0.10 1.34 0.22 0.00 -1.95 0.00 0.00 55.36 55.07 1ala s GLN 220 Cb -0.07 -3.28 1.19 0.00 -0.22 0.00 0.00 33.01 30.63 1ala s GLN 220 CO 0.05 0.51 1.78 0.97 -0.25 0.00 0.00 175.29 178.34 1ala h ILE 221 N 3.33 0.50 0.00 1.08 2.10 -1.94 0.26 117.51 122.84 1ala h ILE 221 Ca -0.46 -0.11 -0.07 0.00 1.08 0.00 0.00 64.86 65.31 1ala h ILE 221 Cb 1.20 0.16 -0.01 0.00 -1.09 0.00 0.00 36.82 37.09 1ala h ILE 221 CO 0.68 0.06 -0.33 -0.33 -1.08 0.00 0.00 178.15 177.15 1ala h GLU 222 N 0.31 0.00 0.00 2.19 3.07 -1.93 -2.39 114.58 115.83 1ala h GLU 222 Ca 0.59 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.41 1ala h GLU 222 Cb 1.64 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.55 1ala h GLU 222 CO -0.24 0.33 -0.17 0.93 -1.40 0.00 0.00 179.01 178.46 1ala h GLU 223 N 0.00 0.00 -0.87 2.33 5.08 -1.32 -2.63 114.58 117.16 1ala h GLU 223 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1ala h GLU 223 Cb 0.83 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1ala h GLU 223 CO 0.04 0.17 0.05 0.25 -1.00 0.00 0.00 179.01 178.52 1ala n THR 224 N -3.46 1.22 -3.69 1.13 -2.24 -0.90 -4.76 114.28 101.58 1ala n THR 224 Ca -0.01 -0.58 -0.12 0.00 -2.27 0.00 0.00 64.05 61.07 1ala n THR 224 Cb 0.34 -0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 67.95 1ala n THR 224 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1ala s ILE 225 N -1.59 -0.28 -0.17 2.28 1.01 -0.99 -4.91 121.20 116.55 1ala s ILE 225 Ca 0.21 0.21 -0.27 0.00 0.00 0.00 0.00 60.65 60.80 1ala s ILE 225 Cb 0.16 -0.46 -0.01 0.00 0.01 0.00 0.00 42.46 42.17 1ala s ILE 225 CO 0.06 0.09 0.93 -0.62 0.00 0.00 0.00 174.94 175.39 1ala s ASP 226 N 1.96 7.05 0.01 3.58 2.15 -1.26 -4.96 116.67 125.20 1ala s ASP 226 Ca -0.04 1.30 -0.11 0.00 0.43 0.00 0.00 52.55 54.14 1ala s ASP 226 Cb -0.11 -2.50 -0.06 0.00 -0.30 0.00 0.00 42.92 39.95 1ala s ASP 226 CO -0.09 -0.49 0.91 0.08 -0.17 0.00 0.00 175.17 175.41 1ala h ARG 227 N 7.33 -0.38 -0.18 4.34 0.11 -1.91 -3.35 114.38 120.34 1ala h ARG 227 Ca -0.27 0.03 0.04 0.00 0.10 0.00 0.00 59.98 59.88 1ala h ARG 227 Cb 1.11 0.09 -0.05 0.00 1.11 0.00 0.00 29.97 32.23 1ala h ARG 227 CO 0.88 -0.25 -0.11 1.05 0.10 0.00 0.00 179.97 181.64 1ala h GLU 228 N -0.49 -0.10 0.00 0.08 4.11 -2.03 -3.42 114.58 112.73 1ala h GLU 228 Ca -0.04 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1ala h GLU 228 Cb 0.30 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ala h GLU 228 CO 0.07 -0.06 0.00 -2.37 0.07 0.00 0.00 179.01 176.71 1ala n THR 229 N -5.26 0.00 -1.67 -1.06 5.66 -1.26 -5.07 114.28 105.63 1ala n THR 229 Ca -0.02 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.89 1ala n THR 229 Cb 0.18 -0.89 0.06 0.00 -1.55 0.00 0.00 70.33 68.13 1ala n THR 229 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1ala n SER 230 N 0.00 0.18 -0.03 1.09 7.64 -1.26 -5.01 113.62 116.23 1ala n SER 230 Ca 0.00 -1.24 0.00 0.00 1.01 0.00 0.00 58.87 58.64 1ala n SER 230 Cb 0.00 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1ala n SER 230 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ala n GLY 231 N 2.16 0.06 0.25 0.23 0.00 -1.26 -4.66 105.19 101.97 1ala n GLY 231 Ca 0.06 -1.22 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 1ala n GLY 231 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ala h ASP 232 N 0.00 0.96 -0.06 1.61 3.32 -1.99 -2.42 116.42 117.84 1ala h ASP 232 Ca 0.00 -0.48 -0.11 0.00 0.02 0.00 0.00 57.03 56.46 1ala h ASP 232 Cb 0.00 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1ala h ASP 232 CO 0.00 1.24 -0.30 0.25 -1.72 0.00 0.00 179.24 178.71 1ala h LEU 233 N 0.69 0.54 -0.01 1.55 5.85 -1.95 -0.07 115.31 121.91 1ala h LEU 233 Ca 0.05 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 1ala h LEU 233 Cb 0.99 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 1ala h LEU 233 CO 0.10 0.82 0.00 -0.33 -0.34 0.00 0.00 178.44 178.69 1ala h GLU 234 N 0.46 0.01 -0.95 1.25 3.07 -1.83 0.40 114.58 116.99 1ala h GLU 234 Ca 0.06 -0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.98 1ala h GLU 234 Cb 0.76 -0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.60 1ala h GLU 234 CO 0.06 0.12 0.60 0.87 -1.40 0.00 0.00 179.01 179.27 1ala h LYS 235 N -0.10 1.06 -0.05 2.33 6.56 -1.36 -0.86 116.57 124.15 1ala h LYS 235 Ca 0.00 -0.06 -0.08 0.00 -1.06 0.00 0.00 60.65 59.45 1ala h LYS 235 Cb 0.11 -0.24 0.00 0.00 -0.57 0.00 0.00 32.23 31.54 1ala h LYS 235 CO -0.00 0.70 -0.29 1.25 -2.06 0.00 0.00 179.45 179.06 1ala h LEU 236 N 1.10 0.35 -0.72 2.94 5.85 -0.10 -2.31 115.31 122.41 1ala h LEU 236 Ca 0.41 -0.66 0.14 0.00 0.84 0.00 0.00 57.88 58.61 1ala h LEU 236 Cb 0.17 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.01 1ala h LEU 236 CO -0.17 0.95 0.25 -0.07 -0.34 0.00 0.00 178.44 179.06 1ala h LEU 237 N -0.24 0.19 -0.36 2.25 4.07 0.18 -1.55 115.31 119.86 1ala h LEU 237 Ca -0.02 0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 1ala h LEU 237 Cb 0.95 0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.78 1ala h LEU 237 CO 0.06 0.07 0.14 0.25 -1.08 0.00 0.00 178.44 177.88 1ala h LEU 238 N 0.39 0.49 -0.62 1.67 5.85 -1.22 -0.37 115.31 121.50 1ala h LEU 238 Ca 0.39 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 1ala h LEU 238 Cb 0.60 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1ala h LEU 238 CO -0.41 0.53 0.11 0.00 -0.34 0.00 0.00 178.44 178.33 1ala h ALA 239 N 0.98 0.82 -0.05 1.25 0.00 -0.78 -2.61 119.26 118.88 1ala h ALA 239 Ca 0.12 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ala h ALA 239 Cb 0.19 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1ala h ALA 239 CO -0.01 0.57 0.01 0.28 0.00 0.00 0.00 179.25 180.11 1ala h VAL 240 N 0.93 1.18 -0.52 0.00 2.07 -1.10 -1.74 116.25 117.07 1ala h VAL 240 Ca 0.19 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.27 1ala h VAL 240 Cb 0.42 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.56 1ala h VAL 240 CO 0.01 0.15 0.13 0.58 0.02 0.00 0.00 177.57 178.46 1ala h VAL 241 N -0.13 0.74 -0.03 2.57 2.07 -1.02 0.54 116.25 121.00 1ala h VAL 241 Ca 0.02 -0.09 -0.15 0.00 0.82 0.00 0.00 66.70 67.30 1ala h VAL 241 Cb 0.22 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1ala h VAL 241 CO -0.00 0.05 -0.65 0.11 0.02 0.00 0.00 177.57 177.10 1ala h LYS 242 N 0.28 0.12 -0.02 1.57 1.57 -1.44 -2.59 116.57 116.05 1ala h LYS 242 Ca 0.26 -0.09 -0.16 0.00 -1.87 0.00 0.00 60.65 58.79 1ala h LYS 242 Cb 0.34 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1ala h LYS 242 CO -0.32 0.72 -0.72 0.00 -0.57 0.00 0.00 179.45 178.56 1ala h ILE 244 N 0.09 1.15 0.03 0.00 5.03 -0.73 -3.12 117.51 119.96 1ala h ILE 244 Ca -0.02 -0.30 -0.07 0.00 -0.12 0.00 0.00 64.86 64.35 1ala h ILE 244 Cb 1.28 0.36 0.01 0.00 -3.03 0.00 0.00 36.82 35.44 1ala h ILE 244 CO 0.11 0.15 -0.29 0.03 -0.68 0.00 0.00 178.15 177.46 1ala h ARG 245 N 0.74 0.15 -1.40 2.37 3.08 -1.41 -3.47 114.38 114.45 1ala h ARG 245 Ca 0.20 -0.20 0.12 0.00 0.07 0.00 0.00 59.98 60.17 1ala h ARG 245 Cb -0.06 0.06 -0.21 0.00 0.08 0.00 0.00 29.97 29.84 1ala h ARG 245 CO -0.04 1.00 -0.04 0.45 -1.07 0.00 0.00 179.97 180.27 1ala s SER 246 N -6.41 -0.99 0.11 7.04 0.15 -0.16 -5.06 113.70 108.38 1ala s SER 246 Ca -0.16 1.13 -0.18 0.00 0.70 0.00 0.00 55.95 57.44 1ala s SER 246 Cb -0.00 2.03 -0.04 0.00 -1.71 0.00 0.00 66.02 66.30 1ala s SER 246 CO 0.74 -0.19 1.64 0.58 1.20 0.00 0.00 173.24 177.22 1ala h VAL 247 N 5.81 1.19 -0.91 4.45 2.07 -1.75 -2.45 116.25 124.67 1ala h VAL 247 Ca -0.18 -0.62 0.09 0.00 0.82 0.00 0.00 66.70 66.81 1ala h VAL 247 Cb 1.12 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.84 1ala h VAL 247 CO 0.11 0.21 0.56 -0.65 0.02 0.00 0.00 177.57 177.82 1ala h PRO 248 N 0.35 0.93 -0.51 1.57 0.11 -1.93 -1.66 132.00 130.85 1ala h PRO 248 Ca 0.10 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.05 1ala h PRO 248 Cb 0.22 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1ala h PRO 248 CO -0.01 0.61 -0.11 0.00 -0.21 0.00 0.00 178.00 178.29 1ala h ALA 249 N 1.46 0.84 -0.11 -0.75 0.00 -1.87 -1.07 119.26 117.77 1ala h ALA 249 Ca 0.42 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ala h ALA 249 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ala h ALA 249 CO -0.22 0.65 0.03 -0.92 0.00 0.00 0.00 179.25 178.79 1ala h TYR 250 N 0.85 0.05 -0.06 0.00 3.20 -0.85 -2.52 116.97 117.64 1ala h TYR 250 Ca 0.14 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.91 1ala h TYR 250 Cb 0.65 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 1ala h TYR 250 CO 0.04 0.03 -0.42 0.74 -1.64 0.00 0.00 178.16 176.91 1ala h PHE 251 N 0.08 0.16 -0.22 -3.82 0.04 -1.27 -1.58 116.94 110.33 1ala h PHE 251 Ca 0.05 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1ala h PHE 251 Cb 0.03 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 1ala h PHE 251 CO -0.11 0.54 0.10 0.00 -0.60 0.00 0.00 178.31 178.25 1ala h ALA 252 N 1.46 0.29 -0.39 2.45 0.00 -0.94 -0.37 119.26 121.75 1ala h ALA 252 Ca 0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1ala h ALA 252 Cb 0.79 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1ala h ALA 252 CO 0.06 -0.14 -0.01 1.49 0.00 0.00 0.00 179.25 180.64 1ala h GLU 253 N 0.22 0.62 -0.37 0.00 4.81 -1.41 0.53 114.58 118.98 1ala h GLU 253 Ca 0.08 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 1ala h GLU 253 Cb 0.13 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1ala h GLU 253 CO -0.01 0.65 0.11 1.15 -0.73 0.00 0.00 179.01 180.18 1ala h THR 254 N 0.59 1.22 -0.36 0.32 2.02 -1.00 -0.46 112.91 115.24 1ala h THR 254 Ca 0.12 -0.72 -0.11 0.00 0.77 0.00 0.00 66.41 66.48 1ala h THR 254 Cb 0.39 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1ala h THR 254 CO 0.02 0.25 -0.19 -0.07 0.37 0.00 0.00 175.52 175.89 1ala h LEU 255 N 0.45 0.79 -0.79 2.58 3.38 -0.67 -2.42 115.31 118.63 1ala h LEU 255 Ca 0.12 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1ala h LEU 255 Cb 0.27 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1ala h LEU 255 CO -0.00 1.03 0.43 0.22 0.09 0.00 0.00 178.44 180.21 1ala h TYR 256 N 0.55 1.10 0.00 1.13 5.03 0.41 -1.78 116.97 123.40 1ala h TYR 256 Ca 0.08 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.36 1ala h TYR 256 Cb 0.74 -0.35 0.00 0.00 1.55 0.00 0.00 36.73 38.67 1ala h TYR 256 CO 0.06 0.77 0.00 0.66 -1.32 0.00 0.00 178.16 178.33 1ala n TYR 257 N -4.41 0.00 1.27 -3.82 4.01 -0.21 -1.78 117.16 112.22 1ala n TYR 257 Ca 0.08 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.96 1ala n TYR 257 Cb 0.10 -0.47 0.60 0.00 -0.31 0.00 0.00 39.34 39.26 1ala n TYR 257 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1ala n SER 258 N -1.47 0.26 0.00 7.72 3.41 -0.67 -4.06 113.62 118.80 1ala n SER 258 Ca 0.06 -0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1ala n SER 258 Cb 0.24 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1ala n SER 258 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1ala n MET 259 N -1.22 2.34 -2.04 4.33 2.81 -1.14 -0.44 117.12 121.76 1ala n MET 259 Ca 0.12 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.59 1ala n MET 259 Cb 0.29 -0.81 -0.03 0.00 -0.71 0.00 0.00 33.22 31.96 1ala n MET 259 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1ala s LYS 260 N -1.39 4.26 0.00 0.03 2.47 -0.73 -4.78 119.74 119.59 1ala s LYS 260 Ca 0.00 2.23 0.00 0.00 -1.56 0.00 0.00 55.97 56.64 1ala s LYS 260 Cb 0.00 -3.25 0.00 0.00 -1.46 0.00 0.00 37.83 33.12 1ala s LYS 260 CO 0.00 -0.55 0.00 0.41 0.16 0.00 0.00 175.35 175.37 1ala n GLY 261 N 3.67 0.30 3.70 5.54 0.00 -1.26 -4.94 105.19 112.20 1ala n GLY 261 Ca 0.13 -1.98 -0.44 0.00 0.00 0.00 0.00 46.02 43.73 1ala n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ala n ALA 262 N 0.80 1.88 -0.13 4.61 0.00 -1.26 -4.75 120.51 121.65 1ala n ALA 262 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1ala n ALA 262 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.06 1ala n ALA 262 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ala n GLY 263 N 2.99 -1.93 3.09 0.00 0.00 -1.26 -5.00 105.19 103.07 1ala n GLY 263 Ca 0.14 -1.37 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 1ala n GLY 263 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ala s THR 264 N 0.00 0.03 -0.98 2.61 2.01 -1.26 -4.65 115.64 113.40 1ala s THR 264 Ca 0.00 -0.24 -0.16 0.00 0.31 0.00 0.00 61.69 61.60 1ala s THR 264 Cb 0.00 -0.34 0.18 0.00 0.01 0.00 0.00 72.50 72.35 1ala s THR 264 CO 0.00 -0.13 1.10 -0.62 -0.69 0.00 0.00 174.62 174.27 1ala s ASP 265 N -0.44 6.83 0.44 3.53 2.15 0.41 -4.84 116.67 124.75 1ala s ASP 265 Ca -0.05 -2.56 0.20 0.00 0.43 0.00 0.00 52.55 50.56 1ala s ASP 265 Cb -0.04 -2.33 1.02 0.00 -0.30 0.00 0.00 42.92 41.27 1ala s ASP 265 CO 0.01 -0.79 1.91 0.44 -0.17 0.00 0.00 175.17 176.57 1ala h ASP 266 N 8.01 0.00 -0.50 -0.34 3.32 -1.98 -1.95 116.42 122.98 1ala h ASP 266 Ca 0.18 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1ala h ASP 266 Cb 0.98 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 1ala h ASP 266 CO 1.03 0.25 0.15 0.44 -1.72 0.00 0.00 179.24 179.40 1ala h ASP 267 N 0.00 0.78 0.46 6.45 3.32 -1.98 -1.72 116.42 123.73 1ala h ASP 267 Ca -0.00 -0.13 -0.31 0.00 0.02 0.00 0.00 57.03 56.61 1ala h ASP 267 Cb 0.56 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.91 1ala h ASP 267 CO 0.03 0.76 -1.45 0.74 -1.72 0.00 0.00 179.24 177.60 1ala h THR 268 N 0.81 1.27 -0.03 0.35 2.02 -1.88 -2.79 112.91 112.67 1ala h THR 268 Ca 0.18 -2.84 0.02 0.00 0.77 0.00 0.00 66.41 64.54 1ala h THR 268 Cb 0.28 2.87 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 1ala h THR 268 CO -0.00 0.84 -0.12 0.25 0.37 0.00 0.00 175.52 176.86 1ala h LEU 269 N 0.09 -0.34 0.05 2.58 5.85 -1.19 -2.63 115.31 119.71 1ala h LEU 269 Ca -0.22 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1ala h LEU 269 Cb 2.04 0.15 0.00 0.00 0.37 0.00 0.00 40.66 43.22 1ala h LEU 269 CO 0.20 -0.16 -0.02 0.40 -0.34 0.00 0.00 178.44 178.51 1ala h ILE 270 N -0.18 1.11 -0.48 4.05 2.04 -1.44 -2.09 117.51 120.52 1ala h ILE 270 Ca 0.05 -0.52 0.09 0.00 1.00 0.00 0.00 64.86 65.48 1ala h ILE 270 Cb 0.25 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 1ala h ILE 270 CO -0.14 0.13 0.03 -0.09 0.00 0.00 0.00 178.15 178.09 1ala h ARG 271 N -0.29 0.15 0.39 2.37 2.43 -1.46 -1.82 114.38 116.15 1ala h ARG 271 Ca -0.01 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1ala h ARG 271 Cb 0.27 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1ala h ARG 271 CO 0.01 0.10 -0.19 0.28 -1.51 0.00 0.00 179.97 178.66 1ala h VAL 272 N 0.15 0.53 -0.45 0.20 2.07 -1.52 -0.76 116.25 116.47 1ala h VAL 272 Ca 0.24 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.32 1ala h VAL 272 Cb 0.35 0.75 -0.09 0.00 -1.52 0.00 0.00 31.29 30.78 1ala h VAL 272 CO -0.37 0.09 -0.17 0.24 0.02 0.00 0.00 177.57 177.37 1ala h MET 273 N -0.87 -0.07 0.56 1.57 2.86 -1.30 -0.29 114.93 117.39 1ala h MET 273 Ca -0.05 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1ala h MET 273 Cb 0.55 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.23 1ala h MET 273 CO 0.09 -0.05 -0.27 0.28 1.06 0.00 0.00 176.91 178.02 1ala h VAL 274 N -0.07 0.29 -0.87 -2.22 2.07 -1.41 -2.32 116.25 111.71 1ala h VAL 274 Ca 0.22 -0.37 0.12 0.00 0.82 0.00 0.00 66.70 67.49 1ala h VAL 274 Cb 0.41 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 1ala h VAL 274 CO -0.51 0.04 0.56 0.77 0.02 0.00 0.00 177.57 178.46 1ala h SER 275 N -1.04 0.72 -0.29 0.57 4.64 -0.88 -2.24 113.55 115.03 1ala h SER 275 Ca -0.08 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1ala h SER 275 Cb 0.65 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1ala h SER 275 CO 0.13 0.40 0.00 0.54 -0.87 0.00 0.00 176.83 177.03 1ala n ARG 276 N -4.54 2.22 0.05 4.77 5.12 -0.14 -4.51 116.66 119.63 1ala n ARG 276 Ca 0.16 -2.05 0.16 0.00 -1.93 0.00 0.00 57.85 54.19 1ala n ARG 276 Cb 0.38 -1.43 0.65 0.00 -1.16 0.00 0.00 32.46 30.89 1ala n ARG 276 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1ala h SER 277 N 3.81 0.06 -0.21 0.55 4.64 -0.81 0.47 113.55 122.06 1ala h SER 277 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ala h SER 277 Cb 0.87 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1ala h SER 277 CO 0.00 0.04 0.00 -0.62 -0.87 0.00 0.00 176.83 175.38 1ala n GLU 278 N -4.43 2.74 0.01 4.77 1.02 -1.26 -1.07 120.64 122.41 1ala n GLU 278 Ca 0.07 -2.17 -0.00 0.00 -0.02 0.00 0.00 57.16 55.04 1ala n GLU 278 Cb 0.44 -1.37 -0.00 0.00 -0.02 0.00 0.00 31.44 30.50 1ala n GLU 278 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1ala n ILE 279 N -0.16 0.27 -1.89 -3.67 5.41 -0.79 -4.65 119.36 113.87 1ala n ILE 279 Ca 0.12 0.12 0.01 0.00 1.00 0.00 0.00 62.75 63.99 1ala n ILE 279 Cb 0.52 -1.17 0.02 0.00 -0.71 0.00 0.00 39.64 38.29 1ala n ILE 279 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1ala n ASP 280 N -2.73 0.28 0.19 4.38 5.68 -0.95 -3.13 116.55 120.27 1ala n ASP 280 Ca -0.00 -2.13 0.17 0.00 -0.50 0.00 0.00 54.79 52.32 1ala n ASP 280 Cb 0.01 -0.23 0.80 0.00 -1.14 0.00 0.00 41.12 40.56 1ala n ASP 280 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1ala h LEU 281 N 0.01 0.00 -0.08 -2.12 5.85 -0.73 -0.66 115.31 117.58 1ala h LEU 281 Ca -0.00 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.49 1ala h LEU 281 Cb 1.36 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1ala h LEU 281 CO 0.00 0.00 -1.04 0.25 -0.34 0.00 0.00 178.44 177.31 1ala h LEU 282 N 0.00 0.34 -0.52 2.25 5.85 -1.65 -2.60 115.31 118.98 1ala h LEU 282 Ca 0.09 -0.31 -0.15 0.00 0.84 0.00 0.00 57.88 58.35 1ala h LEU 282 Cb 0.47 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1ala h LEU 282 CO -0.00 1.17 -0.45 0.44 -0.34 0.00 0.00 178.44 179.26 1ala h ASP 283 N 0.10 0.75 -0.26 1.25 3.32 -1.29 -2.36 116.42 117.92 1ala h ASP 283 Ca -0.08 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 1ala h ASP 283 Cb 1.72 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 41.05 1ala h ASP 283 CO 0.16 1.09 0.16 0.40 -1.72 0.00 0.00 179.24 179.34 1ala h ILE 284 N 0.56 1.09 -0.88 0.35 2.04 -1.24 -0.71 117.51 118.72 1ala h ILE 284 Ca 0.03 -0.20 0.10 0.00 1.00 0.00 0.00 64.86 65.80 1ala h ILE 284 Cb 1.00 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.76 1ala h ILE 284 CO 0.09 0.09 0.57 0.03 0.00 0.00 0.00 178.15 178.93 1ala h ARG 285 N 0.34 0.82 -0.50 2.37 3.08 -1.34 -1.26 114.38 117.89 1ala h ARG 285 Ca 0.10 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 1ala h ARG 285 Cb -0.00 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1ala h ARG 285 CO -0.02 0.54 -0.13 0.45 -1.07 0.00 0.00 179.97 179.75 1ala h HIS 286 N 0.85 1.09 -0.08 3.04 3.86 -0.80 -2.62 115.15 120.49 1ala h HIS 286 Ca 0.41 -0.24 -0.13 0.00 -1.16 0.00 0.00 60.37 59.25 1ala h HIS 286 Cb 0.45 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 1ala h HIS 286 CO -0.00 1.04 -0.55 0.93 0.86 0.00 0.00 177.93 180.21 1ala h GLU 287 N 0.83 0.22 -0.01 2.45 4.39 -0.79 -2.61 114.58 119.06 1ala h GLU 287 Ca 0.13 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1ala h GLU 287 Cb 0.69 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1ala h GLU 287 CO 0.05 0.71 0.00 0.35 -1.16 0.00 0.00 179.01 178.96 1ala h PHE 288 N 0.17 0.01 -0.42 4.33 3.04 -1.20 0.48 116.94 123.35 1ala h PHE 288 Ca 0.00 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.89 1ala h PHE 288 Cb 1.02 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.51 1ala h PHE 288 CO 0.02 0.24 0.05 -0.09 -2.02 0.00 0.00 178.31 176.50 1ala h ARG 289 N -0.22 0.71 0.14 1.11 9.65 -1.44 1.91 114.38 126.25 1ala h ARG 289 Ca 0.00 -0.20 -0.01 0.00 -1.10 0.00 0.00 59.98 58.67 1ala h ARG 289 Cb 0.23 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 1ala h ARG 289 CO 0.00 0.76 -0.07 1.57 2.80 0.00 0.00 179.97 185.04 1ala h LYS 290 N 0.56 -0.18 0.03 0.20 2.10 -1.44 -2.26 116.57 115.58 1ala h LYS 290 Ca 0.13 0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.79 1ala h LYS 290 Cb 0.41 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 1ala h LYS 290 CO 0.01 0.19 -0.01 -0.91 -2.00 0.00 0.00 179.45 176.72 1ala h ASN 291 N -0.58 -0.03 0.86 7.07 -0.26 -0.94 -3.37 115.58 118.34 1ala h ASN 291 Ca -0.02 -0.56 0.00 0.00 -0.56 0.00 0.00 56.30 55.16 1ala h ASN 291 Cb 0.45 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 1ala h ASN 291 CO 0.03 0.56 -0.44 0.49 -1.06 0.00 0.00 177.43 177.02 1ala n PHE 292 N -4.82 0.39 -0.93 1.19 3.72 0.65 -4.96 117.46 112.71 1ala n PHE 292 Ca -0.09 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1ala n PHE 292 Cb 0.30 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 1ala n PHE 292 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ala n ALA 293 N -1.70 0.00 -2.34 4.37 0.00 -0.85 -4.96 120.51 115.03 1ala n ALA 293 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.31 1ala n ALA 293 Cb 0.40 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.12 1ala n ALA 293 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ala s LYS 294 N -0.78 1.34 0.28 0.00 1.02 -1.26 -5.04 119.74 115.30 1ala s LYS 294 Ca 0.00 -1.66 0.04 0.00 0.02 0.00 0.00 55.97 54.37 1ala s LYS 294 Cb 0.00 -0.79 -0.03 0.00 -0.52 0.00 0.00 37.83 36.49 1ala s LYS 294 CO 0.00 -0.01 0.43 -1.54 -0.92 0.00 0.00 175.35 173.30 1ala s SER 295 N -3.32 6.24 0.07 2.83 1.04 -1.26 -3.23 113.70 116.07 1ala s SER 295 Ca 0.26 0.11 -0.23 0.00 0.48 0.00 0.00 55.95 56.58 1ala s SER 295 Cb 0.04 -1.78 -0.15 0.00 0.10 0.00 0.00 66.02 64.23 1ala s SER 295 CO 0.08 -0.19 1.62 0.25 0.98 0.00 0.00 173.24 175.98 1ala h LEU 296 N 1.01 0.04 -0.60 2.42 5.85 -1.89 -2.62 115.31 119.53 1ala h LEU 296 Ca -0.50 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.18 1ala h LEU 296 Cb 1.23 -0.01 -0.11 0.00 0.37 0.00 0.00 40.66 42.14 1ala h LEU 296 CO 0.60 0.16 -0.39 0.22 -0.34 0.00 0.00 178.44 178.69 1ala h TYR 297 N -0.08 -1.13 -0.47 1.25 5.03 -1.95 -1.76 116.97 117.87 1ala h TYR 297 Ca 0.01 0.08 -0.08 0.00 2.58 0.00 0.00 58.73 61.32 1ala h TYR 297 Cb 0.13 0.58 -0.02 0.00 1.55 0.00 0.00 36.73 38.97 1ala h TYR 297 CO -0.03 -0.41 -0.02 -0.56 -1.32 0.00 0.00 178.16 175.83 1ala h GLN 298 N -0.19 0.79 -0.67 1.82 3.07 -1.89 0.26 115.11 118.30 1ala h GLN 298 Ca 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 58.65 58.71 1ala h GLN 298 Cb 0.56 -0.09 -0.03 0.00 0.08 0.00 0.00 27.48 28.00 1ala h GLN 298 CO -0.69 0.81 0.34 1.98 0.09 0.00 0.00 178.83 181.36 1ala h MET 299 N 0.74 0.95 -0.34 0.06 4.05 -0.97 -2.83 114.93 116.59 1ala h MET 299 Ca 0.14 -0.13 -0.11 0.00 -0.28 0.00 0.00 59.70 59.32 1ala h MET 299 Cb 0.47 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.08 1ala h MET 299 CO 0.02 0.74 -0.26 0.82 0.23 0.00 0.00 176.91 178.47 1ala h ILE 300 N 0.92 1.27 -0.90 1.77 2.04 -1.09 -1.52 117.51 120.01 1ala h ILE 300 Ca 0.23 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 1ala h ILE 300 Cb 0.09 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 1ala h ILE 300 CO -0.03 0.44 0.54 1.56 0.00 0.00 0.00 178.15 180.67 1ala h GLN 301 N 0.59 1.22 0.00 2.37 4.20 -0.71 -2.59 115.11 120.18 1ala h GLN 301 Ca 0.08 -0.11 -0.18 0.00 0.06 0.00 0.00 58.65 58.50 1ala h GLN 301 Cb 0.75 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1ala h GLN 301 CO 0.06 0.85 -0.86 0.87 -0.67 0.00 0.00 178.83 179.08 1ala h LYS 302 N 1.24 0.00 0.00 1.46 1.57 -1.48 -3.37 116.57 115.99 1ala h LYS 302 Ca 0.32 -0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.85 1ala h LYS 302 Cb -0.05 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 1ala h LYS 302 CO -0.06 0.86 -1.55 -0.44 -0.57 0.00 0.00 179.45 177.69 1ala h ASP 303 N 0.00 0.00 -1.67 0.86 5.19 -1.19 -3.48 116.42 116.13 1ala h ASP 303 Ca -0.01 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.82 1ala h ASP 303 Cb 1.53 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 40.94 1ala h ASP 303 CO 0.11 0.86 -0.54 0.42 -3.12 0.00 0.00 179.24 176.98 1ala s THR 304 N -2.71 2.31 0.06 0.35 -4.23 -0.99 -4.87 115.64 105.57 1ala s THR 304 Ca -0.04 -1.80 -0.03 0.00 -1.18 0.00 0.00 61.69 58.64 1ala s THR 304 Cb 0.08 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.93 1ala s THR 304 CO 0.82 -0.04 0.02 -0.94 -0.54 0.00 0.00 174.62 173.94 1ala s SER 305 N -3.83 0.40 0.80 3.99 1.04 -1.26 -4.81 113.70 110.02 1ala s SER 305 Ca 0.39 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1ala s SER 305 Cb 0.04 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1ala s SER 305 CO 0.21 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.42 1ala n GLY 306 N 0.10 1.30 0.24 7.32 0.00 -1.26 -2.79 105.19 110.10 1ala n GLY 306 Ca -0.14 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.29 1ala n GLY 306 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ala h ASP 307 N 9.12 0.09 -0.43 1.61 3.32 -2.00 0.26 116.42 128.39 1ala h ASP 307 Ca 0.00 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1ala h ASP 307 Cb 0.00 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1ala h ASP 307 CO 0.00 0.23 0.11 0.22 -1.72 0.00 0.00 179.24 178.08 1ala h TYR 308 N 0.10 0.73 -0.16 4.55 3.20 -1.94 -2.29 116.97 121.16 1ala h TYR 308 Ca 0.02 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.75 1ala h TYR 308 Cb 0.28 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.34 1ala h TYR 308 CO 0.00 0.68 -0.12 -0.09 -1.64 0.00 0.00 178.16 177.00 1ala h ARG 309 N 0.57 0.36 -0.29 1.82 2.43 -0.95 -2.26 114.38 116.05 1ala h ARG 309 Ca 0.14 -0.18 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 1ala h ARG 309 Cb 0.32 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1ala h ARG 309 CO 0.00 0.71 -0.11 0.87 -1.51 0.00 0.00 179.97 179.94 1ala h LYS 310 N 0.01 0.49 -0.25 0.20 1.57 -0.53 -1.82 116.57 116.25 1ala h LYS 310 Ca 0.03 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1ala h LYS 310 Cb 0.62 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1ala h LYS 310 CO 0.03 0.60 -0.29 0.00 -0.57 0.00 0.00 179.45 179.22 1ala h ALA 311 N 1.44 0.37 -0.58 3.86 0.00 -1.38 -1.89 119.26 121.08 1ala h ALA 311 Ca 0.09 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ala h ALA 311 Cb 0.46 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1ala h ALA 311 CO 0.03 0.39 0.34 1.25 0.00 0.00 0.00 179.25 181.25 1ala h LEU 312 N 0.35 0.70 -0.70 0.00 5.85 -1.33 -0.37 115.31 119.81 1ala h LEU 312 Ca 0.03 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 1ala h LEU 312 Cb 0.86 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 1ala h LEU 312 CO 0.07 0.56 0.03 -0.07 -0.34 0.00 0.00 178.44 178.69 1ala h LEU 313 N 0.78 1.00 -0.56 2.25 3.38 -1.38 0.86 115.31 121.64 1ala h LEU 313 Ca 0.21 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1ala h LEU 313 Cb -0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1ala h LEU 313 CO -0.04 1.04 -0.01 -0.07 0.09 0.00 0.00 178.44 179.45 1ala h LEU 314 N 0.96 0.97 -0.77 1.67 3.38 -0.94 -1.85 115.31 118.73 1ala h LEU 314 Ca 0.18 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1ala h LEU 314 Cb 0.50 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1ala h LEU 314 CO 0.02 1.05 0.51 -0.07 0.09 0.00 0.00 178.44 180.04 1ala h LEU 315 N 0.87 0.87 -0.25 1.67 3.38 -0.70 -3.17 115.31 117.97 1ala h LEU 315 Ca 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ala h LEU 315 Cb 0.55 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1ala h LEU 315 CO 0.03 0.62 0.14 0.00 0.09 0.00 0.00 178.44 179.32 1ala n GLY 317 N -0.96 2.65 0.00 0.00 0.00 -0.71 -4.94 105.19 101.23 1ala n GLY 317 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1ala n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93